data_SASDBG9_MAIN # _sas_result.id 495 _sas_result.SASBDB_code SASDBG9 _sas_result.experimental_MW 29.700 _sas_result.experimental_MW_error . _sas_result.MW_standard 29.000 _sas_result.MW_standard_error 2.000 _sas_result.MW_Porod 27.000 _sas_result.MW_Porod_error . _sas_result.I0_from_PR 29.2000000000 _sas_result.I0_from_PR_error 0.1000000000 _sas_result.I0_from_Guinier 28.9000000000 _sas_result.I0_from_Guinier_error 0.1000000000 _sas_result.Rg_from_PR 2.380 _sas_result.Rg_from_PR_error 0.020 _sas_result.Rg_from_Guinier 2.280 _sas_result.Rg_from_Guinier_error 0.030 _sas_result.D_max 8.90 _sas_result.Porod_volume 44.40 _sas_result.Porod_volume_error . _sas_result.estimated_volume . _sas_result.estimated_volume_error . _sas_result.estimated_volume_method . _sas_result.Guinier_point_min 29 _sas_result.Guinier_point_max 114 _sas_result.type_of_curve merged _sas_result.standard . _sas_result.Dmax_error 0.30 _sas_result.comments "TupA measured in the presence of tungstate, fitted against the holo-form model." # _sas_scan.title "TupA measured in the presence of tungstate" _sas_scan.detc_id 16 _sas_scan.id 495 _sas_scan.measurement_date 2014-06-21 _sas_scan.storage_temperature 4.0 _sas_scan.cell_temperature 4.9 _sas_scan.exposure_time 1.000 _sas_scan.number_of_frames 10 _sas_scan.unit 1/A _sas_scan.qmin 0.0032 _sas_scan.qmax 0.4967 _sas_scan.sample_id 453 _sas_scan.result_id 495 _sas_scan.beam_id 10 # _sas_beam.id 10 _sas_beam.instrument_name "ESRF BM29" _sas_beam.instrument_city Grenoble _sas_beam.instrument_country France _sas_beam.shape . _sas_beam.type_of_source "X-ray synchrotron" _sas_beam.radiation_wavelength 0.099000 _sas_beam.dist_spec_to_detc 2.86700 # _sas_detc.id 16 _sas_detc.name "Pilatus 1M" _sas_detc.type . _sas_detc.pixsize_x . # _sas_sample.id 453 _sas_sample.name "ABC transporter periplasmic substrate-binding protein TupA measured in the presence of tungstate" _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 0.80-12.00 _sas_sample.concentration_method . _sas_sample.entity_id 584 # _sas_buffer.id 272 _sas_buffer.name "5 mM Tris-HCl" _sas_buffer.concentration . _sas_buffer.unit . _sas_buffer.pK . _sas_buffer.pH 7.600 _sas_buffer.comment . _sas_buffer.composition . _sas_buffer.sample_id 453 # _entity.id 584 _entity.type protein _entity.pdbx_description "ABC transporter periplasmic substrate-binding protein" _entity.formula_weight 29.660 _entity.pdbx_number_of_molecules 1 # _entity_name_com.entity_id 584 _entity_name_com.name . # _entity_poly.entity_id 584 _entity_poly.pdbx_seq_one_letter_code ;MAHHHHHHVDDDDKMLEVLFQGPEAPVLMMATTTSTDNTGLLDDLAPQFT KDTGIELRWTAVGTGKALKMGENCDVDILLVHAPAAEKAFVDAGFGTART QLMYNDFVIIGPAADPAGVKGMTVAAALGKIAADNAVFVSRGDNSGTHKM EKSLWKQIEGPSPEKEAWYVQTGQGMLRTINVAAEKGGYTMTDRGTYIKY EASMDGNPPLKILVEGDKILFNQYSAIPVNPAHCPKVKKDLADKFVNWMA SPATQKTIGDFKLMGKALFTPNAE ; # _entity_src_gen.entity_id 584 _entity_src_gen.gene_src_common_name "Desulfovibrio alaskensis (strain G20)" # _struct_ref.id 1 _struct_ref.entity_id 584 _struct_ref.db_name UniProt _struct_ref.db_code Q316W1 _struct_ref.details http://www.uniprot.org/uniprot/Q316W1 # _pdbx_contact_author.id 96 _pdbx_contact_author.name_first Alejandro _pdbx_contact_author.name_last Panjkovich _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 3.204772E-03 2.404040E+01 1.631254E+01 495 2 3.678418E-03 2.624424E+01 5.948519E+00 495 3 4.152063E-03 3.782788E+01 4.283829E+00 495 4 4.625709E-03 4.188935E+01 3.309546E+00 495 5 5.099355E-03 4.418084E+01 2.649289E+00 495 6 5.573000E-03 4.197657E+01 2.170312E+00 495 7 6.046646E-03 4.018174E+01 1.823740E+00 495 8 6.520292E-03 3.955905E+01 1.576151E+00 495 9 6.993937E-03 3.701585E+01 1.382884E+00 495 10 7.467583E-03 3.594286E+01 1.231230E+00 495 11 7.941229E-03 3.633168E+01 1.115593E+00 495 12 8.414874E-03 3.504702E+01 1.015134E+00 495 13 8.888520E-03 3.372235E+01 9.257259E-01 495 14 9.362166E-03 3.203733E+01 8.504686E-01 495 15 9.835811E-03 3.121522E+01 7.925935E-01 495 16 1.030946E-02 3.143027E+01 7.450647E-01 495 17 1.078310E-02 3.139959E+01 7.020519E-01 495 18 1.125675E-02 3.214924E+01 6.644057E-01 495 19 1.173039E-02 3.123090E+01 6.307497E-01 495 20 1.220404E-02 3.056973E+01 6.033058E-01 495 21 1.267769E-02 2.982238E+01 5.789551E-01 495 22 1.315133E-02 2.906174E+01 5.550921E-01 495 23 1.362498E-02 2.912560E+01 5.368564E-01 495 24 1.409862E-02 2.889522E+01 5.188443E-01 495 25 1.457227E-02 2.905074E+01 5.030798E-01 495 26 1.504591E-02 2.915235E+01 4.878152E-01 495 27 1.551956E-02 2.875159E+01 4.748358E-01 495 28 1.599320E-02 2.860388E+01 4.627808E-01 495 29 1.646685E-02 2.786604E+01 4.510261E-01 495 30 1.694050E-02 2.787389E+01 4.405906E-01 495 31 1.741414E-02 2.756021E+01 4.311228E-01 495 32 1.788779E-02 2.706677E+01 4.211067E-01 495 33 1.836143E-02 2.715609E+01 4.131903E-01 495 34 1.883508E-02 2.703041E+01 4.052453E-01 495 35 1.930872E-02 2.699481E+01 3.983876E-01 495 36 1.978237E-02 2.728579E+01 3.925715E-01 495 37 2.025602E-02 2.711867E+01 3.859866E-01 495 38 2.072966E-02 2.654883E+01 3.787715E-01 495 39 2.120331E-02 2.685741E+01 3.731716E-01 495 40 2.167695E-02 2.708595E+01 3.686977E-01 495 41 2.215060E-02 2.676228E+01 3.628746E-01 495 42 2.262424E-02 2.680409E+01 3.576127E-01 495 43 2.309789E-02 2.636915E+01 3.519829E-01 495 44 2.357154E-02 2.597620E+01 3.471570E-01 495 45 2.404518E-02 2.613908E+01 3.431808E-01 495 46 2.451883E-02 2.599959E+01 3.389567E-01 495 47 2.499247E-02 2.605190E+01 3.347791E-01 495 48 2.546612E-02 2.604366E+01 3.309327E-01 495 49 2.593976E-02 2.553796E+01 3.270484E-01 495 50 2.641341E-02 2.562711E+01 3.239052E-01 495 51 2.688706E-02 2.569543E+01 3.203666E-01 495 52 2.736070E-02 2.581468E+01 3.172264E-01 495 53 2.783435E-02 2.537871E+01 3.133829E-01 495 54 2.830799E-02 2.504040E+01 3.099235E-01 495 55 2.878164E-02 2.519368E+01 3.075085E-01 495 56 2.925528E-02 2.500308E+01 3.071391E-01 495 57 2.972893E-02 2.478296E+01 3.096310E-01 495 58 3.020257E-02 2.452796E+01 3.108880E-01 495 59 3.067622E-02 2.472684E+01 3.111656E-01 495 60 3.114987E-02 2.469044E+01 3.107597E-01 495 61 3.162351E-02 2.450558E+01 3.099020E-01 495 62 3.209716E-02 2.455817E+01 3.090119E-01 495 63 3.257080E-02 2.436155E+01 3.078728E-01 495 64 3.304445E-02 2.358366E+01 3.063297E-01 495 65 3.351809E-02 2.339529E+01 3.057487E-01 495 66 3.399174E-02 2.314604E+01 3.043175E-01 495 67 3.446539E-02 2.327988E+01 3.031168E-01 495 68 3.493903E-02 2.334644E+01 3.020825E-01 495 69 3.541268E-02 2.313119E+01 3.011131E-01 495 70 3.588632E-02 2.293997E+01 3.009271E-01 495 71 3.635997E-02 2.261958E+01 3.048990E-01 495 72 3.683361E-02 2.233045E+01 3.087878E-01 495 73 3.730726E-02 2.248634E+01 3.120822E-01 495 74 3.778091E-02 2.284834E+01 3.154677E-01 495 75 3.825455E-02 2.224410E+01 3.165579E-01 495 76 3.872820E-02 2.187722E+01 3.182937E-01 495 77 3.920184E-02 2.210130E+01 3.203852E-01 495 78 3.967549E-02 2.191609E+01 3.207052E-01 495 79 4.014913E-02 2.175182E+01 3.208598E-01 495 80 4.062278E-02 2.152743E+01 3.216893E-01 495 81 4.109643E-02 2.134297E+01 3.226935E-01 495 82 4.157007E-02 2.138489E+01 3.239507E-01 495 83 4.204372E-02 2.094421E+01 3.236863E-01 495 84 4.251736E-02 2.081565E+01 3.243074E-01 495 85 4.299101E-02 2.075002E+01 3.250653E-01 495 86 4.346465E-02 2.072863E+01 3.248164E-01 495 87 4.393830E-02 2.082470E+01 3.250385E-01 495 88 4.441195E-02 2.102943E+01 3.261718E-01 495 89 4.488559E-02 2.053393E+01 3.302613E-01 495 90 4.535924E-02 2.022824E+01 3.392550E-01 495 91 4.583288E-02 2.007437E+01 3.452796E-01 495 92 4.630653E-02 1.996931E+01 3.500871E-01 495 93 4.678017E-02 1.968324E+01 3.536610E-01 495 94 4.725382E-02 1.979699E+01 3.582390E-01 495 95 4.772746E-02 1.969020E+01 3.617870E-01 495 96 4.820111E-02 1.906787E+01 3.645017E-01 495 97 4.867476E-02 1.905380E+01 3.674530E-01 495 98 4.914840E-02 1.917949E+01 3.712935E-01 495 99 4.962205E-02 1.917633E+01 3.742918E-01 495 100 5.009569E-02 1.879283E+01 3.757427E-01 495 101 5.056934E-02 1.867453E+01 3.786440E-01 495 102 5.104298E-02 1.854872E+01 3.808642E-01 495 103 5.151663E-02 1.871688E+01 3.711110E-01 495 104 5.199028E-02 1.852467E+01 3.594718E-01 495 105 5.246392E-02 1.793490E+01 3.518698E-01 495 106 5.293757E-02 1.766378E+01 3.469138E-01 495 107 5.341121E-02 1.777238E+01 3.435839E-01 495 108 5.388486E-02 1.791832E+01 3.401174E-01 495 109 5.435850E-02 1.732031E+01 3.373361E-01 495 110 5.483215E-02 1.705943E+01 3.346614E-01 495 111 5.530580E-02 1.725665E+01 3.325871E-01 495 112 5.577944E-02 1.667284E+01 3.296694E-01 495 113 5.625309E-02 1.644948E+01 3.276692E-01 495 114 5.672673E-02 1.646344E+01 3.259800E-01 495 115 5.720038E-02 1.670749E+01 3.246361E-01 495 116 5.767402E-02 1.675421E+01 3.225899E-01 495 117 5.814767E-02 1.634537E+01 3.196276E-01 495 118 5.862132E-02 1.594380E+01 3.163819E-01 495 119 5.909496E-02 1.588842E+01 3.145337E-01 495 120 5.956861E-02 1.613440E+01 3.123639E-01 495 121 6.004225E-02 1.598498E+01 3.094817E-01 495 122 6.051590E-02 1.573043E+01 3.067998E-01 495 123 6.098954E-02 1.546145E+01 3.045965E-01 495 124 6.146319E-02 1.533390E+01 3.024518E-01 495 125 6.193683E-02 1.535047E+01 3.006135E-01 495 126 6.241048E-02 1.518404E+01 2.983729E-01 495 127 6.288413E-02 1.502067E+01 2.968434E-01 495 128 6.335777E-02 1.466005E+01 2.948215E-01 495 129 6.383142E-02 1.443914E+01 2.934578E-01 495 130 6.430506E-02 1.425008E+01 2.925917E-01 495 131 6.477871E-02 1.415796E+01 2.916067E-01 495 132 6.525235E-02 1.457388E+01 2.911858E-01 495 133 6.572600E-02 1.442999E+01 2.902732E-01 495 134 6.619965E-02 1.425066E+01 2.891961E-01 495 135 6.667329E-02 1.375072E+01 2.879245E-01 495 136 6.714694E-02 1.375542E+01 2.873407E-01 495 137 6.762058E-02 1.348629E+01 2.859747E-01 495 138 6.809423E-02 1.307054E+01 2.845970E-01 495 139 6.856787E-02 1.294347E+01 2.839400E-01 495 140 6.904152E-02 1.291653E+01 2.830653E-01 495 141 6.951517E-02 1.290627E+01 2.821548E-01 495 142 6.998881E-02 1.316638E+01 2.815260E-01 495 143 7.046246E-02 1.287499E+01 2.804583E-01 495 144 7.093610E-02 1.265884E+01 2.793309E-01 495 145 7.140975E-02 1.248361E+01 2.783925E-01 495 146 7.188339E-02 1.214936E+01 2.774874E-01 495 147 7.235704E-02 1.222297E+01 2.774374E-01 495 148 7.283069E-02 1.232886E+01 2.766240E-01 495 149 7.330433E-02 1.205419E+01 1.453538E-01 495 150 7.377798E-02 1.193481E+01 1.381533E-01 495 151 7.425162E-02 1.194696E+01 1.377064E-01 495 152 7.472527E-02 1.182488E+01 1.373781E-01 495 153 7.519891E-02 1.166880E+01 1.368066E-01 495 154 7.567256E-02 1.149901E+01 1.363936E-01 495 155 7.614620E-02 1.126527E+01 1.358493E-01 495 156 7.661985E-02 1.108427E+01 1.350328E-01 495 157 7.709350E-02 1.116202E+01 1.349504E-01 495 158 7.756714E-02 1.112978E+01 1.346400E-01 495 159 7.804079E-02 1.086726E+01 1.339056E-01 495 160 7.851443E-02 1.074100E+01 1.337101E-01 495 161 7.898808E-02 1.069296E+01 1.333697E-01 495 162 7.946172E-02 1.065067E+01 1.331794E-01 495 163 7.993537E-02 1.046958E+01 1.327569E-01 495 164 8.040902E-02 1.030478E+01 1.322210E-01 495 165 8.088266E-02 1.017836E+01 1.317545E-01 495 166 8.135631E-02 1.016250E+01 1.314837E-01 495 167 8.182995E-02 9.933820E+00 1.310032E-01 495 168 8.230360E-02 9.996914E+00 1.309328E-01 495 169 8.277724E-02 9.767336E+00 1.301505E-01 495 170 8.325089E-02 9.664955E+00 1.297832E-01 495 171 8.372454E-02 9.512580E+00 1.292932E-01 495 172 8.419818E-02 9.424019E+00 1.288193E-01 495 173 8.467183E-02 9.458548E+00 1.286225E-01 495 174 8.514547E-02 9.159578E+00 1.280504E-01 495 175 8.561912E-02 9.057263E+00 1.279428E-01 495 176 8.609276E-02 9.035224E+00 1.277151E-01 495 177 8.656641E-02 8.974996E+00 1.271379E-01 495 178 8.704006E-02 8.952831E+00 1.268038E-01 495 179 8.751370E-02 9.004434E+00 1.267214E-01 495 180 8.798735E-02 8.905751E+00 1.263686E-01 495 181 8.846099E-02 8.770372E+00 1.261129E-01 495 182 8.893464E-02 8.564953E+00 1.255388E-01 495 183 8.940828E-02 8.389463E+00 1.252915E-01 495 184 8.988193E-02 8.216769E+00 1.248900E-01 495 185 9.035557E-02 8.234196E+00 1.246623E-01 495 186 9.082922E-02 8.021364E+00 1.239713E-01 495 187 9.130287E-02 8.080263E+00 1.238928E-01 495 188 9.177651E-02 8.018259E+00 1.234557E-01 495 189 9.225016E-02 7.917720E+00 1.231815E-01 495 190 9.272380E-02 7.751325E+00 1.227477E-01 495 191 9.319745E-02 7.610745E+00 1.222946E-01 495 192 9.367109E-02 7.607401E+00 1.220324E-01 495 193 9.414474E-02 7.589020E+00 1.219355E-01 495 194 9.461839E-02 7.340330E+00 1.214052E-01 495 195 9.509203E-02 7.313771E+00 1.208104E-01 495 196 9.556568E-02 7.344027E+00 1.205540E-01 495 197 9.603932E-02 7.277969E+00 1.203064E-01 495 198 9.651297E-02 7.114933E+00 1.200652E-01 495 199 9.698661E-02 6.846387E+00 1.197272E-01 495 200 9.746026E-02 6.726189E+00 1.194930E-01 495 201 9.793391E-02 6.770895E+00 1.191990E-01 495 202 9.840755E-02 6.808127E+00 1.189432E-01 495 203 9.888120E-02 6.565390E+00 1.186612E-01 495 204 9.935484E-02 6.596574E+00 1.183536E-01 495 205 9.982849E-02 6.485917E+00 1.180678E-01 495 206 1.003021E-01 6.490279E+00 1.179023E-01 495 207 1.007758E-01 6.262338E+00 1.174584E-01 495 208 1.012494E-01 6.173363E+00 1.170658E-01 495 209 1.017231E-01 6.146478E+00 1.168426E-01 495 210 1.021967E-01 5.964650E+00 1.163023E-01 495 211 1.026704E-01 6.040349E+00 1.163993E-01 495 212 1.031440E-01 5.995010E+00 1.159722E-01 495 213 1.036177E-01 5.940243E+00 1.156258E-01 495 214 1.040913E-01 5.773942E+00 1.152215E-01 495 215 1.045649E-01 5.805418E+00 1.150530E-01 495 216 1.050386E-01 5.747205E+00 1.149456E-01 495 217 1.055122E-01 5.567395E+00 1.144614E-01 495 218 1.059859E-01 5.431540E+00 1.142276E-01 495 219 1.064595E-01 5.545084E+00 1.140703E-01 495 220 1.069332E-01 5.376367E+00 1.137542E-01 495 221 1.074068E-01 5.294825E+00 1.135375E-01 495 222 1.078805E-01 5.220474E+00 1.133269E-01 495 223 1.083541E-01 5.172746E+00 1.130589E-01 495 224 1.088278E-01 5.033231E+00 1.126510E-01 495 225 1.093014E-01 4.956784E+00 1.121707E-01 495 226 1.097750E-01 4.979807E+00 1.121130E-01 495 227 1.102487E-01 4.966004E+00 1.121113E-01 495 228 1.107223E-01 4.856057E+00 1.116261E-01 495 229 1.111960E-01 4.811517E+00 1.111681E-01 495 230 1.116696E-01 4.754338E+00 1.112071E-01 495 231 1.121433E-01 4.699395E+00 1.112452E-01 495 232 1.126169E-01 4.674108E+00 1.108930E-01 495 233 1.130906E-01 4.547385E+00 1.104230E-01 495 234 1.135642E-01 4.513750E+00 1.104640E-01 495 235 1.140379E-01 4.514307E+00 1.102210E-01 495 236 1.145115E-01 4.489408E+00 1.099652E-01 495 237 1.149851E-01 4.295784E+00 1.095047E-01 495 238 1.154588E-01 4.230163E+00 1.090883E-01 495 239 1.159324E-01 4.263220E+00 1.088181E-01 495 240 1.164061E-01 4.229481E+00 1.086277E-01 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1.202852E-02 495 815 3.887523E-01 1.925016E-01 1.205409E-02 495 816 3.892260E-01 2.040024E-01 1.211515E-02 495 817 3.896996E-01 2.231707E-01 1.217694E-02 495 818 3.901733E-01 2.184750E-01 1.222721E-02 495 819 3.906469E-01 2.063887E-01 1.224471E-02 495 820 3.911206E-01 1.993852E-01 1.228088E-02 495 821 3.915942E-01 1.962028E-01 1.232189E-02 495 822 3.920679E-01 1.740854E-01 1.234965E-02 495 823 3.925415E-01 1.873110E-01 1.239171E-02 495 824 3.930152E-01 1.933100E-01 1.244602E-02 495 825 3.934888E-01 2.034318E-01 1.249843E-02 495 826 3.939624E-01 2.081164E-01 1.253817E-02 495 827 3.944361E-01 2.032490E-01 1.255069E-02 495 828 3.949097E-01 2.128893E-01 1.255904E-02 495 829 3.953834E-01 2.043510E-01 1.258470E-02 495 830 3.958570E-01 1.842218E-01 1.254242E-02 495 831 3.963307E-01 1.812255E-01 1.252859E-02 495 832 3.968043E-01 1.909979E-01 1.253554E-02 495 833 3.972780E-01 2.007135E-01 1.255817E-02 495 834 3.977516E-01 1.935972E-01 1.258227E-02 495 835 3.982253E-01 1.835082E-01 1.261548E-02 495 836 3.986989E-01 1.795114E-01 1.265321E-02 495 837 3.991726E-01 1.864059E-01 1.268941E-02 495 838 3.996462E-01 1.821045E-01 1.271782E-02 495 839 4.001198E-01 1.710073E-01 1.277472E-02 495 840 4.005935E-01 1.901340E-01 1.284948E-02 495 841 4.010671E-01 1.996793E-01 1.289368E-02 495 842 4.015408E-01 2.012106E-01 1.294021E-02 495 843 4.020144E-01 1.873457E-01 1.295538E-02 495 844 4.024881E-01 1.930988E-01 1.300639E-02 495 845 4.029617E-01 1.989216E-01 1.307168E-02 495 846 4.034354E-01 1.813703E-01 1.311065E-02 495 847 4.039090E-01 1.825712E-01 1.313623E-02 495 848 4.043827E-01 1.766285E-01 1.316361E-02 495 849 4.048563E-01 1.826226E-01 1.322163E-02 495 850 4.053299E-01 1.807621E-01 1.328526E-02 495 851 4.058036E-01 1.784143E-01 1.333327E-02 495 852 4.062772E-01 1.957887E-01 1.337139E-02 495 853 4.067509E-01 2.049027E-01 1.343284E-02 495 854 4.072245E-01 2.036269E-01 1.345425E-02 495 855 4.076982E-01 1.904960E-01 1.351691E-02 495 856 4.081718E-01 1.889724E-01 1.358744E-02 495 857 4.086455E-01 1.951378E-01 1.366659E-02 495 858 4.091191E-01 1.903949E-01 1.370295E-02 495 859 4.095928E-01 2.042385E-01 1.376477E-02 495 860 4.100664E-01 2.050500E-01 1.377438E-02 495 861 4.105400E-01 1.949204E-01 1.380893E-02 495 862 4.110137E-01 1.995118E-01 1.386031E-02 495 863 4.114873E-01 1.929045E-01 1.389049E-02 495 864 4.119610E-01 2.052374E-01 1.397717E-02 495 865 4.124346E-01 2.000693E-01 1.402352E-02 495 866 4.129083E-01 1.901545E-01 1.407451E-02 495 867 4.133819E-01 1.932659E-01 1.410512E-02 495 868 4.138556E-01 1.928388E-01 1.414477E-02 495 869 4.143292E-01 1.854587E-01 1.421631E-02 495 870 4.148029E-01 1.973967E-01 1.430289E-02 495 871 4.152765E-01 1.969336E-01 1.433610E-02 495 872 4.157501E-01 1.894776E-01 1.440379E-02 495 873 4.162238E-01 1.849419E-01 1.443297E-02 495 874 4.166974E-01 1.888271E-01 1.447515E-02 495 875 4.171711E-01 1.850704E-01 1.454151E-02 495 876 4.176447E-01 1.747747E-01 1.457492E-02 495 877 4.181184E-01 1.688720E-01 1.459636E-02 495 878 4.185920E-01 1.836844E-01 1.469063E-02 495 879 4.190657E-01 1.964231E-01 1.478050E-02 495 880 4.195393E-01 1.819173E-01 1.480682E-02 495 881 4.200130E-01 1.798355E-01 1.484870E-02 495 882 4.204866E-01 1.708050E-01 1.491400E-02 495 883 4.209603E-01 1.822332E-01 1.494177E-02 495 884 4.214339E-01 1.776076E-01 1.498976E-02 495 885 4.219075E-01 1.902077E-01 1.507734E-02 495 886 4.223812E-01 1.809702E-01 1.514507E-02 495 887 4.228548E-01 1.783399E-01 1.519623E-02 495 888 4.233285E-01 1.839013E-01 1.527938E-02 495 889 4.238021E-01 1.787268E-01 1.533931E-02 495 890 4.242758E-01 1.675385E-01 1.537693E-02 495 891 4.247494E-01 1.791572E-01 1.542963E-02 495 892 4.252231E-01 1.869259E-01 1.553521E-02 495 893 4.256967E-01 1.715220E-01 1.557570E-02 495 894 4.261704E-01 1.708301E-01 1.564341E-02 495 895 4.266440E-01 1.714208E-01 1.569552E-02 495 896 4.271176E-01 1.729296E-01 1.574656E-02 495 897 4.275913E-01 1.865850E-01 1.581352E-02 495 898 4.280649E-01 1.830503E-01 1.589941E-02 495 899 4.285386E-01 1.754964E-01 1.598684E-02 495 900 4.290122E-01 1.711952E-01 1.602923E-02 495 901 4.294859E-01 1.849990E-01 1.614085E-02 495 902 4.299595E-01 1.603394E-01 1.615276E-02 495 903 4.304332E-01 1.617458E-01 1.617184E-02 495 904 4.309068E-01 1.784255E-01 1.631229E-02 495 905 4.313805E-01 1.802113E-01 1.639869E-02 495 906 4.318541E-01 1.688465E-01 1.645597E-02 495 907 4.323277E-01 1.553973E-01 1.649531E-02 495 908 4.328014E-01 1.638922E-01 1.658753E-02 495 909 4.332750E-01 1.954222E-01 1.669644E-02 495 910 4.337487E-01 1.763715E-01 1.672231E-02 495 911 4.342223E-01 1.760443E-01 1.678272E-02 495 912 4.346960E-01 1.986504E-01 1.694049E-02 495 913 4.351696E-01 1.974431E-01 1.703410E-02 495 914 4.356433E-01 1.734899E-01 1.704443E-02 495 915 4.361169E-01 1.576626E-01 1.705939E-02 495 916 4.365906E-01 1.443058E-01 1.712288E-02 495 917 4.370642E-01 1.641883E-01 1.726010E-02 495 918 4.375378E-01 1.819543E-01 1.736680E-02 495 919 4.380115E-01 1.888606E-01 1.747592E-02 495 920 4.384851E-01 1.728328E-01 1.754332E-02 495 921 4.389588E-01 1.621837E-01 1.759471E-02 495 922 4.394324E-01 1.630263E-01 1.767704E-02 495 923 4.399061E-01 1.787211E-01 1.781303E-02 495 924 4.403797E-01 1.876629E-01 1.790731E-02 495 925 4.408534E-01 1.641487E-01 1.796932E-02 495 926 4.413270E-01 1.887185E-01 1.806876E-02 495 927 4.418007E-01 1.806213E-01 1.804962E-02 495 928 4.422743E-01 1.619382E-01 1.803646E-02 495 929 4.427480E-01 1.742634E-01 1.809577E-02 495 930 4.432216E-01 1.878877E-01 1.814009E-02 495 931 4.436952E-01 1.714181E-01 1.807767E-02 495 932 4.441689E-01 1.558881E-01 1.807519E-02 495 933 4.446425E-01 1.680052E-01 1.810417E-02 495 934 4.451162E-01 1.650431E-01 1.812789E-02 495 935 4.455898E-01 1.595816E-01 1.815966E-02 495 936 4.460635E-01 1.682709E-01 1.826169E-02 495 937 4.465371E-01 1.760672E-01 1.833990E-02 495 938 4.470108E-01 1.602923E-01 1.838797E-02 495 939 4.474844E-01 1.717794E-01 1.849584E-02 495 940 4.479581E-01 1.630757E-01 1.861092E-02 495 941 4.484317E-01 1.647893E-01 1.868994E-02 495 942 4.489053E-01 1.709048E-01 1.876963E-02 495 943 4.493790E-01 1.844172E-01 1.891945E-02 495 944 4.498526E-01 1.811667E-01 1.903946E-02 495 945 4.503263E-01 1.754581E-01 1.912040E-02 495 946 4.507999E-01 1.726872E-01 1.922621E-02 495 947 4.512736E-01 1.575504E-01 1.937930E-02 495 948 4.517472E-01 1.769860E-01 1.949462E-02 495 949 4.522209E-01 1.697355E-01 1.956011E-02 495 950 4.526945E-01 1.654359E-01 1.966570E-02 495 951 4.531682E-01 1.624487E-01 1.981713E-02 495 952 4.536418E-01 1.734376E-01 1.995488E-02 495 953 4.541154E-01 1.749362E-01 2.012124E-02 495 954 4.545891E-01 1.692808E-01 2.021970E-02 495 955 4.550627E-01 1.677942E-01 2.029591E-02 495 956 4.555364E-01 1.629006E-01 2.040322E-02 495 957 4.560100E-01 1.667318E-01 2.055484E-02 495 958 4.564837E-01 1.768928E-01 2.068903E-02 495 959 4.569573E-01 1.522228E-01 2.068729E-02 495 960 4.574310E-01 1.388550E-01 2.084430E-02 495 961 4.579046E-01 1.583758E-01 2.105046E-02 495 962 4.583783E-01 1.473460E-01 2.112977E-02 495 963 4.588519E-01 1.681972E-01 2.127163E-02 495 964 4.593256E-01 1.857049E-01 2.148902E-02 495 965 4.597992E-01 1.847294E-01 2.165575E-02 495 966 4.602728E-01 1.670328E-01 2.171654E-02 495 967 4.607465E-01 1.624862E-01 2.188630E-02 495 968 4.612201E-01 1.734931E-01 2.206442E-02 495 969 4.616938E-01 1.663459E-01 2.217182E-02 495 970 4.621674E-01 1.560454E-01 2.234655E-02 495 971 4.626411E-01 1.586381E-01 2.249985E-02 495 972 4.631147E-01 1.424211E-01 2.263994E-02 495 973 4.635884E-01 1.576541E-01 2.280841E-02 495 974 4.640620E-01 1.602247E-01 2.294294E-02 495 975 4.645357E-01 1.535454E-01 2.315129E-02 495 976 4.650093E-01 1.453104E-01 2.335076E-02 495 977 4.654829E-01 1.289003E-01 2.352325E-02 495 978 4.659566E-01 1.422527E-01 2.381140E-02 495 979 4.664302E-01 1.705188E-01 2.403014E-02 495 980 4.669039E-01 1.689771E-01 2.416333E-02 495 981 4.673775E-01 1.499791E-01 2.431835E-02 495 982 4.678512E-01 1.583608E-01 2.461688E-02 495 983 4.683248E-01 1.584765E-01 2.485547E-02 495 984 4.687985E-01 1.704230E-01 2.502487E-02 495 985 4.692721E-01 1.713101E-01 2.526033E-02 495 986 4.697458E-01 1.601068E-01 2.540998E-02 495 987 4.702194E-01 1.618127E-01 2.565402E-02 495 988 4.706930E-01 1.678298E-01 2.592372E-02 495 989 4.711667E-01 1.536056E-01 2.616272E-02 495 990 4.716403E-01 1.302386E-01 2.632927E-02 495 991 4.721140E-01 1.558665E-01 2.669359E-02 495 992 4.725876E-01 1.753727E-01 2.696258E-02 495 993 4.730613E-01 1.642153E-01 2.715434E-02 495 994 4.735349E-01 1.532654E-01 2.746205E-02 495 995 4.740086E-01 1.497695E-01 2.776189E-02 495 996 4.744822E-01 1.619258E-01 2.807764E-02 495 997 4.749559E-01 1.389479E-01 2.818434E-02 495 998 4.754295E-01 1.361733E-01 2.859139E-02 495 999 4.759031E-01 1.282496E-01 2.896241E-02 495 1000 4.763768E-01 1.321612E-01 2.937814E-02 495 1001 4.768504E-01 1.364704E-01 2.979782E-02 495 1002 4.773241E-01 1.501837E-01 3.022077E-02 495 1003 4.777977E-01 1.563349E-01 3.054374E-02 495 1004 4.782714E-01 1.867335E-01 3.092774E-02 495 1005 4.787450E-01 1.710182E-01 3.132330E-02 495 1006 4.792187E-01 1.761456E-01 3.171836E-02 495 1007 4.796923E-01 1.546659E-01 3.211762E-02 495 1008 4.801660E-01 1.526806E-01 3.271930E-02 495 1009 4.806396E-01 1.608642E-01 3.305202E-02 495 1010 4.811133E-01 1.760088E-01 3.372675E-02 495 1011 4.815869E-01 1.677732E-01 3.429391E-02 495 1012 4.820605E-01 1.746635E-01 3.473289E-02 495 1013 4.825342E-01 1.703864E-01 3.521144E-02 495 1014 4.830078E-01 1.775796E-01 3.587525E-02 495 1015 4.834815E-01 1.595490E-01 3.649608E-02 495 1016 4.839551E-01 1.300657E-01 3.706348E-02 495 1017 4.844288E-01 1.400962E-01 3.788389E-02 495 1018 4.849024E-01 1.609430E-01 3.865179E-02 495 1019 4.853761E-01 1.569510E-01 3.962264E-02 495 1020 4.858497E-01 1.562443E-01 4.040677E-02 495 1021 4.863234E-01 1.660574E-01 4.128611E-02 495 1022 4.867970E-01 1.547019E-01 4.214352E-02 495 1023 4.872706E-01 1.367606E-01 4.307771E-02 495 1024 4.877443E-01 1.714157E-01 4.430244E-02 495 1025 4.882179E-01 1.671700E-01 4.537152E-02 495 1026 4.886916E-01 2.043280E-01 4.687226E-02 495 1027 4.891652E-01 2.100725E-01 4.830391E-02 495 1028 4.896389E-01 1.971492E-01 4.990541E-02 495 1029 4.901125E-01 1.696285E-01 5.182758E-02 495 1030 4.905862E-01 1.196523E-01 5.337126E-02 495 1031 4.910598E-01 1.488836E-01 5.557062E-02 495 1032 4.915335E-01 1.376210E-01 5.796200E-02 495 1033 4.920071E-01 1.833958E-01 6.069082E-02 495 1034 4.924807E-01 2.390741E-01 6.412144E-02 495 1035 4.929544E-01 2.344394E-01 6.819733E-02 495 1036 4.934280E-01 1.304217E-01 7.251321E-02 495 1037 4.939017E-01 1.003101E-01 7.776200E-02 495 1038 4.943753E-01 1.373708E-01 8.474541E-02 495 1039 4.948490E-01 1.851793E-01 9.495659E-02 495 1040 4.953226E-01 2.317173E-01 1.063555E-01 495 1041 4.957963E-01 1.233514E-01 1.278351E-01 495 1042 4.962699E-01 -4.396227E-04 1.816418E-01 495 1043 4.967436E-01 1.103527E-01 3.022433E-01 495 # _sas_p_of_R_details.id 495 _sas_p_of_R_details.intensity_id 495 _sas_p_of_R_details.software_p_of_R "GNOM 5.0" _sas_p_of_R_details.number_of_points 705 _sas_p_of_R_details.qmin 0.0164669 _sas_p_of_R_details.qmax 0.349913 _sas_p_of_R_details.p_of_R_point_min 1 _sas_p_of_R_details.p_of_R_point_max 705 _sas_p_of_R_details.Rmin 0.0 _sas_p_of_R_details.Rmax 89.0 # 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 495 1 0.000000E+00 0.000000E+00 0.000000E+00 495 2 4.218000E-01 1.003000E-03 7.836000E-06 495 3 8.436000E-01 2.012000E-03 1.411000E-05 495 4 1.265000E+00 3.030000E-03 1.887000E-05 495 5 1.687000E+00 4.056000E-03 2.217000E-05 495 6 2.109000E+00 5.094000E-03 2.409000E-05 495 7 2.531000E+00 6.145000E-03 2.475000E-05 495 8 2.953000E+00 7.213000E-03 2.429000E-05 495 9 3.374000E+00 8.300000E-03 2.286000E-05 495 10 3.796000E+00 9.410000E-03 2.069000E-05 495 11 4.218000E+00 1.055000E-02 1.808000E-05 495 12 4.640000E+00 1.171000E-02 1.546000E-05 495 13 5.062000E+00 1.291000E-02 1.354000E-05 495 14 5.483000E+00 1.415000E-02 1.318000E-05 495 15 5.905000E+00 1.543000E-02 1.479000E-05 495 16 6.327000E+00 1.675000E-02 1.792000E-05 495 17 6.749000E+00 1.812000E-02 2.185000E-05 495 18 7.171000E+00 1.954000E-02 2.605000E-05 495 19 7.592000E+00 2.101000E-02 3.020000E-05 495 20 8.014000E+00 2.253000E-02 3.409000E-05 495 21 8.436000E+00 2.410000E-02 3.758000E-05 495 22 8.858000E+00 2.572000E-02 4.059000E-05 495 23 9.280000E+00 2.740000E-02 4.306000E-05 495 24 9.701000E+00 2.912000E-02 4.499000E-05 495 25 1.012000E+01 3.089000E-02 4.640000E-05 495 26 1.055000E+01 3.270000E-02 4.734000E-05 495 27 1.097000E+01 3.454000E-02 4.791000E-05 495 28 1.139000E+01 3.642000E-02 4.824000E-05 495 29 1.181000E+01 3.833000E-02 4.847000E-05 495 30 1.223000E+01 4.025000E-02 4.879000E-05 495 31 1.265000E+01 4.219000E-02 4.936000E-05 495 32 1.308000E+01 4.413000E-02 5.036000E-05 495 33 1.350000E+01 4.606000E-02 5.188000E-05 495 34 1.392000E+01 4.798000E-02 5.399000E-05 495 35 1.434000E+01 4.988000E-02 5.667000E-05 495 36 1.476000E+01 5.174000E-02 5.985000E-05 495 37 1.518000E+01 5.356000E-02 6.342000E-05 495 38 1.561000E+01 5.533000E-02 6.725000E-05 495 39 1.603000E+01 5.704000E-02 7.120000E-05 495 40 1.645000E+01 5.867000E-02 7.514000E-05 495 41 1.687000E+01 6.023000E-02 7.894000E-05 495 42 1.729000E+01 6.170000E-02 8.252000E-05 495 43 1.772000E+01 6.307000E-02 8.581000E-05 495 44 1.814000E+01 6.434000E-02 8.874000E-05 495 45 1.856000E+01 6.551000E-02 9.130000E-05 495 46 1.898000E+01 6.656000E-02 9.348000E-05 495 47 1.940000E+01 6.749000E-02 9.529000E-05 495 48 1.982000E+01 6.830000E-02 9.679000E-05 495 49 2.025000E+01 6.898000E-02 9.801000E-05 495 50 2.067000E+01 6.954000E-02 9.903000E-05 495 51 2.109000E+01 6.997000E-02 9.993000E-05 495 52 2.151000E+01 7.028000E-02 1.008000E-04 495 53 2.193000E+01 7.046000E-02 1.016000E-04 495 54 2.236000E+01 7.052000E-02 1.026000E-04 495 55 2.278000E+01 7.047000E-02 1.037000E-04 495 56 2.320000E+01 7.030000E-02 1.049000E-04 495 57 2.362000E+01 7.002000E-02 1.063000E-04 495 58 2.404000E+01 6.964000E-02 1.077000E-04 495 59 2.446000E+01 6.916000E-02 1.093000E-04 495 60 2.489000E+01 6.859000E-02 1.109000E-04 495 61 2.531000E+01 6.794000E-02 1.125000E-04 495 62 2.573000E+01 6.722000E-02 1.140000E-04 495 63 2.615000E+01 6.643000E-02 1.153000E-04 495 64 2.657000E+01 6.559000E-02 1.164000E-04 495 65 2.700000E+01 6.469000E-02 1.172000E-04 495 66 2.742000E+01 6.376000E-02 1.177000E-04 495 67 2.784000E+01 6.279000E-02 1.179000E-04 495 68 2.826000E+01 6.179000E-02 1.179000E-04 495 69 2.868000E+01 6.078000E-02 1.176000E-04 495 70 2.910000E+01 5.975000E-02 1.171000E-04 495 71 2.953000E+01 5.872000E-02 1.165000E-04 495 72 2.995000E+01 5.769000E-02 1.158000E-04 495 73 3.037000E+01 5.666000E-02 1.151000E-04 495 74 3.079000E+01 5.564000E-02 1.146000E-04 495 75 3.121000E+01 5.464000E-02 1.143000E-04 495 76 3.164000E+01 5.366000E-02 1.142000E-04 495 77 3.206000E+01 5.269000E-02 1.144000E-04 495 78 3.248000E+01 5.175000E-02 1.150000E-04 495 79 3.290000E+01 5.082000E-02 1.159000E-04 495 80 3.332000E+01 4.992000E-02 1.172000E-04 495 81 3.374000E+01 4.905000E-02 1.186000E-04 495 82 3.417000E+01 4.819000E-02 1.202000E-04 495 83 3.459000E+01 4.736000E-02 1.220000E-04 495 84 3.501000E+01 4.655000E-02 1.237000E-04 495 85 3.543000E+01 4.575000E-02 1.254000E-04 495 86 3.585000E+01 4.497000E-02 1.270000E-04 495 87 3.627000E+01 4.421000E-02 1.284000E-04 495 88 3.670000E+01 4.345000E-02 1.296000E-04 495 89 3.712000E+01 4.270000E-02 1.305000E-04 495 90 3.754000E+01 4.196000E-02 1.312000E-04 495 91 3.796000E+01 4.122000E-02 1.317000E-04 495 92 3.838000E+01 4.049000E-02 1.320000E-04 495 93 3.881000E+01 3.975000E-02 1.322000E-04 495 94 3.923000E+01 3.901000E-02 1.324000E-04 495 95 3.965000E+01 3.826000E-02 1.325000E-04 495 96 4.007000E+01 3.751000E-02 1.326000E-04 495 97 4.049000E+01 3.675000E-02 1.329000E-04 495 98 4.091000E+01 3.598000E-02 1.333000E-04 495 99 4.134000E+01 3.520000E-02 1.338000E-04 495 100 4.176000E+01 3.441000E-02 1.345000E-04 495 101 4.218000E+01 3.361000E-02 1.354000E-04 495 102 4.260000E+01 3.281000E-02 1.365000E-04 495 103 4.302000E+01 3.200000E-02 1.376000E-04 495 104 4.345000E+01 3.118000E-02 1.389000E-04 495 105 4.387000E+01 3.036000E-02 1.401000E-04 495 106 4.429000E+01 2.953000E-02 1.413000E-04 495 107 4.471000E+01 2.871000E-02 1.423000E-04 495 108 4.513000E+01 2.788000E-02 1.433000E-04 495 109 4.555000E+01 2.706000E-02 1.440000E-04 495 110 4.598000E+01 2.625000E-02 1.446000E-04 495 111 4.640000E+01 2.545000E-02 1.450000E-04 495 112 4.682000E+01 2.466000E-02 1.453000E-04 495 113 4.724000E+01 2.388000E-02 1.453000E-04 495 114 4.766000E+01 2.312000E-02 1.453000E-04 495 115 4.809000E+01 2.237000E-02 1.452000E-04 495 116 4.851000E+01 2.165000E-02 1.451000E-04 495 117 4.893000E+01 2.094000E-02 1.451000E-04 495 118 4.935000E+01 2.027000E-02 1.451000E-04 495 119 4.977000E+01 1.961000E-02 1.453000E-04 495 120 5.019000E+01 1.898000E-02 1.457000E-04 495 121 5.062000E+01 1.838000E-02 1.464000E-04 495 122 5.104000E+01 1.780000E-02 1.472000E-04 495 123 5.146000E+01 1.725000E-02 1.483000E-04 495 124 5.188000E+01 1.672000E-02 1.496000E-04 495 125 5.230000E+01 1.622000E-02 1.511000E-04 495 126 5.273000E+01 1.575000E-02 1.528000E-04 495 127 5.315000E+01 1.530000E-02 1.545000E-04 495 128 5.357000E+01 1.487000E-02 1.563000E-04 495 129 5.399000E+01 1.447000E-02 1.581000E-04 495 130 5.441000E+01 1.408000E-02 1.599000E-04 495 131 5.483000E+01 1.372000E-02 1.617000E-04 495 132 5.526000E+01 1.337000E-02 1.634000E-04 495 133 5.568000E+01 1.303000E-02 1.650000E-04 495 134 5.610000E+01 1.271000E-02 1.666000E-04 495 135 5.652000E+01 1.240000E-02 1.681000E-04 495 136 5.694000E+01 1.211000E-02 1.696000E-04 495 137 5.736000E+01 1.182000E-02 1.711000E-04 495 138 5.779000E+01 1.153000E-02 1.725000E-04 495 139 5.821000E+01 1.126000E-02 1.739000E-04 495 140 5.863000E+01 1.099000E-02 1.753000E-04 495 141 5.905000E+01 1.072000E-02 1.767000E-04 495 142 5.947000E+01 1.045000E-02 1.781000E-04 495 143 5.990000E+01 1.019000E-02 1.795000E-04 495 144 6.032000E+01 9.928000E-03 1.809000E-04 495 145 6.074000E+01 9.667000E-03 1.822000E-04 495 146 6.116000E+01 9.407000E-03 1.834000E-04 495 147 6.158000E+01 9.147000E-03 1.845000E-04 495 148 6.200000E+01 8.888000E-03 1.855000E-04 495 149 6.243000E+01 8.630000E-03 1.863000E-04 495 150 6.285000E+01 8.374000E-03 1.869000E-04 495 151 6.327000E+01 8.119000E-03 1.873000E-04 495 152 6.369000E+01 7.867000E-03 1.876000E-04 495 153 6.411000E+01 7.617000E-03 1.876000E-04 495 154 6.454000E+01 7.371000E-03 1.874000E-04 495 155 6.496000E+01 7.129000E-03 1.870000E-04 495 156 6.538000E+01 6.892000E-03 1.865000E-04 495 157 6.580000E+01 6.660000E-03 1.859000E-04 495 158 6.622000E+01 6.433000E-03 1.851000E-04 495 159 6.664000E+01 6.214000E-03 1.843000E-04 495 160 6.707000E+01 6.001000E-03 1.835000E-04 495 161 6.749000E+01 5.795000E-03 1.827000E-04 495 162 6.791000E+01 5.596000E-03 1.819000E-04 495 163 6.833000E+01 5.405000E-03 1.812000E-04 495 164 6.875000E+01 5.221000E-03 1.806000E-04 495 165 6.918000E+01 5.044000E-03 1.800000E-04 495 166 6.960000E+01 4.875000E-03 1.795000E-04 495 167 7.002000E+01 4.713000E-03 1.792000E-04 495 168 7.044000E+01 4.557000E-03 1.789000E-04 495 169 7.086000E+01 4.407000E-03 1.788000E-04 495 170 7.128000E+01 4.263000E-03 1.787000E-04 495 171 7.171000E+01 4.123000E-03 1.788000E-04 495 172 7.213000E+01 3.989000E-03 1.789000E-04 495 173 7.255000E+01 3.857000E-03 1.792000E-04 495 174 7.297000E+01 3.729000E-03 1.796000E-04 495 175 7.339000E+01 3.604000E-03 1.801000E-04 495 176 7.382000E+01 3.480000E-03 1.808000E-04 495 177 7.424000E+01 3.358000E-03 1.816000E-04 495 178 7.466000E+01 3.237000E-03 1.826000E-04 495 179 7.508000E+01 3.116000E-03 1.837000E-04 495 180 7.550000E+01 2.995000E-03 1.850000E-04 495 181 7.592000E+01 2.874000E-03 1.863000E-04 495 182 7.635000E+01 2.753000E-03 1.878000E-04 495 183 7.677000E+01 2.632000E-03 1.893000E-04 495 184 7.719000E+01 2.510000E-03 1.908000E-04 495 185 7.761000E+01 2.387000E-03 1.923000E-04 495 186 7.803000E+01 2.265000E-03 1.937000E-04 495 187 7.845000E+01 2.144000E-03 1.949000E-04 495 188 7.888000E+01 2.022000E-03 1.960000E-04 495 189 7.930000E+01 1.902000E-03 1.969000E-04 495 190 7.972000E+01 1.784000E-03 1.975000E-04 495 191 8.014000E+01 1.667000E-03 1.978000E-04 495 192 8.056000E+01 1.553000E-03 1.977000E-04 495 193 8.099000E+01 1.442000E-03 1.974000E-04 495 194 8.141000E+01 1.335000E-03 1.966000E-04 495 195 8.183000E+01 1.231000E-03 1.954000E-04 495 196 8.225000E+01 1.132000E-03 1.937000E-04 495 197 8.267000E+01 1.038000E-03 1.916000E-04 495 198 8.309000E+01 9.480000E-04 1.888000E-04 495 199 8.352000E+01 8.632000E-04 1.853000E-04 495 200 8.394000E+01 7.833000E-04 1.810000E-04 495 201 8.436000E+01 7.080000E-04 1.758000E-04 495 202 8.478000E+01 6.371000E-04 1.695000E-04 495 203 8.520000E+01 5.701000E-04 1.619000E-04 495 204 8.563000E+01 5.065000E-04 1.528000E-04 495 205 8.605000E+01 4.454000E-04 1.420000E-04 495 206 8.647000E+01 3.861000E-04 1.293000E-04 495 207 8.689000E+01 3.274000E-04 1.144000E-04 495 208 8.731000E+01 2.682000E-04 9.715000E-05 495 209 8.773000E+01 2.072000E-04 7.729000E-05 495 210 8.816000E+01 1.432000E-04 5.461000E-05 495 211 8.858000E+01 7.460000E-05 2.891000E-05 495 212 8.900000E+01 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 495 1 0.000000E+00 2.915520E+01 495 2 5.881020E-04 2.915320E+01 495 3 1.176200E-03 2.914760E+01 495 4 1.764310E-03 2.913810E+01 495 5 2.352410E-03 2.912480E+01 495 6 2.940510E-03 2.910780E+01 495 7 3.528610E-03 2.908700E+01 495 8 4.116710E-03 2.906240E+01 495 9 4.704810E-03 2.903410E+01 495 10 5.292920E-03 2.900210E+01 495 11 5.881020E-03 2.896630E+01 495 12 6.469120E-03 2.892690E+01 495 13 7.057220E-03 2.888370E+01 495 14 7.645320E-03 2.883690E+01 495 15 8.233430E-03 2.878650E+01 495 16 8.821530E-03 2.873240E+01 495 17 9.409630E-03 2.867470E+01 495 18 9.997730E-03 2.861350E+01 495 19 1.058580E-02 2.854880E+01 495 20 1.117390E-02 2.848050E+01 495 21 1.176200E-02 2.840870E+01 495 22 1.235010E-02 2.833350E+01 495 23 1.293820E-02 2.825490E+01 495 24 1.352630E-02 2.817300E+01 495 25 1.411440E-02 2.808760E+01 495 26 1.470250E-02 2.799900E+01 495 27 1.529060E-02 2.790720E+01 495 28 1.587870E-02 2.781210E+01 495 29 1.646690E-02 2.771380E+01 495 30 1.694050E-02 2.763240E+01 495 31 1.741410E-02 2.754900E+01 495 32 1.788780E-02 2.746360E+01 495 33 1.836140E-02 2.737630E+01 495 34 1.883510E-02 2.728700E+01 495 35 1.930870E-02 2.719580E+01 495 36 1.978240E-02 2.710270E+01 495 37 2.025600E-02 2.700780E+01 495 38 2.072970E-02 2.691100E+01 495 39 2.120330E-02 2.681250E+01 495 40 2.167700E-02 2.671210E+01 495 41 2.215060E-02 2.661010E+01 495 42 2.262420E-02 2.650630E+01 495 43 2.309790E-02 2.640080E+01 495 44 2.357150E-02 2.629370E+01 495 45 2.404520E-02 2.618490E+01 495 46 2.451880E-02 2.607460E+01 495 47 2.499250E-02 2.596270E+01 495 48 2.546610E-02 2.584920E+01 495 49 2.593980E-02 2.573420E+01 495 50 2.641340E-02 2.561780E+01 495 51 2.688710E-02 2.549990E+01 495 52 2.736070E-02 2.538060E+01 495 53 2.783440E-02 2.525990E+01 495 54 2.830800E-02 2.513790E+01 495 55 2.878160E-02 2.501460E+01 495 56 2.925530E-02 2.489000E+01 495 57 2.972890E-02 2.476410E+01 495 58 3.020260E-02 2.463700E+01 495 59 3.067620E-02 2.450870E+01 495 60 3.114990E-02 2.437920E+01 495 61 3.162350E-02 2.424870E+01 495 62 3.209720E-02 2.411700E+01 495 63 3.257080E-02 2.398430E+01 495 64 3.304450E-02 2.385060E+01 495 65 3.351810E-02 2.371590E+01 495 66 3.399170E-02 2.358020E+01 495 67 3.446540E-02 2.344360E+01 495 68 3.493900E-02 2.330610E+01 495 69 3.541270E-02 2.316770E+01 495 70 3.588630E-02 2.302860E+01 495 71 3.636000E-02 2.288860E+01 495 72 3.683360E-02 2.274790E+01 495 73 3.730730E-02 2.260640E+01 495 74 3.778090E-02 2.246430E+01 495 75 3.825450E-02 2.232150E+01 495 76 3.872820E-02 2.217800E+01 495 77 3.920180E-02 2.203400E+01 495 78 3.967550E-02 2.188940E+01 495 79 4.014910E-02 2.174430E+01 495 80 4.062280E-02 2.159870E+01 495 81 4.109640E-02 2.145260E+01 495 82 4.157010E-02 2.130610E+01 495 83 4.204370E-02 2.115910E+01 495 84 4.251740E-02 2.101180E+01 495 85 4.299100E-02 2.086420E+01 495 86 4.346470E-02 2.071620E+01 495 87 4.393830E-02 2.056800E+01 495 88 4.441190E-02 2.041950E+01 495 89 4.488560E-02 2.027080E+01 495 90 4.535920E-02 2.012190E+01 495 91 4.583290E-02 1.997280E+01 495 92 4.630650E-02 1.982360E+01 495 93 4.678020E-02 1.967430E+01 495 94 4.725380E-02 1.952490E+01 495 95 4.772750E-02 1.937540E+01 495 96 4.820110E-02 1.922600E+01 495 97 4.867480E-02 1.907650E+01 495 98 4.914840E-02 1.892710E+01 495 99 4.962210E-02 1.877770E+01 495 100 5.009570E-02 1.862840E+01 495 101 5.056930E-02 1.847930E+01 495 102 5.104300E-02 1.833020E+01 495 103 5.151660E-02 1.818140E+01 495 104 5.199030E-02 1.803270E+01 495 105 5.246390E-02 1.788420E+01 495 106 5.293760E-02 1.773600E+01 495 107 5.341120E-02 1.758800E+01 495 108 5.388490E-02 1.744030E+01 495 109 5.435850E-02 1.729290E+01 495 110 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2.632360E-01 2.010380E-01 495 551 2.637100E-01 2.011060E-01 495 552 2.641840E-01 2.011880E-01 495 553 2.646570E-01 2.012830E-01 495 554 2.651310E-01 2.013920E-01 495 555 2.656050E-01 2.015150E-01 495 556 2.660780E-01 2.016490E-01 495 557 2.665520E-01 2.017960E-01 495 558 2.670250E-01 2.019550E-01 495 559 2.674990E-01 2.021260E-01 495 560 2.679730E-01 2.023090E-01 495 561 2.684460E-01 2.025030E-01 495 562 2.689200E-01 2.027080E-01 495 563 2.693940E-01 2.029240E-01 495 564 2.698670E-01 2.031510E-01 495 565 2.703410E-01 2.033880E-01 495 566 2.708150E-01 2.036350E-01 495 567 2.712880E-01 2.038920E-01 495 568 2.717620E-01 2.041590E-01 495 569 2.722360E-01 2.044350E-01 495 570 2.727090E-01 2.047200E-01 495 571 2.731830E-01 2.050140E-01 495 572 2.736560E-01 2.053170E-01 495 573 2.741300E-01 2.056290E-01 495 574 2.746040E-01 2.059480E-01 495 575 2.750770E-01 2.062760E-01 495 576 2.755510E-01 2.066110E-01 495 577 2.760250E-01 2.069540E-01 495 578 2.764980E-01 2.073050E-01 495 579 2.769720E-01 2.076630E-01 495 580 2.774460E-01 2.080270E-01 495 581 2.779190E-01 2.083990E-01 495 582 2.783930E-01 2.087770E-01 495 583 2.788670E-01 2.091610E-01 495 584 2.793400E-01 2.095520E-01 495 585 2.798140E-01 2.099480E-01 495 586 2.802880E-01 2.103500E-01 495 587 2.807610E-01 2.107580E-01 495 588 2.812350E-01 2.111710E-01 495 589 2.817080E-01 2.115890E-01 495 590 2.821820E-01 2.120130E-01 495 591 2.826560E-01 2.124410E-01 495 592 2.831290E-01 2.128740E-01 495 593 2.836030E-01 2.133110E-01 495 594 2.840770E-01 2.137610E-01 495 595 2.845500E-01 2.141940E-01 495 596 2.850240E-01 2.146420E-01 495 597 2.854980E-01 2.150990E-01 495 598 2.859710E-01 2.155560E-01 495 599 2.864450E-01 2.160150E-01 495 600 2.869190E-01 2.164780E-01 495 601 2.873920E-01 2.169430E-01 495 602 2.878660E-01 2.174120E-01 495 603 2.883400E-01 2.178820E-01 495 604 2.888130E-01 2.183560E-01 495 605 2.892870E-01 2.188310E-01 495 606 2.897600E-01 2.193080E-01 495 607 2.902340E-01 2.197870E-01 495 608 2.907080E-01 2.202680E-01 495 609 2.911810E-01 2.207500E-01 495 610 2.916550E-01 2.212330E-01 495 611 2.921290E-01 2.217180E-01 495 612 2.926020E-01 2.222020E-01 495 613 2.930760E-01 2.226890E-01 495 614 2.935500E-01 2.231750E-01 495 615 2.940230E-01 2.236610E-01 495 616 2.944970E-01 2.241480E-01 495 617 2.949710E-01 2.246340E-01 495 618 2.954440E-01 2.251210E-01 495 619 2.959180E-01 2.256070E-01 495 620 2.963910E-01 2.260910E-01 495 621 2.968650E-01 2.265760E-01 495 622 2.973390E-01 2.270590E-01 495 623 2.978120E-01 2.275410E-01 495 624 2.982860E-01 2.280220E-01 495 625 2.987600E-01 2.285010E-01 495 626 2.992330E-01 2.289780E-01 495 627 2.997070E-01 2.294530E-01 495 628 3.001810E-01 2.299270E-01 495 629 3.006540E-01 2.303970E-01 495 630 3.011280E-01 2.308650E-01 495 631 3.016020E-01 2.313300E-01 495 632 3.020750E-01 2.317920E-01 495 633 3.025490E-01 2.322510E-01 495 634 3.030220E-01 2.327070E-01 495 635 3.034960E-01 2.331600E-01 495 636 3.039700E-01 2.336080E-01 495 637 3.044430E-01 2.340530E-01 495 638 3.049170E-01 2.344940E-01 495 639 3.053910E-01 2.349300E-01 495 640 3.058640E-01 2.353620E-01 495 641 3.063380E-01 2.357890E-01 495 642 3.068120E-01 2.362120E-01 495 643 3.072850E-01 2.366290E-01 495 644 3.077590E-01 2.370500E-01 495 645 3.082330E-01 2.374450E-01 495 646 3.087060E-01 2.378520E-01 495 647 3.091800E-01 2.382450E-01 495 648 3.096540E-01 2.386350E-01 495 649 3.101270E-01 2.390190E-01 495 650 3.106010E-01 2.393960E-01 495 651 3.110740E-01 2.397670E-01 495 652 3.115480E-01 2.401320E-01 495 653 3.120220E-01 2.404890E-01 495 654 3.124950E-01 2.408400E-01 495 655 3.129690E-01 2.411840E-01 495 656 3.134430E-01 2.415210E-01 495 657 3.139160E-01 2.418500E-01 495 658 3.143900E-01 2.421710E-01 495 659 3.148640E-01 2.424850E-01 495 660 3.153370E-01 2.427910E-01 495 661 3.158110E-01 2.430890E-01 495 662 3.162850E-01 2.433790E-01 495 663 3.167580E-01 2.436610E-01 495 664 3.172320E-01 2.439340E-01 495 665 3.177050E-01 2.441990E-01 495 666 3.181790E-01 2.444550E-01 495 667 3.186530E-01 2.447030E-01 495 668 3.191260E-01 2.449410E-01 495 669 3.196000E-01 2.451700E-01 495 670 3.200740E-01 2.453900E-01 495 671 3.205470E-01 2.456020E-01 495 672 3.210210E-01 2.458030E-01 495 673 3.214950E-01 2.459960E-01 495 674 3.219680E-01 2.461780E-01 495 675 3.224420E-01 2.463510E-01 495 676 3.229160E-01 2.465150E-01 495 677 3.233890E-01 2.466680E-01 495 678 3.238630E-01 2.468130E-01 495 679 3.243370E-01 2.469450E-01 495 680 3.248100E-01 2.470690E-01 495 681 3.252840E-01 2.471820E-01 495 682 3.257570E-01 2.472860E-01 495 683 3.262310E-01 2.473790E-01 495 684 3.267050E-01 2.474610E-01 495 685 3.271780E-01 2.475340E-01 495 686 3.276520E-01 2.475960E-01 495 687 3.281260E-01 2.476480E-01 495 688 3.285990E-01 2.476890E-01 495 689 3.290730E-01 2.477190E-01 495 690 3.295470E-01 2.477400E-01 495 691 3.300200E-01 2.477490E-01 495 692 3.304940E-01 2.477490E-01 495 693 3.309680E-01 2.477370E-01 495 694 3.314410E-01 2.477240E-01 495 695 3.319150E-01 2.476800E-01 495 696 3.323880E-01 2.476480E-01 495 697 3.328620E-01 2.475870E-01 495 698 3.333360E-01 2.475230E-01 495 699 3.338090E-01 2.474480E-01 495 700 3.342830E-01 2.473630E-01 495 701 3.347570E-01 2.472680E-01 495 702 3.352300E-01 2.471630E-01 495 703 3.357040E-01 2.470460E-01 495 704 3.361780E-01 2.469200E-01 495 705 3.366510E-01 2.467830E-01 495 706 3.371250E-01 2.466370E-01 495 707 3.375990E-01 2.464800E-01 495 708 3.380720E-01 2.463130E-01 495 709 3.385460E-01 2.461360E-01 495 710 3.390200E-01 2.459490E-01 495 711 3.394930E-01 2.457520E-01 495 712 3.399670E-01 2.455460E-01 495 713 3.404400E-01 2.453290E-01 495 714 3.409140E-01 2.451030E-01 495 715 3.413880E-01 2.448670E-01 495 716 3.418610E-01 2.446230E-01 495 717 3.423350E-01 2.443680E-01 495 718 3.428090E-01 2.441050E-01 495 719 3.432820E-01 2.438320E-01 495 720 3.437560E-01 2.435500E-01 495 721 3.442300E-01 2.432610E-01 495 722 3.447030E-01 2.429610E-01 495 723 3.451770E-01 2.426540E-01 495 724 3.456510E-01 2.423370E-01 495 725 3.461240E-01 2.420130E-01 495 726 3.465980E-01 2.416800E-01 495 727 3.470710E-01 2.413390E-01 495 728 3.475450E-01 2.409910E-01 495 729 3.480190E-01 2.406330E-01 495 730 3.484920E-01 2.402680E-01 495 731 3.489660E-01 2.398960E-01 495 732 3.494400E-01 2.395170E-01 495 733 3.499130E-01 2.391300E-01 # data_SASDBG9_FIT_733 # _sas_model_fitting_details.id 733 _sas_model_fitting_details.unit 1/A _sas_model_fitting_details.chi_square 2.191 _sas_model_fitting_details.p_value . _sas_model_fitting_details.result_id 495 # loop_ _sas_model_fitting.id _sas_model_fitting.ordinal _sas_model_fitting.momentum_transfer _sas_model_fitting.intensity _sas_model_fitting.fit 733 1 0.000000E+00 0.000000E+00 2.885310E+01 733 2 2.000000E-03 0.000000E+00 2.883190E+01 733 3 4.000000E-03 0.000000E+00 2.876980E+01 733 4 6.000000E-03 0.000000E+00 2.866670E+01 733 5 8.000000E-03 0.000000E+00 2.852330E+01 733 6 1.000000E-02 0.000000E+00 2.834020E+01 733 7 1.200000E-02 0.000000E+00 2.811800E+01 733 8 1.400000E-02 0.000000E+00 2.785880E+01 733 9 1.599320E-02 2.860390E+01 2.756420E+01 733 10 1.646690E-02 2.786600E+01 2.748880E+01 733 11 1.694050E-02 2.787390E+01 2.741150E+01 733 12 1.741410E-02 2.756020E+01 2.733220E+01 733 13 1.788780E-02 2.706680E+01 2.725100E+01 733 14 1.836140E-02 2.715610E+01 2.716780E+01 733 15 1.883510E-02 2.703040E+01 2.708280E+01 733 16 1.930870E-02 2.699480E+01 2.699600E+01 733 17 1.978240E-02 2.728580E+01 2.690740E+01 733 18 2.025600E-02 2.711870E+01 2.681700E+01 733 19 2.072970E-02 2.654880E+01 2.672490E+01 733 20 2.120330E-02 2.685740E+01 2.663100E+01 733 21 2.167700E-02 2.708600E+01 2.653550E+01 733 22 2.215060E-02 2.676230E+01 2.643830E+01 733 23 2.262420E-02 2.680410E+01 2.633940E+01 733 24 2.309790E-02 2.636920E+01 2.623900E+01 733 25 2.357150E-02 2.597620E+01 2.613690E+01 733 26 2.404520E-02 2.613910E+01 2.603330E+01 733 27 2.451880E-02 2.599960E+01 2.592810E+01 733 28 2.499250E-02 2.605190E+01 2.582130E+01 733 29 2.546610E-02 2.604370E+01 2.571300E+01 733 30 2.593980E-02 2.553800E+01 2.560330E+01 733 31 2.641340E-02 2.562710E+01 2.549200E+01 733 32 2.688710E-02 2.569540E+01 2.537940E+01 733 33 2.736070E-02 2.581470E+01 2.526530E+01 733 34 2.783440E-02 2.537870E+01 2.515000E+01 733 35 2.830800E-02 2.504040E+01 2.503330E+01 733 36 2.878160E-02 2.519370E+01 2.491530E+01 733 37 2.925530E-02 2.500310E+01 2.479600E+01 733 38 2.972890E-02 2.478300E+01 2.467550E+01 733 39 3.020260E-02 2.452800E+01 2.455380E+01 733 40 3.067620E-02 2.472680E+01 2.443090E+01 733 41 3.114990E-02 2.469040E+01 2.430680E+01 733 42 3.162350E-02 2.450560E+01 2.418150E+01 733 43 3.209720E-02 2.455820E+01 2.405520E+01 733 44 3.257080E-02 2.436160E+01 2.392780E+01 733 45 3.304450E-02 2.358370E+01 2.379930E+01 733 46 3.351810E-02 2.339530E+01 2.366980E+01 733 47 3.399170E-02 2.314600E+01 2.353930E+01 733 48 3.446540E-02 2.327990E+01 2.340790E+01 733 49 3.493900E-02 2.334640E+01 2.327550E+01 733 50 3.541270E-02 2.313120E+01 2.314230E+01 733 51 3.588630E-02 2.294000E+01 2.300830E+01 733 52 3.636000E-02 2.261960E+01 2.287340E+01 733 53 3.683360E-02 2.233040E+01 2.273770E+01 733 54 3.730730E-02 2.248630E+01 2.260130E+01 733 55 3.778090E-02 2.284830E+01 2.246410E+01 733 56 3.825450E-02 2.224410E+01 2.232630E+01 733 57 3.872820E-02 2.187720E+01 2.218770E+01 733 58 3.920180E-02 2.210130E+01 2.204850E+01 733 59 3.967550E-02 2.191610E+01 2.190880E+01 733 60 4.014910E-02 2.175180E+01 2.176840E+01 733 61 4.062280E-02 2.152740E+01 2.162740E+01 733 62 4.109640E-02 2.134300E+01 2.148600E+01 733 63 4.157010E-02 2.138490E+01 2.134400E+01 733 64 4.204370E-02 2.094420E+01 2.120160E+01 733 65 4.251740E-02 2.081570E+01 2.105870E+01 733 66 4.299100E-02 2.075000E+01 2.091550E+01 733 67 4.346470E-02 2.072860E+01 2.077180E+01 733 68 4.393830E-02 2.082470E+01 2.062780E+01 733 69 4.441190E-02 2.102940E+01 2.048350E+01 733 70 4.488560E-02 2.053390E+01 2.033880E+01 733 71 4.535920E-02 2.022820E+01 2.019390E+01 733 72 4.583290E-02 2.007440E+01 2.004870E+01 733 73 4.630650E-02 1.996930E+01 1.990320E+01 733 74 4.678020E-02 1.968320E+01 1.975760E+01 733 75 4.725380E-02 1.979700E+01 1.961180E+01 733 76 4.772750E-02 1.969020E+01 1.946590E+01 733 77 4.820110E-02 1.906790E+01 1.931980E+01 733 78 4.867480E-02 1.905380E+01 1.917370E+01 733 79 4.914840E-02 1.917950E+01 1.902760E+01 733 80 4.962210E-02 1.917630E+01 1.888140E+01 733 81 5.009570E-02 1.879280E+01 1.873520E+01 733 82 5.056930E-02 1.867450E+01 1.858910E+01 733 83 5.104300E-02 1.854870E+01 1.844300E+01 733 84 5.151660E-02 1.871690E+01 1.829700E+01 733 85 5.199030E-02 1.852470E+01 1.815100E+01 733 86 5.246390E-02 1.793490E+01 1.800520E+01 733 87 5.293760E-02 1.766380E+01 1.785950E+01 733 88 5.341120E-02 1.777240E+01 1.771400E+01 733 89 5.388490E-02 1.791830E+01 1.756870E+01 733 90 5.435850E-02 1.732030E+01 1.742360E+01 733 91 5.483220E-02 1.705940E+01 1.727880E+01 733 92 5.530580E-02 1.725670E+01 1.713410E+01 733 93 5.577940E-02 1.667280E+01 1.698980E+01 733 94 5.625310E-02 1.644950E+01 1.684580E+01 733 95 5.672670E-02 1.646340E+01 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1.758190E-01 733 861 4.195390E-01 1.819170E-01 1.753290E-01 733 862 4.200130E-01 1.798360E-01 1.748400E-01 733 863 4.204870E-01 1.708050E-01 1.743500E-01 733 864 4.209600E-01 1.822330E-01 1.738610E-01 733 865 4.214340E-01 1.776080E-01 1.733720E-01 733 866 4.219070E-01 1.902080E-01 1.728840E-01 733 867 4.223810E-01 1.809700E-01 1.723960E-01 733 868 4.228550E-01 1.783400E-01 1.719080E-01 733 869 4.233280E-01 1.839010E-01 1.714220E-01 733 870 4.238020E-01 1.787270E-01 1.709360E-01 733 871 4.242760E-01 1.675390E-01 1.704510E-01 733 872 4.247490E-01 1.791570E-01 1.699670E-01 733 873 4.252230E-01 1.869260E-01 1.694850E-01 733 874 4.256970E-01 1.715220E-01 1.690030E-01 733 875 4.261700E-01 1.708300E-01 1.685230E-01 733 876 4.266440E-01 1.714210E-01 1.680440E-01 733 877 4.271180E-01 1.729300E-01 1.675650E-01 733 878 4.275910E-01 1.865850E-01 1.670880E-01 733 879 4.280650E-01 1.830500E-01 1.666110E-01 733 880 4.285390E-01 1.754960E-01 1.661350E-01 733 881 4.290120E-01 1.711950E-01 1.656600E-01 733 882 4.294860E-01 1.849990E-01 1.651870E-01 733 883 4.299590E-01 1.603390E-01 1.647150E-01 733 884 4.304330E-01 1.617460E-01 1.642450E-01 733 885 4.309070E-01 1.784250E-01 1.637770E-01 733 886 4.313810E-01 1.802110E-01 1.633100E-01 733 887 4.318540E-01 1.688470E-01 1.628450E-01 733 888 4.323280E-01 1.553970E-01 1.623810E-01 733 889 4.328010E-01 1.638920E-01 1.619190E-01 733 890 4.332750E-01 1.954220E-01 1.614580E-01 733 891 4.337490E-01 1.763710E-01 1.609990E-01 733 892 4.342220E-01 1.760440E-01 1.605430E-01 733 893 4.346960E-01 1.986500E-01 1.600880E-01 733 894 4.351700E-01 1.974430E-01 1.596360E-01 733 895 4.356430E-01 1.734900E-01 1.591860E-01 733 896 4.361170E-01 1.576630E-01 1.587390E-01 733 897 4.365910E-01 1.443060E-01 1.582930E-01 733 898 4.370640E-01 1.641880E-01 1.578500E-01 733 899 4.375380E-01 1.819540E-01 1.574090E-01 733 900 4.380110E-01 1.888610E-01 1.569710E-01 733 901 4.384850E-01 1.728330E-01 1.565350E-01 733 902 4.389590E-01 1.621840E-01 1.561020E-01 733 903 4.394320E-01 1.630260E-01 1.556710E-01 733 904 4.399060E-01 1.787210E-01 1.552430E-01 733 905 4.403800E-01 1.876630E-01 1.548170E-01 733 906 4.408530E-01 1.641490E-01 1.543950E-01 733 907 4.413270E-01 1.887190E-01 1.539750E-01 733 908 4.418010E-01 1.806210E-01 1.535580E-01 733 909 4.422740E-01 1.619380E-01 1.531440E-01 733 910 4.427480E-01 1.742630E-01 1.527330E-01 733 911 4.432220E-01 1.878880E-01 1.523240E-01 733 912 4.436950E-01 1.714180E-01 1.519200E-01 733 913 4.441690E-01 1.558880E-01 1.515180E-01 733 914 4.446420E-01 1.680050E-01 1.511190E-01 733 915 4.451160E-01 1.650430E-01 1.507240E-01 733 916 4.455900E-01 1.595820E-01 1.503320E-01 733 917 4.460640E-01 1.682710E-01 1.499430E-01 733 918 4.465370E-01 1.760670E-01 1.495580E-01 733 919 4.470110E-01 1.602920E-01 1.491760E-01 733 920 4.474840E-01 1.717790E-01 1.487980E-01 733 921 4.479580E-01 1.630760E-01 1.484230E-01 733 922 4.484320E-01 1.647890E-01 1.480520E-01 733 923 4.489050E-01 1.709050E-01 1.476840E-01 733 924 4.493790E-01 1.844170E-01 1.473210E-01 733 925 4.498530E-01 1.811670E-01 1.469610E-01 733 926 4.503260E-01 1.754580E-01 1.466060E-01 733 927 4.508000E-01 1.726870E-01 1.462540E-01 733 928 4.512740E-01 1.575500E-01 1.459070E-01 733 929 4.517470E-01 1.769860E-01 1.455640E-01 733 930 4.522210E-01 1.697360E-01 1.452240E-01 733 931 4.526940E-01 1.654360E-01 1.448890E-01 733 932 4.531680E-01 1.624490E-01 1.445580E-01 733 933 4.536420E-01 1.734380E-01 1.442320E-01 733 934 4.541150E-01 1.749360E-01 1.439090E-01 733 935 4.545890E-01 1.692810E-01 1.435900E-01 733 936 4.550630E-01 1.677940E-01 1.432760E-01 733 937 4.555360E-01 1.629010E-01 1.429660E-01 733 938 4.560100E-01 1.667320E-01 1.426590E-01 733 939 4.564840E-01 1.768930E-01 1.423580E-01 733 940 4.569570E-01 1.522230E-01 1.420600E-01 733 941 4.574310E-01 1.388550E-01 1.417670E-01 733 942 4.579050E-01 1.583760E-01 1.414790E-01 733 943 4.583780E-01 1.473460E-01 1.411960E-01 733 944 4.588520E-01 1.681970E-01 1.409170E-01 733 945 4.593260E-01 1.857050E-01 1.406420E-01 733 946 4.597990E-01 1.847290E-01 1.403730E-01 733 947 4.602730E-01 1.670330E-01 1.401080E-01 733 948 4.607470E-01 1.624860E-01 1.398470E-01 733 949 4.612200E-01 1.734930E-01 1.395920E-01 733 950 4.616940E-01 1.663460E-01 1.393400E-01 733 951 4.621670E-01 1.560450E-01 1.390940E-01 733 952 4.626410E-01 1.586380E-01 1.388520E-01 733 953 4.631150E-01 1.424210E-01 1.386140E-01 733 954 4.635880E-01 1.576540E-01 1.383820E-01 733 955 4.640620E-01 1.602250E-01 1.381540E-01 733 956 4.645360E-01 1.535450E-01 1.379310E-01 733 957 4.650090E-01 1.453100E-01 1.377140E-01 733 958 4.654830E-01 1.289000E-01 1.375010E-01 733 959 4.659570E-01 1.422530E-01 1.372940E-01 733 960 4.664300E-01 1.705190E-01 1.370920E-01 733 961 4.669040E-01 1.689770E-01 1.368950E-01 733 962 4.673780E-01 1.499790E-01 1.367020E-01 733 963 4.678510E-01 1.583610E-01 1.365150E-01 733 964 4.683250E-01 1.584760E-01 1.363320E-01 733 965 4.687990E-01 1.704230E-01 1.361540E-01 733 966 4.692720E-01 1.713100E-01 1.359810E-01 733 967 4.697460E-01 1.601070E-01 1.358130E-01 733 968 4.702190E-01 1.618130E-01 1.356490E-01 733 969 4.706930E-01 1.678300E-01 1.354900E-01 733 970 4.711670E-01 1.536060E-01 1.353350E-01 733 971 4.716400E-01 1.302390E-01 1.351860E-01 733 972 4.721140E-01 1.558660E-01 1.350400E-01 733 973 4.725880E-01 1.753730E-01 1.349000E-01 733 974 4.730610E-01 1.642150E-01 1.347640E-01 733 975 4.735350E-01 1.532650E-01 1.346330E-01 733 976 4.740090E-01 1.497690E-01 1.345060E-01 733 977 4.744820E-01 1.619260E-01 1.343840E-01 733 978 4.749560E-01 1.389480E-01 1.342670E-01 733 979 4.754300E-01 1.361730E-01 1.341550E-01 733 980 4.759030E-01 1.282500E-01 1.340470E-01 733 981 4.763770E-01 1.321610E-01 1.339430E-01 733 982 4.768500E-01 1.364700E-01 1.338440E-01 733 983 4.773240E-01 1.501840E-01 1.337500E-01 733 984 4.777980E-01 1.563350E-01 1.336600E-01 733 985 4.782710E-01 1.867330E-01 1.335740E-01 733 986 4.787450E-01 1.710180E-01 1.334920E-01 733 987 4.792190E-01 1.761460E-01 1.334150E-01 733 988 4.796920E-01 1.546660E-01 1.333430E-01 733 989 4.801660E-01 1.526810E-01 1.332760E-01 733 990 4.806400E-01 1.608640E-01 1.332120E-01 733 991 4.811130E-01 1.760090E-01 1.331540E-01 733 992 4.815870E-01 1.677730E-01 1.331000E-01 733 993 4.820610E-01 1.746630E-01 1.330490E-01 733 994 4.825340E-01 1.703860E-01 1.330030E-01 733 995 4.830080E-01 1.775800E-01 1.329610E-01 733 996 4.834820E-01 1.595490E-01 1.329230E-01 733 997 4.839550E-01 1.300660E-01 1.328890E-01 733 998 4.844290E-01 1.400960E-01 1.328590E-01 733 999 4.849020E-01 1.609430E-01 1.328330E-01 733 1000 4.853760E-01 1.569510E-01 1.328100E-01 733 1001 4.858500E-01 1.562440E-01 1.327920E-01 733 1002 4.863230E-01 1.660570E-01 1.327770E-01 733 1003 4.867970E-01 1.547020E-01 1.327660E-01 733 1004 4.872710E-01 1.367610E-01 1.327580E-01 733 1005 4.877440E-01 1.714160E-01 1.327540E-01 733 1006 4.882180E-01 1.671700E-01 1.327540E-01 733 1007 4.886920E-01 2.043280E-01 1.327570E-01 733 1008 4.891650E-01 2.100720E-01 1.327640E-01 733 1009 4.896390E-01 1.971490E-01 1.327750E-01 733 1010 4.901130E-01 1.696280E-01 1.327890E-01 733 1011 4.905860E-01 1.196520E-01 1.328060E-01 733 1012 4.910600E-01 1.488840E-01 1.328270E-01 733 1013 4.915340E-01 1.376210E-01 1.328510E-01 733 1014 4.920070E-01 1.833960E-01 1.328780E-01 733 1015 4.924810E-01 2.390740E-01 1.329080E-01 733 1016 4.929540E-01 2.344390E-01 1.329400E-01 733 1017 4.934280E-01 1.304220E-01 1.329750E-01 733 1018 4.939020E-01 1.003100E-01 1.330130E-01 733 1019 4.943750E-01 1.373710E-01 1.330550E-01 733 1020 4.948490E-01 1.851790E-01 1.330990E-01 733 1021 4.953230E-01 2.317170E-01 1.331480E-01 733 1022 4.957960E-01 1.233510E-01 1.332000E-01 733 1023 4.962700E-01 -4.396230E-04 1.332550E-01 # data_SASDBG9_MODEL_1121 # _sas_model.id 1121 _sas_model.type_of_model mix _sas_model.version 2.7.2 _sas_model.symmetry . _sas_model.comment "Tungstate group was added manually by homology to related structures" _sas_model.fitting_id 733 _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 C CA . MET A 1121 1 . -19.640 43.968 -11.731 1.00 20.00 ? ? ? ? ? . 1 MET A CA 1121 ATOM 2 C CA . ALA A 1121 2 . -17.532 42.807 -14.672 1.00 20.00 ? ? ? ? ? . 2 ALA A CA 1121 ATOM 3 C CA . HIS A 1121 3 . -15.045 45.629 -14.124 1.00 20.00 ? ? ? ? ? . 3 HIS A CA 1121 ATOM 4 C CA . HIS A 1121 4 . -12.111 43.323 -13.407 1.00 20.00 ? ? ? ? ? . 4 HIS A CA 1121 ATOM 5 C CA . HIS A 1121 5 . -14.141 41.847 -10.553 1.00 20.00 ? ? ? ? ? . 5 HIS A CA 1121 ATOM 6 C CA . HIS A 1121 6 . -14.146 38.065 -10.930 1.00 20.00 ? ? ? ? ? . 6 HIS A CA 1121 ATOM 7 C CA . HIS A 1121 7 . -10.467 38.059 -11.880 1.00 20.00 ? ? ? ? ? . 7 HIS A CA 1121 ATOM 8 C CA . HIS A 1121 8 . -9.191 39.989 -8.866 1.00 20.00 ? ? ? ? ? . 8 HIS A CA 1121 ATOM 9 C CA . VAL A 1121 9 . -5.536 40.717 -9.614 1.00 20.00 ? ? ? ? ? . 9 VAL A CA 1121 ATOM 10 C CA . ASP A 1121 10 . -5.013 43.321 -6.895 1.00 20.00 ? ? ? ? ? . 10 ASP A CA 1121 ATOM 11 C CA . ASP A 1121 11 . -7.765 43.240 -4.277 1.00 20.00 ? ? ? ? ? . 11 ASP A CA 1121 ATOM 12 C CA . ASP A 1121 12 . -7.271 39.526 -3.640 1.00 20.00 ? ? ? ? ? . 12 ASP A CA 1121 ATOM 13 C CA . ASP A 1121 13 . -3.631 38.495 -3.274 1.00 20.00 ? ? ? ? ? . 13 ASP A CA 1121 ATOM 14 C CA . LYS A 1121 14 . -2.743 36.810 -6.562 1.00 20.00 ? ? ? ? ? . 14 LYS A CA 1121 ATOM 15 C CA . MET A 1121 15 . -1.720 33.575 -4.849 1.00 20.00 ? ? ? ? ? . 15 MET A CA 1121 ATOM 16 C CA . LEU A 1121 16 . -3.940 33.673 -1.766 1.00 20.00 ? ? ? ? ? . 16 LEU A CA 1121 ATOM 17 C CA . GLU A 1121 17 . -5.016 36.139 0.917 1.00 20.00 ? ? ? ? ? . 17 GLU A CA 1121 ATOM 18 C CA . VAL A 1121 18 . -3.006 34.473 3.678 1.00 20.00 ? ? ? ? ? . 18 VAL A CA 1121 ATOM 19 C CA . LEU A 1121 19 . -6.037 32.223 4.118 1.00 20.00 ? ? ? ? ? . 19 LEU A CA 1121 ATOM 20 C CA . PHE A 1121 20 . -9.368 32.171 2.290 1.00 20.00 ? ? ? ? ? . 20 PHE A CA 1121 ATOM 21 C CA . GLN A 1121 21 . -10.302 29.134 0.205 1.00 20.00 ? ? ? ? ? . 21 GLN A CA 1121 ATOM 22 C CA . GLY A 1121 22 . -9.949 25.609 1.582 1.00 20.00 ? ? ? ? ? . 22 GLY A CA 1121 ATOM 23 C CA . PRO A 1121 23 . -6.397 24.293 1.878 1.00 20.00 ? ? ? ? ? . 23 PRO A CA 1121 ATOM 24 C CA . GLU A 1121 24 . -4.442 23.842 5.105 1.00 20.00 ? ? ? ? ? . 24 GLU A CA 1121 ATOM 25 N N . ALA A 1121 25 . -1.409 27.536 4.650 1.00 20.00 ? ? ? ? ? . 25 ALA A N 1121 ATOM 26 C CA . ALA A 1121 25 . -1.939 26.375 3.958 1.00 20.00 ? ? ? ? ? . 25 ALA A CA 1121 ATOM 27 C C . ALA A 1121 25 . -2.887 25.638 4.835 1.00 20.00 ? ? ? ? ? . 25 ALA A C 1121 ATOM 28 O O . ALA A 1121 25 . -2.562 25.252 5.909 1.00 20.00 ? ? ? ? ? . 25 ALA A O 1121 ATOM 29 C CB . ALA A 1121 25 . -0.854 25.419 3.492 1.00 20.00 ? ? ? ? ? . 25 ALA A CB 1121 ATOM 30 N N . PRO A 1121 26 . -4.148 25.427 4.271 1.00 20.00 ? ? ? ? ? . 26 PRO A N 1121 ATOM 31 C CA . PRO A 1121 26 . -4.909 24.356 4.909 1.00 20.00 ? ? ? ? ? . 26 PRO A CA 1121 ATOM 32 C C . PRO A 1121 26 . -4.083 23.075 5.061 1.00 20.00 ? ? ? ? ? . 26 PRO A C 1121 ATOM 33 O O . PRO A 1121 26 . -3.208 22.853 4.304 1.00 20.00 ? ? ? ? ? . 26 PRO A O 1121 ATOM 34 C CB . PRO A 1121 26 . -6.054 24.121 3.975 1.00 20.00 ? ? ? ? ? . 26 PRO A CB 1121 ATOM 35 C CG . PRO A 1121 26 . -5.785 24.812 2.744 1.00 20.00 ? ? ? ? ? . 26 PRO A CG 1121 ATOM 36 C CD . PRO A 1121 26 . -5.008 25.954 3.104 1.00 20.00 ? ? ? ? ? . 26 PRO A CD 1121 ATOM 37 N N . VAL A 1121 27 . -4.343 22.337 6.120 1.00 20.00 ? ? ? ? ? . 27 VAL A N 1121 ATOM 38 C CA . VAL A 1121 27 . -3.590 21.155 6.424 1.00 20.00 ? ? ? ? ? . 27 VAL A CA 1121 ATOM 39 C C . VAL A 1121 27 . -4.523 19.959 6.546 1.00 20.00 ? ? ? ? ? . 27 VAL A C 1121 ATOM 40 O O . VAL A 1121 27 . -5.455 19.982 7.271 1.00 20.00 ? ? ? ? ? . 27 VAL A O 1121 ATOM 41 C CB . VAL A 1121 27 . -2.847 21.314 7.717 1.00 20.00 ? ? ? ? ? . 27 VAL A CB 1121 ATOM 42 C CG1 . VAL A 1121 27 . -2.038 20.089 8.002 1.00 20.00 ? ? ? ? ? . 27 VAL A CG1 1121 ATOM 43 C CG2 . VAL A 1121 27 . -1.920 22.490 7.670 1.00 20.00 ? ? ? ? ? . 27 VAL A CG2 1121 ATOM 44 N N . LEU A 1121 28 . -4.214 18.934 5.779 1.00 20.00 ? ? ? ? ? . 28 LEU A N 1121 ATOM 45 C CA . LEU A 1121 28 . -4.969 17.689 5.783 1.00 20.00 ? ? ? ? ? . 28 LEU A CA 1121 ATOM 46 C C . LEU A 1121 28 . -4.133 16.659 6.533 1.00 20.00 ? ? ? ? ? . 28 LEU A C 1121 ATOM 47 O O . LEU A 1121 28 . -2.982 16.440 6.170 1.00 20.00 ? ? ? ? ? . 28 LEU A O 1121 ATOM 48 C CB . LEU A 1121 28 . -5.232 17.229 4.342 1.00 20.00 ? ? ? ? ? . 28 LEU A CB 1121 ATOM 49 C CG . LEU A 1121 28 . -5.848 15.833 4.131 1.00 20.00 ? ? ? ? ? . 28 LEU A CG 1121 ATOM 50 C CD1 . LEU A 1121 28 . -7.210 15.699 4.783 1.00 20.00 ? ? ? ? ? . 28 LEU A CD1 1121 ATOM 51 C CD2 . LEU A 1121 28 . -5.982 15.512 2.651 1.00 20.00 ? ? ? ? ? . 28 LEU A CD2 1121 ATOM 52 N N . MET A 1121 29 . -4.715 16.034 7.557 1.00 20.00 ? ? ? ? ? . 29 MET A N 1121 ATOM 53 C CA . MET A 1121 29 . -4.012 15.053 8.399 1.00 20.00 ? ? ? ? ? . 29 MET A CA 1121 ATOM 54 C C . MET A 1121 29 . -4.447 13.648 8.004 1.00 20.00 ? ? ? ? ? . 29 MET A C 1121 ATOM 55 O O . MET A 1121 29 . -5.640 13.330 7.985 1.00 20.00 ? ? ? ? ? . 29 MET A O 1121 ATOM 56 C CB . MET A 1121 29 . -4.323 15.243 9.886 1.00 20.00 ? ? ? ? ? . 29 MET A CB 1121 ATOM 57 C CG . MET A 1121 29 . -4.032 16.621 10.472 1.00 20.00 ? ? ? ? ? . 29 MET A CG 1121 ATOM 58 S SD . MET A 1121 29 . -2.346 17.196 10.147 1.00 20.00 ? ? ? ? ? . 29 MET A SD 1121 ATOM 59 C CE . MET A 1121 29 . -1.419 16.172 11.279 1.00 20.00 ? ? ? ? ? . 29 MET A CE 1121 ATOM 60 N N . MET A 1121 30 . -3.463 12.805 7.733 1.00 20.00 ? ? ? ? ? . 30 MET A N 1121 ATOM 61 C CA . MET A 1121 30 . -3.695 11.456 7.241 1.00 20.00 ? ? ? ? ? . 30 MET A CA 1121 ATOM 62 C C . MET A 1121 30 . -3.062 10.442 8.166 1.00 20.00 ? ? ? ? ? . 30 MET A C 1121 ATOM 63 O O . MET A 1121 30 . -1.996 10.662 8.707 1.00 20.00 ? ? ? ? ? . 30 MET A O 1121 ATOM 64 C CB . MET A 1121 30 . -3.098 11.302 5.847 1.00 20.00 ? ? ? ? ? . 30 MET A CB 1121 ATOM 65 C CG . MET A 1121 30 . -2.907 9.859 5.380 1.00 20.00 ? ? ? ? ? . 30 MET A CG 1121 ATOM 66 S SD . MET A 1121 30 . -2.134 9.751 3.741 1.00 20.00 ? ? ? ? ? . 30 MET A SD 1121 ATOM 67 C CE . MET A 1121 30 . -3.440 10.386 2.731 1.00 20.00 ? ? ? ? ? . 30 MET A CE 1121 ATOM 68 N N . ALA A 1121 31 . -3.731 9.309 8.328 1.00 20.00 ? ? ? ? ? . 31 ALA A N 1121 ATOM 69 C CA . ALA A 1121 31 . -3.085 8.134 8.892 1.00 20.00 ? ? ? ? ? . 31 ALA A CA 1121 ATOM 70 C C . ALA A 1121 31 . -2.926 7.116 7.780 1.00 20.00 ? ? ? ? ? . 31 ALA A C 1121 ATOM 71 O O . ALA A 1121 31 . -3.857 6.862 7.020 1.00 20.00 ? ? ? ? ? . 31 ALA A O 1121 ATOM 72 C CB . ALA A 1121 31 . -3.906 7.552 10.026 1.00 20.00 ? ? ? ? ? . 31 ALA A CB 1121 ATOM 73 N N . THR A 1121 32 . -1.727 6.555 7.662 1.00 20.00 ? ? ? ? ? . 32 THR A N 1121 ATOM 74 C CA . THR A 1121 32 . -1.443 5.529 6.673 1.00 20.00 ? ? ? ? ? . 32 THR A CA 1121 ATOM 75 C C . THR A 1121 32 . -0.557 4.473 7.308 1.00 20.00 ? ? ? ? ? . 32 THR A C 1121 ATOM 76 O O . THR A 1121 32 . -0.364 4.492 8.508 1.00 20.00 ? ? ? ? ? . 32 THR A O 1121 ATOM 77 C CB . THR A 1121 32 . -0.796 6.128 5.431 1.00 20.00 ? ? ? ? ? . 32 THR A CB 1121 ATOM 78 C CG2 . THR A 1121 32 . 0.621 6.627 5.711 1.00 20.00 ? ? ? ? ? . 32 THR A CG2 1121 ATOM 79 O OG1 . THR A 1121 32 . -0.773 5.148 4.386 1.00 20.00 ? ? ? ? ? . 32 THR A OG1 1121 ATOM 80 N N . THR A 1121 33 . -0.036 3.548 6.512 1.00 20.00 ? ? ? ? ? . 33 THR A N 1121 ATOM 81 C CA . THR A 1121 33 . 0.708 2.439 7.084 1.00 20.00 ? ? ? ? ? . 33 THR A CA 1121 ATOM 82 C C . THR A 1121 33 . 2.207 2.543 6.891 1.00 20.00 ? ? ? ? ? . 33 THR A C 1121 ATOM 83 O O . THR A 1121 33 . 2.684 3.224 5.994 1.00 20.00 ? ? ? ? ? . 33 THR A O 1121 ATOM 84 C CB . THR A 1121 33 . 0.260 1.112 6.522 1.00 20.00 ? ? ? ? ? . 33 THR A CB 1121 ATOM 85 C CG2 . THR A 1121 33 . -1.270 0.952 6.618 1.00 20.00 ? ? ? ? ? . 33 THR A CG2 1121 ATOM 86 O OG1 . THR A 1121 33 . 0.693 1.001 5.160 1.00 20.00 ? ? ? ? ? . 33 THR A OG1 1121 ATOM 87 N N . THR A 1121 34 . 2.937 1.839 7.748 1.00 20.00 ? ? ? ? ? . 34 THR A N 1121 ATOM 88 C CA . THR A 1121 34 . 4.383 1.761 7.674 1.00 20.00 ? ? ? ? ? . 34 THR A CA 1121 ATOM 89 C C . THR A 1121 34 . 4.835 1.301 6.295 1.00 20.00 ? ? ? ? ? . 34 THR A C 1121 ATOM 90 O O . THR A 1121 34 . 5.720 1.895 5.695 1.00 20.00 ? ? ? ? ? . 34 THR A O 1121 ATOM 91 C CB . THR A 1121 34 . 4.886 0.796 8.746 1.00 20.00 ? ? ? ? ? . 34 THR A CB 1121 ATOM 92 C CG2 . THR A 1121 34 . 6.415 0.680 8.725 1.00 20.00 ? ? ? ? ? . 34 THR A CG2 1121 ATOM 93 O OG1 . THR A 1121 34 . 4.439 1.266 10.027 1.00 20.00 ? ? ? ? ? . 34 THR A OG1 1121 ATOM 94 N N . SER A 1121 35 . 4.202 0.273 5.754 1.00 20.00 ? ? ? ? ? . 35 SER A N 1121 ATOM 95 C CA . SER A 1121 35 . 4.648 -0.223 4.468 1.00 20.00 ? ? ? ? ? . 35 SER A CA 1121 ATOM 96 C C . SER A 1121 35 . 4.424 0.850 3.410 1.00 20.00 ? ? ? ? ? . 35 SER A C 1121 ATOM 97 O O . SER A 1121 35 . 5.261 1.026 2.521 1.00 20.00 ? ? ? ? ? . 35 SER A O 1121 ATOM 98 C CB . SER A 1121 35 . 3.957 -1.534 4.080 1.00 20.00 ? ? ? ? ? . 35 SER A CB 1121 ATOM 99 O OG . SER A 1121 35 . 2.571 -1.396 3.983 1.00 20.00 ? ? ? ? ? . 35 SER A OG 1121 ATOM 100 N N . THR A 1121 36 . 3.312 1.579 3.521 1.00 20.00 ? ? ? ? ? . 36 THR A N 1121 ATOM 101 C CA . THR A 1121 36 . 3.017 2.646 2.560 1.00 20.00 ? ? ? ? ? . 36 THR A CA 1121 ATOM 102 C C . THR A 1121 36 . 4.133 3.686 2.595 1.00 20.00 ? ? ? ? ? . 36 THR A C 1121 ATOM 103 O O . THR A 1121 36 . 4.675 4.111 1.566 1.00 20.00 ? ? ? ? ? . 36 THR A O 1121 ATOM 104 C CB . THR A 1121 36 . 1.673 3.330 2.850 1.00 20.00 ? ? ? ? ? . 36 THR A CB 1121 ATOM 105 C CG2 . THR A 1121 36 . 1.338 4.376 1.767 1.00 20.00 ? ? ? ? ? . 36 THR A CG2 1121 ATOM 106 O OG1 . THR A 1121 36 . 0.627 2.361 2.878 1.00 20.00 ? ? ? ? ? . 36 THR A OG1 1121 ATOM 107 N N . ASP A 1121 37 . 4.463 4.117 3.795 1.00 20.00 ? ? ? ? ? . 37 ASP A N 1121 ATOM 108 C CA . ASP A 1121 37 . 5.499 5.121 3.963 1.00 20.00 ? ? ? ? ? . 37 ASP A CA 1121 ATOM 109 C C . ASP A 1121 37 . 6.848 4.656 3.424 1.00 20.00 ? ? ? ? ? . 37 ASP A C 1121 ATOM 110 O O . ASP A 1121 37 . 7.581 5.429 2.796 1.00 20.00 ? ? ? ? ? . 37 ASP A O 1121 ATOM 111 C CB . ASP A 1121 37 . 5.611 5.514 5.428 1.00 20.00 ? ? ? ? ? . 37 ASP A CB 1121 ATOM 112 C CG . ASP A 1121 37 . 6.590 6.642 5.646 1.00 20.00 ? ? ? ? ? . 37 ASP A CG 1121 ATOM 113 O OD1 . ASP A 1121 37 . 6.354 7.766 5.137 1.00 20.00 ? ? ? ? ? . 37 ASP A OD1 1121 ATOM 114 O OD2 . ASP A 1121 37 . 7.599 6.401 6.323 1.00 20.00 ? ? ? ? ? 1- 37 ASP A OD2 1121 ATOM 115 N N . ASN A 1121 38 . 7.163 3.385 3.647 1.00 20.00 ? ? ? ? ? . 38 ASN A N 1121 ATOM 116 C CA . ASN A 1121 38 . 8.415 2.815 3.160 1.00 20.00 ? ? ? ? ? . 38 ASN A CA 1121 ATOM 117 C C . ASN A 1121 38 . 8.581 2.854 1.638 1.00 20.00 ? ? ? ? ? . 38 ASN A C 1121 ATOM 118 O O . ASN A 1121 38 . 9.718 2.871 1.155 1.00 20.00 ? ? ? ? ? . 38 ASN A O 1121 ATOM 119 C CB . ASN A 1121 38 . 8.580 1.385 3.666 1.00 20.00 ? ? ? ? ? . 38 ASN A CB 1121 ATOM 120 C CG . ASN A 1121 38 . 8.833 1.331 5.156 1.00 20.00 ? ? ? ? ? . 38 ASN A CG 1121 ATOM 121 N ND2 . ASN A 1121 38 . 8.636 0.161 5.753 1.00 20.00 ? ? ? ? ? . 38 ASN A ND2 1121 ATOM 122 O OD1 . ASN A 1121 38 . 9.211 2.332 5.762 1.00 20.00 ? ? ? ? ? . 38 ASN A OD1 1121 ATOM 123 N N . THR A 1121 39 . 7.475 2.871 0.887 1.00 20.00 ? ? ? ? ? . 39 THR A N 1121 ATOM 124 C CA . THR A 1121 39 . 7.568 2.911 -0.573 1.00 20.00 ? ? ? ? ? . 39 THR A CA 1121 ATOM 125 C C . THR A 1121 39 . 8.075 4.253 -1.067 1.00 20.00 ? ? ? ? ? . 39 THR A C 1121 ATOM 126 O O . THR A 1121 39 . 8.605 4.349 -2.166 1.00 20.00 ? ? ? ? ? . 39 THR A O 1121 ATOM 127 C CB . THR A 1121 39 . 6.227 2.635 -1.307 1.00 20.00 ? ? ? ? ? . 39 THR A CB 1121 ATOM 128 C CG2 . THR A 1121 39 . 5.613 1.310 -0.863 1.00 20.00 ? ? ? ? ? . 39 THR A CG2 1121 ATOM 129 O OG1 . THR A 1121 39 . 5.306 3.720 -1.108 1.00 20.00 ? ? ? ? ? . 39 THR A OG1 1121 ATOM 130 N N . GLY A 1121 40 . 7.855 5.297 -0.277 1.00 20.00 ? ? ? ? ? . 40 GLY A N 1121 ATOM 131 C CA . GLY A 1121 40 . 8.230 6.634 -0.693 1.00 20.00 ? ? ? ? ? . 40 GLY A CA 1121 ATOM 132 C C . GLY A 1121 40 . 7.223 7.328 -1.600 1.00 20.00 ? ? ? ? ? . 40 GLY A C 1121 ATOM 133 O O . GLY A 1121 40 . 7.438 8.467 -2.008 1.00 20.00 ? ? ? ? ? . 40 GLY A O 1121 ATOM 134 N N . LEU A 1121 41 . 6.117 6.657 -1.905 1.00 20.00 ? ? ? ? ? . 41 LEU A N 1121 ATOM 135 C CA . LEU A 1121 41 . 5.123 7.227 -2.817 1.00 20.00 ? ? ? ? ? . 41 LEU A CA 1121 ATOM 136 C C . LEU A 1121 41 . 4.600 8.582 -2.345 1.00 20.00 ? ? ? ? ? . 41 LEU A C 1121 ATOM 137 O O . LEU A 1121 41 . 4.455 9.499 -3.141 1.00 20.00 ? ? ? ? ? . 41 LEU A O 1121 ATOM 138 C CB . LEU A 1121 41 . 3.946 6.273 -3.018 1.00 20.00 ? ? ? ? ? . 41 LEU A CB 1121 ATOM 139 C CG . LEU A 1121 41 . 2.792 6.783 -3.899 1.00 20.00 ? ? ? ? ? . 41 LEU A CG 1121 ATOM 140 C CD1 . LEU A 1121 41 . 3.246 6.931 -5.333 1.00 20.00 ? ? ? ? ? . 41 LEU A CD1 1121 ATOM 141 C CD2 . LEU A 1121 41 . 1.575 5.868 -3.825 1.00 20.00 ? ? ? ? ? . 41 LEU A CD2 1121 ATOM 142 N N . LEU A 1121 42 . 4.306 8.699 -1.060 1.00 20.00 ? ? ? ? ? . 42 LEU A N 1121 ATOM 143 C CA . LEU A 1121 42 . 3.699 9.921 -0.547 1.00 20.00 ? ? ? ? ? . 42 LEU A CA 1121 ATOM 144 C C . LEU A 1121 42 . 4.692 11.074 -0.573 1.00 20.00 ? ? ? ? ? . 42 LEU A C 1121 ATOM 145 O O . LEU A 1121 42 . 4.288 12.221 -0.725 1.00 20.00 ? ? ? ? ? . 42 LEU A O 1121 ATOM 146 C CB . LEU A 1121 42 . 3.147 9.734 0.863 1.00 20.00 ? ? ? ? ? . 42 LEU A CB 1121 ATOM 147 C CG . LEU A 1121 42 . 1.886 8.871 0.949 1.00 20.00 ? ? ? ? ? . 42 LEU A CG 1121 ATOM 148 C CD1 . LEU A 1121 42 . 1.559 8.563 2.382 1.00 20.00 ? ? ? ? ? . 42 LEU A CD1 1121 ATOM 149 C CD2 . LEU A 1121 42 . 0.705 9.554 0.273 1.00 20.00 ? ? ? ? ? . 42 LEU A CD2 1121 ATOM 150 N N . ASP A 1121 43 . 5.984 10.771 -0.443 1.00 20.00 ? ? ? ? ? . 43 ASP A N 1121 ATOM 151 C CA . ASP A 1121 43 . 7.015 11.800 -0.516 1.00 20.00 ? ? ? ? ? . 43 ASP A CA 1121 ATOM 152 C C . ASP A 1121 43 . 7.041 12.425 -1.898 1.00 20.00 ? ? ? ? ? . 43 ASP A C 1121 ATOM 153 O O . ASP A 1121 43 . 7.357 13.601 -2.029 1.00 20.00 ? ? ? ? ? . 43 ASP A O 1121 ATOM 154 C CB . ASP A 1121 43 . 8.395 11.225 -0.192 1.00 20.00 ? ? ? ? ? . 43 ASP A CB 1121 ATOM 155 C CG . ASP A 1121 43 . 8.502 10.726 1.238 1.00 20.00 ? ? ? ? ? . 43 ASP A CG 1121 ATOM 156 O OD1 . ASP A 1121 43 . 8.143 11.476 2.159 1.00 20.00 ? ? ? ? ? . 43 ASP A OD1 1121 ATOM 157 O OD2 . ASP A 1121 43 . 8.961 9.582 1.438 1.00 20.00 ? ? ? ? ? 1- 43 ASP A OD2 1121 ATOM 158 N N . ASP A 1121 44 . 6.714 11.634 -2.916 1.00 20.00 ? ? ? ? ? . 44 ASP A N 1121 ATOM 159 C CA . ASP A 1121 44 . 6.579 12.132 -4.293 1.00 20.00 ? ? ? ? ? . 44 ASP A CA 1121 ATOM 160 C C . ASP A 1121 44 . 5.244 12.827 -4.538 1.00 20.00 ? ? ? ? ? . 44 ASP A C 1121 ATOM 161 O O . ASP A 1121 44 . 5.196 13.867 -5.202 1.00 20.00 ? ? ? ? ? . 44 ASP A O 1121 ATOM 162 C CB . ASP A 1121 44 . 6.680 10.973 -5.290 1.00 20.00 ? ? ? ? ? . 44 ASP A CB 1121 ATOM 163 C CG . ASP A 1121 44 . 8.018 10.900 -5.970 1.00 20.00 ? ? ? ? ? . 44 ASP A CG 1121 ATOM 164 O OD1 . ASP A 1121 44 . 9.052 10.958 -5.262 1.00 20.00 ? ? ? ? ? . 44 ASP A OD1 1121 ATOM 165 O OD2 . ASP A 1121 44 . 8.033 10.774 -7.217 1.00 20.00 ? ? ? ? ? 1- 44 ASP A OD2 1121 ATOM 166 N N . LEU A 1121 45 . 4.159 12.234 -4.030 1.00 20.00 ? ? ? ? ? . 45 LEU A N 1121 ATOM 167 C CA . LEU A 1121 45 . 2.823 12.755 -4.298 1.00 20.00 ? ? ? ? ? . 45 LEU A CA 1121 ATOM 168 C C . LEU A 1121 45 . 2.515 14.030 -3.535 1.00 20.00 ? ? ? ? ? . 45 LEU A C 1121 ATOM 169 O O . LEU A 1121 45 . 1.891 14.933 -4.080 1.00 20.00 ? ? ? ? ? . 45 LEU A O 1121 ATOM 170 C CB . LEU A 1121 45 . 1.739 11.718 -3.980 1.00 20.00 ? ? ? ? ? . 45 LEU A CB 1121 ATOM 171 C CG . LEU A 1121 45 . 1.675 10.476 -4.871 1.00 20.00 ? ? ? ? ? . 45 LEU A CG 1121 ATOM 172 C CD1 . LEU A 1121 45 . 0.535 9.563 -4.427 1.00 20.00 ? ? ? ? ? . 45 LEU A CD1 1121 ATOM 173 C CD2 . LEU A 1121 45 . 1.545 10.806 -6.364 1.00 20.00 ? ? ? ? ? . 45 LEU A CD2 1121 ATOM 174 N N . ALA A 1121 46 . 2.924 14.106 -2.278 1.00 20.00 ? ? ? ? ? . 46 ALA A N 1121 ATOM 175 C CA . ALA A 1121 46 . 2.475 15.207 -1.427 1.00 20.00 ? ? ? ? ? . 46 ALA A CA 1121 ATOM 176 C C . ALA A 1121 46 . 2.810 16.611 -1.974 1.00 20.00 ? ? ? ? ? . 46 ALA A C 1121 ATOM 177 O O . ALA A 1121 46 . 1.953 17.482 -1.981 1.00 20.00 ? ? ? ? ? . 46 ALA A O 1121 ATOM 178 C CB . ALA A 1121 46 . 2.983 15.034 -0.005 1.00 20.00 ? ? ? ? ? . 46 ALA A CB 1121 ATOM 179 N N . PRO A 1121 47 . 4.042 16.825 -2.458 1.00 20.00 ? ? ? ? ? . 47 PRO A N 1121 ATOM 180 C CA . PRO A 1121 47 . 4.334 18.160 -3.000 1.00 20.00 ? ? ? ? ? . 47 PRO A CA 1121 ATOM 181 C C . PRO A 1121 47 . 3.476 18.467 -4.217 1.00 20.00 ? ? ? ? ? . 47 PRO A C 1121 ATOM 182 O O . PRO A 1121 47 . 3.099 19.616 -4.411 1.00 20.00 ? ? ? ? ? . 47 PRO A O 1121 ATOM 183 C CB . PRO A 1121 47 . 5.818 18.088 -3.391 1.00 20.00 ? ? ? ? ? . 47 PRO A CB 1121 ATOM 184 C CG . PRO A 1121 47 . 6.361 16.899 -2.658 1.00 20.00 ? ? ? ? ? . 47 PRO A CG 1121 ATOM 185 C CD . PRO A 1121 47 . 5.232 15.964 -2.376 1.00 20.00 ? ? ? ? ? . 47 PRO A CD 1121 ATOM 186 N N . GLN A 1121 48 . 3.161 17.465 -5.029 1.00 20.00 ? ? ? ? ? . 48 GLN A N 1121 ATOM 187 C CA . GLN A 1121 48 . 2.326 17.675 -6.209 1.00 20.00 ? ? ? ? ? . 48 GLN A CA 1121 ATOM 188 C C . GLN A 1121 48 . 0.881 17.999 -5.792 1.00 20.00 ? ? ? ? ? . 48 GLN A C 1121 ATOM 189 O O . GLN A 1121 48 . 0.241 18.856 -6.364 1.00 20.00 ? ? ? ? ? . 48 GLN A O 1121 ATOM 190 C CB . GLN A 1121 48 . 2.393 16.451 -7.138 1.00 20.00 ? ? ? ? ? . 48 GLN A CB 1121 ATOM 191 C CG . GLN A 1121 48 . 3.798 16.208 -7.742 1.00 20.00 ? ? ? ? ? . 48 GLN A CG 1121 ATOM 192 C CD . GLN A 1121 48 . 3.911 14.940 -8.600 1.00 20.00 ? ? ? ? ? . 48 GLN A CD 1121 ATOM 193 N NE2 . GLN A 1121 48 . 4.427 13.869 -8.006 1.00 20.00 ? ? ? ? ? . 48 GLN A NE2 1121 ATOM 194 O OE1 . GLN A 1121 48 . 3.578 14.940 -9.785 1.00 20.00 ? ? ? ? ? . 48 GLN A OE1 1121 ATOM 195 N N . PHE A 1121 49 . 0.377 17.307 -4.777 1.00 20.00 ? ? ? ? ? . 49 PHE A N 1121 ATOM 196 C CA . PHE A 1121 49 . -0.944 17.578 -4.240 1.00 20.00 ? ? ? ? ? . 49 PHE A CA 1121 ATOM 197 C C . PHE A 1121 49 . -1.011 19.030 -3.764 1.00 20.00 ? ? ? ? ? . 49 PHE A C 1121 ATOM 198 O O . PHE A 1121 49 . -1.969 19.736 -4.059 1.00 20.00 ? ? ? ? ? . 49 PHE A O 1121 ATOM 199 C CB . PHE A 1121 49 . -1.233 16.607 -3.081 1.00 20.00 ? ? ? ? ? . 49 PHE A CB 1121 ATOM 200 C CG . PHE A 1121 49 . -2.518 16.897 -2.324 1.00 20.00 ? ? ? ? ? . 49 PHE A CG 1121 ATOM 201 C CD1 . PHE A 1121 49 . -3.742 16.855 -2.960 1.00 20.00 ? ? ? ? ? . 49 PHE A CD1 1121 ATOM 202 C CD2 . PHE A 1121 49 . -2.488 17.188 -0.964 1.00 20.00 ? ? ? ? ? . 49 PHE A CD2 1121 ATOM 203 C CE1 . PHE A 1121 49 . -4.929 17.109 -2.256 1.00 20.00 ? ? ? ? ? . 49 PHE A CE1 1121 ATOM 204 C CE2 . PHE A 1121 49 . -3.660 17.438 -0.263 1.00 20.00 ? ? ? ? ? . 49 PHE A CE2 1121 ATOM 205 C CZ . PHE A 1121 49 . -4.881 17.397 -0.913 1.00 20.00 ? ? ? ? ? . 49 PHE A CZ 1121 ATOM 206 N N . THR A 1121 50 . 0.014 19.484 -3.056 1.00 20.00 ? ? ? ? ? . 50 THR A N 1121 ATOM 207 C CA . THR A 1121 50 . 0.019 20.856 -2.540 1.00 20.00 ? ? ? ? ? . 50 THR A CA 1121 ATOM 208 C C . THR A 1121 50 . 0.107 21.878 -3.677 1.00 20.00 ? ? ? ? ? . 50 THR A C 1121 ATOM 209 O O . THR A 1121 50 . -0.592 22.893 -3.643 1.00 20.00 ? ? ? ? ? . 50 THR A O 1121 ATOM 210 C CB . THR A 1121 50 . 1.166 21.080 -1.537 1.00 20.00 ? ? ? ? ? . 50 THR A CB 1121 ATOM 211 C CG2 . THR A 1121 50 . 1.194 22.519 -1.002 1.00 20.00 ? ? ? ? ? . 50 THR A CG2 1121 ATOM 212 O OG1 . THR A 1121 50 . 1.022 20.171 -0.442 1.00 20.00 ? ? ? ? ? . 50 THR A OG1 1121 ATOM 213 N N . LYS A 1121 51 . 0.936 21.604 -4.681 1.00 20.00 ? ? ? ? ? . 51 LYS A N 1121 ATOM 214 C CA . LYS A 1121 51 . 1.026 22.462 -5.853 1.00 20.00 ? ? ? ? ? . 51 LYS A CA 1121 ATOM 215 C C . LYS A 1121 51 . -0.336 22.605 -6.520 1.00 20.00 ? ? ? ? ? . 51 LYS A C 1121 ATOM 216 O O . LYS A 1121 51 . -0.733 23.711 -6.924 1.00 20.00 ? ? ? ? ? . 51 LYS A O 1121 ATOM 217 C CB . LYS A 1121 51 . 2.011 21.867 -6.856 1.00 20.00 ? ? ? ? ? . 51 LYS A CB 1121 ATOM 218 C CG . LYS A 1121 51 . 2.239 22.737 -8.073 1.00 20.00 ? ? ? ? ? . 51 LYS A CG 1121 ATOM 219 C CD . LYS A 1121 51 . 3.347 22.190 -8.947 1.00 20.00 ? ? ? ? ? . 51 LYS A CD 1121 ATOM 220 C CE . LYS A 1121 51 . 2.893 20.966 -9.737 1.00 20.00 ? ? ? ? ? . 51 LYS A CE 1121 ATOM 221 N NZ . LYS A 1121 51 . 3.976 20.440 -10.626 1.00 20.00 ? ? ? ? ? 1+ 51 LYS A NZ 1121 ATOM 222 N N . ASP A 1121 52 . -1.033 21.482 -6.667 1.00 20.00 ? ? ? ? ? . 52 ASP A N 1121 ATOM 223 C CA . ASP A 1121 52 . -2.276 21.466 -7.437 1.00 20.00 ? ? ? ? ? . 52 ASP A CA 1121 ATOM 224 C C . ASP A 1121 52 . -3.495 21.977 -6.663 1.00 20.00 ? ? ? ? ? . 52 ASP A C 1121 ATOM 225 O O . ASP A 1121 52 . -4.443 22.482 -7.279 1.00 20.00 ? ? ? ? ? . 52 ASP A O 1121 ATOM 226 C CB . ASP A 1121 52 . -2.574 20.054 -7.943 1.00 20.00 ? ? ? ? ? . 52 ASP A CB 1121 ATOM 227 C CG . ASP A 1121 52 . -1.536 19.544 -8.919 1.00 20.00 ? ? ? ? ? . 52 ASP A CG 1121 ATOM 228 O OD1 . ASP A 1121 52 . -0.764 20.364 -9.479 1.00 20.00 ? ? ? ? ? . 52 ASP A OD1 1121 ATOM 229 O OD2 . ASP A 1121 52 . -1.502 18.309 -9.135 1.00 20.00 ? ? ? ? ? 1- 52 ASP A OD2 1121 ATOM 230 N N . THR A 1121 53 . -3.471 21.876 -5.334 1.00 20.00 ? ? ? ? ? . 53 THR A N 1121 ATOM 231 C CA . THR A 1121 53 . -4.671 22.143 -4.533 1.00 20.00 ? ? ? ? ? . 53 THR A CA 1121 ATOM 232 C C . THR A 1121 53 . -4.493 23.178 -3.428 1.00 20.00 ? ? ? ? ? . 53 THR A C 1121 ATOM 233 O O . THR A 1121 53 . -5.484 23.630 -2.832 1.00 20.00 ? ? ? ? ? . 53 THR A O 1121 ATOM 234 C CB . THR A 1121 53 . -5.195 20.867 -3.845 1.00 20.00 ? ? ? ? ? . 53 THR A CB 1121 ATOM 235 C CG2 . THR A 1121 53 . -5.322 19.726 -4.810 1.00 20.00 ? ? ? ? ? . 53 THR A CG2 1121 ATOM 236 O OG1 . THR A 1121 53 . -4.321 20.508 -2.769 1.00 20.00 ? ? ? ? ? . 53 THR A OG1 1121 ATOM 237 N N . GLY A 1121 54 . -3.243 23.528 -3.143 1.00 20.00 ? ? ? ? ? . 54 GLY A N 1121 ATOM 238 C CA . GLY A 1121 54 . -2.918 24.436 -2.063 1.00 20.00 ? ? ? ? ? . 54 GLY A CA 1121 ATOM 239 C C . GLY A 1121 54 . -2.925 23.833 -0.674 1.00 20.00 ? ? ? ? ? . 54 GLY A C 1121 ATOM 240 O O . GLY A 1121 54 . -2.609 24.520 0.286 1.00 20.00 ? ? ? ? ? . 54 GLY A O 1121 ATOM 241 N N . ILE A 1121 55 . -3.277 22.555 -0.564 1.00 20.00 ? ? ? ? ? . 55 ILE A N 1121 ATOM 242 C CA . ILE A 1121 55 . -3.429 21.913 0.733 1.00 20.00 ? ? ? ? ? . 55 ILE A CA 1121 ATOM 243 C C . ILE A 1121 55 . -2.139 21.188 1.104 1.00 20.00 ? ? ? ? ? . 55 ILE A C 1121 ATOM 244 O O . ILE A 1121 55 . -1.585 20.472 0.282 1.00 20.00 ? ? ? ? ? . 55 ILE A O 1121 ATOM 245 C CB . ILE A 1121 55 . -4.599 20.887 0.707 1.00 20.00 ? ? ? ? ? . 55 ILE A CB 1121 ATOM 246 C CG1 . ILE A 1121 55 . -5.915 21.551 0.281 1.00 20.00 ? ? ? ? ? . 55 ILE A CG1 1121 ATOM 247 C CG2 . ILE A 1121 55 . -4.738 20.175 2.071 1.00 20.00 ? ? ? ? ? . 55 ILE A CG2 1121 ATOM 248 C CD1 . ILE A 1121 55 . -6.981 20.580 -0.159 1.00 20.00 ? ? ? ? ? . 55 ILE A CD1 1121 ATOM 249 N N . GLU A 1121 56 . -1.659 21.391 2.331 1.00 20.00 ? ? ? ? ? . 56 GLU A N 1121 ATOM 250 C CA . GLU A 1121 56 . -0.529 20.629 2.864 1.00 20.00 ? ? ? ? ? . 56 GLU A CA 1121 ATOM 251 C C . GLU A 1121 56 . -1.021 19.277 3.392 1.00 20.00 ? ? ? ? ? . 56 GLU A C 1121 ATOM 252 O O . GLU A 1121 56 . -1.987 19.234 4.148 1.00 20.00 ? ? ? ? ? . 56 GLU A O 1121 ATOM 253 C CB . GLU A 1121 56 . 0.175 21.389 3.994 1.00 20.00 ? ? ? ? ? . 56 GLU A CB 1121 ATOM 254 C CG . GLU A 1121 56 . 1.429 20.658 4.506 1.00 20.00 ? ? ? ? ? . 56 GLU A CG 1121 ATOM 255 C CD . GLU A 1121 56 . 2.013 21.249 5.782 1.00 20.00 ? ? ? ? ? . 56 GLU A CD 1121 ATOM 256 O OE1 . GLU A 1121 56 . 1.536 22.317 6.245 1.00 20.00 ? ? ? ? ? . 56 GLU A OE1 1121 ATOM 257 O OE2 . GLU A 1121 56 . 2.949 20.622 6.327 1.00 20.00 ? ? ? ? ? 1- 56 GLU A OE2 1121 ATOM 258 N N . LEU A 1121 57 . -0.365 18.187 2.982 1.00 20.00 ? ? ? ? ? . 57 LEU A N 1121 ATOM 259 C CA . LEU A 1121 57 . -0.679 16.848 3.477 1.00 20.00 ? ? ? ? ? . 57 LEU A CA 1121 ATOM 260 C C . LEU A 1121 57 . 0.376 16.441 4.497 1.00 20.00 ? ? ? ? ? . 57 LEU A C 1121 ATOM 261 O O . LEU A 1121 57 . 1.573 16.455 4.205 1.00 20.00 ? ? ? ? ? . 57 LEU A O 1121 ATOM 262 C CB . LEU A 1121 57 . -0.717 15.838 2.329 1.00 20.00 ? ? ? ? ? . 57 LEU A CB 1121 ATOM 263 C CG . LEU A 1121 57 . -0.936 14.383 2.738 1.00 20.00 ? ? ? ? ? . 57 LEU A CG 1121 ATOM 264 C CD1 . LEU A 1121 57 . -2.339 14.167 3.320 1.00 20.00 ? ? ? ? ? . 57 LEU A CD1 1121 ATOM 265 C CD2 . LEU A 1121 57 . -0.701 13.436 1.547 1.00 20.00 ? ? ? ? ? . 57 LEU A CD2 1121 ATOM 266 N N . ARG A 1121 58 . -0.082 16.093 5.695 1.00 20.00 ? ? ? ? ? . 58 ARG A N 1121 ATOM 267 C CA . ARG A 1121 58 . 0.782 15.534 6.715 1.00 20.00 ? ? ? ? ? . 58 ARG A CA 1121 ATOM 268 C C . ARG A 1121 58 . 0.271 14.149 7.016 1.00 20.00 ? ? ? ? ? . 58 ARG A C 1121 ATOM 269 O O . ARG A 1121 58 . -0.936 13.928 7.102 1.00 20.00 ? ? ? ? ? . 58 ARG A O 1121 ATOM 270 C CB . ARG A 1121 58 . 0.785 16.395 7.973 1.00 20.00 ? ? ? ? ? . 58 ARG A CB 1121 ATOM 271 C CG . ARG A 1121 58 . 1.335 17.787 7.755 1.00 20.00 ? ? ? ? ? . 58 ARG A CG 1121 ATOM 272 C CD . ARG A 1121 58 . 1.390 18.542 9.060 1.00 20.00 ? ? ? ? ? . 58 ARG A CD 1121 ATOM 273 N NE . ARG A 1121 58 . 1.615 19.963 8.843 1.00 20.00 ? ? ? ? ? . 58 ARG A NE 1121 ATOM 274 C CZ . ARG A 1121 58 . 1.203 20.917 9.672 1.00 20.00 ? ? ? ? ? . 58 ARG A CZ 1121 ATOM 275 N NH1 . ARG A 1121 58 . 0.566 20.601 10.796 1.00 20.00 ? ? ? ? ? 1+ 58 ARG A NH1 1121 ATOM 276 N NH2 . ARG A 1121 58 . 1.431 22.188 9.383 1.00 20.00 ? ? ? ? ? . 58 ARG A NH2 1121 ATOM 277 N N . TRP A 1121 59 . 1.193 13.205 7.183 1.00 20.00 ? ? ? ? ? . 59 TRP A N 1121 ATOM 278 C CA . TRP A 1121 59 . 0.832 11.832 7.478 1.00 20.00 ? ? ? ? ? . 59 TRP A CA 1121 ATOM 279 C C . TRP A 1121 59 . 1.579 11.326 8.677 1.00 20.00 ? ? ? ? ? . 59 TRP A C 1121 ATOM 280 O O . TRP A 1121 59 . 2.796 11.568 8.822 1.00 20.00 ? ? ? ? ? . 59 TRP A O 1121 ATOM 281 C CB . TRP A 1121 59 . 1.116 10.940 6.276 1.00 20.00 ? ? ? ? ? . 59 TRP A CB 1121 ATOM 282 C CG . TRP A 1121 59 . 2.566 10.941 5.854 1.00 20.00 ? ? ? ? ? . 59 TRP A CG 1121 ATOM 283 C CD1 . TRP A 1121 59 . 3.592 10.135 6.337 1.00 20.00 ? ? ? ? ? . 59 TRP A CD1 1121 ATOM 284 C CD2 . TRP A 1121 59 . 3.200 11.798 4.841 1.00 20.00 ? ? ? ? ? . 59 TRP A CD2 1121 ATOM 285 C CE2 . TRP A 1121 59 . 4.613 11.411 4.805 1.00 20.00 ? ? ? ? ? . 59 TRP A CE2 1121 ATOM 286 C CE3 . TRP A 1121 59 . 2.758 12.804 3.997 1.00 20.00 ? ? ? ? ? . 59 TRP A CE3 1121 ATOM 287 N NE1 . TRP A 1121 59 . 4.779 10.424 5.712 1.00 20.00 ? ? ? ? ? . 59 TRP A NE1 1121 ATOM 288 C CZ2 . TRP A 1121 59 . 5.518 12.019 3.953 1.00 20.00 ? ? ? ? ? . 59 TRP A CZ2 1121 ATOM 289 C CZ3 . TRP A 1121 59 . 3.681 13.410 3.142 1.00 20.00 ? ? ? ? ? . 59 TRP A CZ3 1121 ATOM 290 C CH2 . TRP A 1121 59 . 5.027 13.025 3.122 1.00 20.00 ? ? ? ? ? . 59 TRP A CH2 1121 ATOM 291 N N . THR A 1121 60 . 0.977 10.278 9.229 1.00 20.00 ? ? ? ? ? . 60 THR A N 1121 ATOM 292 C CA . THR A 1121 60 . 1.628 9.477 10.239 1.00 20.00 ? ? ? ? ? . 60 THR A CA 1121 ATOM 293 C C . THR A 1121 60 . 1.478 8.032 9.796 1.00 20.00 ? ? ? ? ? . 60 THR A C 1121 ATOM 294 O O . THR A 1121 60 . 0.392 7.622 9.376 1.00 20.00 ? ? ? ? ? . 60 THR A O 1121 ATOM 295 C CB . THR A 1121 60 . 0.961 9.681 11.590 1.00 20.00 ? ? ? ? ? . 60 THR A CB 1121 ATOM 296 C CG2 . THR A 1121 60 . 1.549 8.732 12.641 1.00 20.00 ? ? ? ? ? . 60 THR A CG2 1121 ATOM 297 O OG1 . THR A 1121 60 . 1.176 11.031 12.008 1.00 20.00 ? ? ? ? ? . 60 THR A OG1 1121 ATOM 298 N N . ALA A 1121 61 . 2.576 7.283 9.850 1.00 20.00 ? ? ? ? ? . 61 ALA A N 1121 ATOM 299 C CA . ALA A 1121 61 . 2.625 5.924 9.351 1.00 20.00 ? ? ? ? ? . 61 ALA A CA 1121 ATOM 300 C C . ALA A 1121 61 . 2.758 4.959 10.510 1.00 20.00 ? ? ? ? ? . 61 ALA A C 1121 ATOM 301 O O . ALA A 1121 61 . 3.733 5.008 11.258 1.00 20.00 ? ? ? ? ? . 61 ALA A O 1121 ATOM 302 C CB . ALA A 1121 61 . 3.802 5.775 8.406 1.00 20.00 ? ? ? ? ? . 61 ALA A CB 1121 ATOM 303 N N . VAL A 1121 62 . 1.769 4.086 10.655 1.00 20.00 ? ? ? ? ? . 62 VAL A N 1121 ATOM 304 C CA . VAL A 1121 62 . 1.692 3.165 11.778 1.00 20.00 ? ? ? ? ? . 62 VAL A CA 1121 ATOM 305 C C . VAL A 1121 62 . 1.174 1.839 11.247 1.00 20.00 ? ? ? ? ? . 62 VAL A C 1121 ATOM 306 O O . VAL A 1121 62 . 0.951 1.711 10.058 1.00 20.00 ? ? ? ? ? . 62 VAL A O 1121 ATOM 307 C CB . VAL A 1121 62 . 0.753 3.732 12.877 1.00 20.00 ? ? ? ? ? . 62 VAL A CB 1121 ATOM 308 C CG1 . VAL A 1121 62 . 1.395 4.925 13.553 1.00 20.00 ? ? ? ? ? . 62 VAL A CG1 1121 ATOM 309 C CG2 . VAL A 1121 62 . -0.614 4.122 12.302 1.00 20.00 ? ? ? ? ? . 62 VAL A CG2 1121 ATOM 310 N N . GLY A 1121 63 . 0.993 0.841 12.103 1.00 20.00 ? ? ? ? ? . 63 GLY A N 1121 ATOM 311 C CA . GLY A 1121 63 . 0.320 -0.372 11.682 1.00 20.00 ? ? ? ? ? . 63 GLY A CA 1121 ATOM 312 C C . GLY A 1121 63 . -1.139 -0.109 11.344 1.00 20.00 ? ? ? ? ? . 63 GLY A C 1121 ATOM 313 O O . GLY A 1121 63 . -1.730 0.857 11.803 1.00 20.00 ? ? ? ? ? . 63 GLY A O 1121 ATOM 314 N N . THR A 1121 64 . -1.719 -0.977 10.528 1.00 20.00 ? ? ? ? ? . 64 THR A N 1121 ATOM 315 C CA . THR A 1121 64 . -3.095 -0.820 10.082 1.00 20.00 ? ? ? ? ? . 64 THR A CA 1121 ATOM 316 C C . THR A 1121 64 . -4.080 -0.659 11.232 1.00 20.00 ? ? ? ? ? . 64 THR A C 1121 ATOM 317 O O . THR A 1121 64 . -4.934 0.226 11.188 1.00 20.00 ? ? ? ? ? . 64 THR A O 1121 ATOM 318 C CB . THR A 1121 64 . -3.524 -1.998 9.193 1.00 20.00 ? ? ? ? ? . 64 THR A CB 1121 ATOM 319 C CG2 . THR A 1121 64 . -4.978 -1.848 8.762 1.00 20.00 ? ? ? ? ? . 64 THR A CG2 1121 ATOM 320 O OG1 . THR A 1121 64 . -2.699 -2.016 8.024 1.00 20.00 ? ? ? ? ? . 64 THR A OG1 1121 ATOM 321 N N . GLY A 1121 65 . -3.995 -1.517 12.243 1.00 20.00 ? ? ? ? ? . 65 GLY A N 1121 ATOM 322 C CA . GLY A 1121 65 . -4.896 -1.408 13.375 1.00 20.00 ? ? ? ? ? . 65 GLY A CA 1121 ATOM 323 C C . GLY A 1121 65 . -4.837 -0.034 14.016 1.00 20.00 ? ? ? ? ? . 65 GLY A C 1121 ATOM 324 O O . GLY A 1121 65 . -5.861 0.582 14.336 1.00 20.00 ? ? ? ? ? . 65 GLY A O 1121 ATOM 325 N N . LYS A 1121 66 . -3.623 0.453 14.201 1.00 20.00 ? ? ? ? ? . 66 LYS A N 1121 ATOM 326 C CA . LYS A 1121 66 . -3.419 1.737 14.841 1.00 20.00 ? ? ? ? ? . 66 LYS A CA 1121 ATOM 327 C C . LYS A 1121 66 . -3.890 2.888 13.944 1.00 20.00 ? ? ? ? ? . 66 LYS A C 1121 ATOM 328 O O . LYS A 1121 66 . -4.381 3.895 14.441 1.00 20.00 ? ? ? ? ? . 66 LYS A O 1121 ATOM 329 C CB . LYS A 1121 66 . -1.943 1.912 15.174 1.00 20.00 ? ? ? ? ? . 66 LYS A CB 1121 ATOM 330 C CG . LYS A 1121 66 . -1.607 3.182 15.940 1.00 20.00 ? ? ? ? ? . 66 LYS A CG 1121 ATOM 331 C CD . LYS A 1121 66 . -2.420 3.312 17.223 1.00 20.00 ? ? ? ? ? . 66 LYS A CD 1121 ATOM 332 C CE . LYS A 1121 66 . -1.719 4.232 18.195 1.00 20.00 ? ? ? ? ? . 66 LYS A CE 1121 ATOM 333 N NZ . LYS A 1121 66 . -1.215 5.447 17.509 1.00 20.00 ? ? ? ? ? 1+ 66 LYS A NZ 1121 ATOM 334 N N . ALA A 1121 67 . -3.741 2.751 12.630 1.00 20.00 ? ? ? ? ? . 67 ALA A N 1121 ATOM 335 C CA . ALA A 1121 67 . -4.223 3.778 11.701 1.00 20.00 ? ? ? ? ? . 67 ALA A CA 1121 ATOM 336 C C . ALA A 1121 67 . -5.724 3.894 11.802 1.00 20.00 ? ? ? ? ? . 67 ALA A C 1121 ATOM 337 O O . ALA A 1121 67 . -6.269 5.002 11.854 1.00 20.00 ? ? ? ? ? . 67 ALA A O 1121 ATOM 338 C CB . ALA A 1121 67 . -3.839 3.442 10.295 1.00 20.00 ? ? ? ? ? . 67 ALA A CB 1121 ATOM 339 N N . LEU A 1121 68 . -6.404 2.752 11.795 1.00 20.00 ? ? ? ? ? . 68 LEU A N 1121 ATOM 340 C CA . LEU A 1121 68 . -7.849 2.772 11.911 1.00 20.00 ? ? ? ? ? . 68 LEU A CA 1121 ATOM 341 C C . LEU A 1121 68 . -8.261 3.330 13.270 1.00 20.00 ? ? ? ? ? . 68 LEU A C 1121 ATOM 342 O O . LEU A 1121 68 . -9.212 4.096 13.346 1.00 20.00 ? ? ? ? ? . 68 LEU A O 1121 ATOM 343 C CB . LEU A 1121 68 . -8.472 1.401 11.603 1.00 20.00 ? ? ? ? ? . 68 LEU A CB 1121 ATOM 344 C CG . LEU A 1121 68 . -8.777 1.247 10.099 1.00 20.00 ? ? ? ? ? . 68 LEU A CG 1121 ATOM 345 C CD1 . LEU A 1121 68 . -7.527 1.398 9.269 1.00 20.00 ? ? ? ? ? . 68 LEU A CD1 1121 ATOM 346 C CD2 . LEU A 1121 68 . -9.433 -0.059 9.803 1.00 20.00 ? ? ? ? ? . 68 LEU A CD2 1121 ATOM 347 N N . LYS A 1121 69 . -7.524 2.986 14.324 1.00 20.00 ? ? ? ? ? . 69 LYS A N 1121 ATOM 348 C CA . LYS A 1121 69 . -7.783 3.550 15.646 1.00 20.00 ? ? ? ? ? . 69 LYS A CA 1121 ATOM 349 C C . LYS A 1121 69 . -7.641 5.071 15.644 1.00 20.00 ? ? ? ? ? . 69 LYS A C 1121 ATOM 350 O O . LYS A 1121 69 . -8.428 5.752 16.279 1.00 20.00 ? ? ? ? ? . 69 LYS A O 1121 ATOM 351 C CB . LYS A 1121 69 . -6.861 2.946 16.709 1.00 20.00 ? ? ? ? ? . 69 LYS A CB 1121 ATOM 352 C CG . LYS A 1121 69 . -7.413 1.708 17.398 1.00 20.00 ? ? ? ? ? . 69 LYS A CG 1121 ATOM 353 C CD . LYS A 1121 69 . -6.296 0.948 18.124 1.00 20.00 ? ? ? ? ? . 69 LYS A CD 1121 ATOM 354 C CE . LYS A 1121 69 . -6.781 0.262 19.392 1.00 20.00 ? ? ? ? ? . 69 LYS A CE 1121 ATOM 355 N NZ . LYS A 1121 69 . -6.301 0.980 20.609 1.00 20.00 ? ? ? ? ? 1+ 69 LYS A NZ 1121 ATOM 356 N N . MET A 1121 70 . -6.639 5.597 14.934 1.00 20.00 ? ? ? ? ? . 70 MET A N 1121 ATOM 357 C CA . MET A 1121 70 . -6.449 7.045 14.847 1.00 20.00 ? ? ? ? ? . 70 MET A CA 1121 ATOM 358 C C . MET A 1121 70 . -7.685 7.680 14.205 1.00 20.00 ? ? ? ? ? . 70 MET A C 1121 ATOM 359 O O . MET A 1121 70 . -8.140 8.732 14.644 1.00 20.00 ? ? ? ? ? . 70 MET A O 1121 ATOM 360 C CB . MET A 1121 70 . -5.183 7.406 14.052 1.00 20.00 ? ? ? ? ? . 70 MET A CB 1121 ATOM 361 C CG . MET A 1121 70 . -3.884 7.107 14.801 1.00 20.00 ? ? ? ? ? . 70 MET A CG 1121 ATOM 362 S SD . MET A 1121 70 . -2.379 7.567 13.932 1.00 20.00 ? ? ? ? ? . 70 MET A SD 1121 ATOM 363 C CE . MET A 1121 70 . -2.362 9.324 14.356 1.00 20.00 ? ? ? ? ? . 70 MET A CE 1121 ATOM 364 N N . GLY A 1121 71 . -8.242 7.025 13.184 1.00 20.00 ? ? ? ? ? . 71 GLY A N 1121 ATOM 365 C CA . GLY A 1121 71 . -9.456 7.518 12.555 1.00 20.00 ? ? ? ? ? . 71 GLY A CA 1121 ATOM 366 C C . GLY A 1121 71 . -10.614 7.510 13.529 1.00 20.00 ? ? ? ? ? . 71 GLY A C 1121 ATOM 367 O O . GLY A 1121 71 . -11.326 8.509 13.684 1.00 20.00 ? ? ? ? ? . 71 GLY A O 1121 ATOM 368 N N . GLU A 1121 72 . -10.790 6.381 14.201 1.00 20.00 ? ? ? ? ? . 72 GLU A N 1121 ATOM 369 C CA . GLU A 1121 72 . -11.823 6.247 15.205 1.00 20.00 ? ? ? ? ? . 72 GLU A CA 1121 ATOM 370 C C . GLU A 1121 72 . -11.690 7.286 16.324 1.00 20.00 ? ? ? ? ? . 72 GLU A C 1121 ATOM 371 O O . GLU A 1121 72 . -12.695 7.769 16.819 1.00 20.00 ? ? ? ? ? . 72 GLU A O 1121 ATOM 372 C CB . GLU A 1121 72 . -11.796 4.840 15.784 1.00 20.00 ? ? ? ? ? . 72 GLU A CB 1121 ATOM 373 C CG . GLU A 1121 72 . -12.901 4.589 16.758 1.00 20.00 ? ? ? ? ? . 72 GLU A CG 1121 ATOM 374 C CD . GLU A 1121 72 . -12.889 3.169 17.278 1.00 20.00 ? ? ? ? ? . 72 GLU A CD 1121 ATOM 375 O OE1 . GLU A 1121 72 . -12.092 2.353 16.770 1.00 20.00 ? ? ? ? ? . 72 GLU A OE1 1121 ATOM 376 O OE2 . GLU A 1121 72 . -13.679 2.869 18.194 1.00 20.00 ? ? ? ? ? 1- 72 GLU A OE2 1121 ATOM 377 N N . ASN A 1121 73 . -10.460 7.644 16.689 1.00 20.00 ? ? ? ? ? . 73 ASN A N 1121 ATOM 378 C CA . ASN A 1121 73 . -10.236 8.619 17.751 1.00 20.00 ? ? ? ? ? . 73 ASN A CA 1121 ATOM 379 C C . ASN A 1121 73 . -10.296 10.072 17.256 1.00 20.00 ? ? ? ? ? . 73 ASN A C 1121 ATOM 380 O O . ASN A 1121 73 . -10.041 10.997 18.029 1.00 20.00 ? ? ? ? ? . 73 ASN A O 1121 ATOM 381 C CB . ASN A 1121 73 . -8.888 8.336 18.425 1.00 20.00 ? ? ? ? ? . 73 ASN A CB 1121 ATOM 382 C CG . ASN A 1121 73 . -8.736 9.026 19.783 1.00 20.00 ? ? ? ? ? . 73 ASN A CG 1121 ATOM 383 N ND2 . ASN A 1121 73 . -7.687 9.834 19.915 1.00 20.00 ? ? ? ? ? . 73 ASN A ND2 1121 ATOM 384 O OD1 . ASN A 1121 73 . -9.527 8.803 20.711 1.00 20.00 ? ? ? ? ? . 73 ASN A OD1 1121 ATOM 385 N N . CYS A 1121 74 . -10.640 10.256 15.978 1.00 20.00 ? ? ? ? ? . 74 CYS A N 1121 ATOM 386 C CA . CYS A 1121 74 . -10.752 11.579 15.360 1.00 20.00 ? ? ? ? ? . 74 CYS A CA 1121 ATOM 387 C C . CYS A 1121 74 . -9.410 12.322 15.316 1.00 20.00 ? ? ? ? ? . 74 CYS A C 1121 ATOM 388 O O . CYS A 1121 74 . -9.374 13.549 15.259 1.00 20.00 ? ? ? ? ? . 74 CYS A O 1121 ATOM 389 C CB . CYS A 1121 74 . -11.818 12.438 16.075 1.00 20.00 ? ? ? ? ? . 74 CYS A CB 1121 ATOM 390 S SG . CYS A 1121 74 . -13.481 11.705 16.112 1.00 20.00 ? ? ? ? ? . 74 CYS A SG 1121 ATOM 391 N N . ASP A 1121 75 . -8.309 11.574 15.328 1.00 20.00 ? ? ? ? ? . 75 ASP A N 1121 ATOM 392 C CA . ASP A 1121 75 . -6.976 12.169 15.289 1.00 20.00 ? ? ? ? ? . 75 ASP A CA 1121 ATOM 393 C C . ASP A 1121 75 . -6.640 12.717 13.899 1.00 20.00 ? ? ? ? ? . 75 ASP A C 1121 ATOM 394 O O . ASP A 1121 75 . -5.765 13.570 13.756 1.00 20.00 ? ? ? ? ? . 75 ASP A O 1121 ATOM 395 C CB . ASP A 1121 75 . -5.905 11.128 15.625 1.00 20.00 ? ? ? ? ? . 75 ASP A CB 1121 ATOM 396 C CG . ASP A 1121 75 . -5.922 10.678 17.069 1.00 20.00 ? ? ? ? ? . 75 ASP A CG 1121 ATOM 397 O OD1 . ASP A 1121 75 . -6.186 11.502 17.958 1.00 20.00 ? ? ? ? ? . 75 ASP A OD1 1121 ATOM 398 O OD2 . ASP A 1121 75 . -5.614 9.489 17.321 1.00 20.00 ? ? ? ? ? 1- 75 ASP A OD2 1121 ATOM 399 N N . VAL A 1121 76 . -7.255 12.138 12.872 1.00 20.00 ? ? ? ? ? . 76 VAL A N 1121 ATOM 400 C CA . VAL A 1121 76 . -6.963 12.472 11.477 1.00 20.00 ? ? ? ? ? . 76 VAL A CA 1121 ATOM 401 C C . VAL A 1121 76 . -8.235 12.669 10.647 1.00 20.00 ? ? ? ? ? . 76 VAL A C 1121 ATOM 402 O O . VAL A 1121 76 . -9.335 12.279 11.043 1.00 20.00 ? ? ? ? ? . 76 VAL A O 1121 ATOM 403 C CB . VAL A 1121 76 . -6.093 11.359 10.804 1.00 20.00 ? ? ? ? ? . 76 VAL A CB 1121 ATOM 404 C CG1 . VAL A 1121 76 . -4.774 11.210 11.518 1.00 20.00 ? ? ? ? ? . 76 VAL A CG1 1121 ATOM 405 C CG2 . VAL A 1121 76 . -6.828 9.997 10.761 1.00 20.00 ? ? ? ? ? . 76 VAL A CG2 1121 ATOM 406 N N . ASP A 1121 77 . -8.057 13.261 9.473 1.00 20.00 ? ? ? ? ? . 77 ASP A N 1121 ATOM 407 C CA . ASP A 1121 77 . -9.139 13.532 8.541 1.00 20.00 ? ? ? ? ? . 77 ASP A CA 1121 ATOM 408 C C . ASP A 1121 77 . -9.393 12.426 7.509 1.00 20.00 ? ? ? ? ? . 77 ASP A C 1121 ATOM 409 O O . ASP A 1121 77 . -10.463 12.354 6.921 1.00 20.00 ? ? ? ? ? . 77 ASP A O 1121 ATOM 410 C CB . ASP A 1121 77 . -8.805 14.817 7.800 1.00 20.00 ? ? ? ? ? . 77 ASP A CB 1121 ATOM 411 C CG . ASP A 1121 77 . -8.503 15.965 8.749 1.00 20.00 ? ? ? ? ? . 77 ASP A CG 1121 ATOM 412 O OD1 . ASP A 1121 77 . -9.362 16.275 9.603 1.00 20.00 ? ? ? ? ? . 77 ASP A OD1 1121 ATOM 413 O OD2 . ASP A 1121 77 . -7.405 16.551 8.639 1.00 20.00 ? ? ? ? ? 1- 77 ASP A OD2 1121 ATOM 414 N N . ILE A 1121 78 . -8.402 11.580 7.273 1.00 20.00 ? ? ? ? ? . 78 ILE A N 1121 ATOM 415 C CA . ILE A 1121 78 . -8.479 10.604 6.189 1.00 20.00 ? ? ? ? ? . 78 ILE A CA 1121 ATOM 416 C C . ILE A 1121 78 . -7.512 9.466 6.434 1.00 20.00 ? ? ? ? ? . 78 ILE A C 1121 ATOM 417 O O . ILE A 1121 78 . -6.468 9.647 7.050 1.00 20.00 ? ? ? ? ? . 78 ILE A O 1121 ATOM 418 C CB . ILE A 1121 78 . -8.160 11.285 4.833 1.00 20.00 ? ? ? ? ? . 78 ILE A CB 1121 ATOM 419 C CG1 . ILE A 1121 78 . -8.494 10.380 3.646 1.00 20.00 ? ? ? ? ? . 78 ILE A CG1 1121 ATOM 420 C CG2 . ILE A 1121 78 . -6.703 11.774 4.797 1.00 20.00 ? ? ? ? ? . 78 ILE A CG2 1121 ATOM 421 C CD1 . ILE A 1121 78 . -8.458 11.084 2.288 1.00 20.00 ? ? ? ? ? . 78 ILE A CD1 1121 ATOM 422 N N . LEU A 1121 79 . -7.900 8.299 5.954 1.00 20.00 ? ? ? ? ? . 79 LEU A N 1121 ATOM 423 C CA . LEU A 1121 79 . -7.082 7.107 5.995 1.00 20.00 ? ? ? ? ? . 79 LEU A CA 1121 ATOM 424 C C . LEU A 1121 79 . -6.622 6.773 4.583 1.00 20.00 ? ? ? ? ? . 79 LEU A C 1121 ATOM 425 O O . LEU A 1121 79 . -7.381 6.882 3.634 1.00 20.00 ? ? ? ? ? . 79 LEU A O 1121 ATOM 426 C CB . LEU A 1121 79 . -7.872 5.919 6.531 1.00 20.00 ? ? ? ? ? . 79 LEU A CB 1121 ATOM 427 C CG . LEU A 1121 79 . -8.490 5.997 7.923 1.00 20.00 ? ? ? ? ? . 79 LEU A CG 1121 ATOM 428 C CD1 . LEU A 1121 79 . -9.022 4.622 8.306 1.00 20.00 ? ? ? ? ? . 79 LEU A CD1 1121 ATOM 429 C CD2 . LEU A 1121 79 . -7.545 6.521 8.968 1.00 20.00 ? ? ? ? ? . 79 LEU A CD2 1121 ATOM 430 N N . LEU A 1121 80 . -5.399 6.291 4.458 1.00 20.00 ? ? ? ? ? . 80 LEU A N 1121 ATOM 431 C CA . LEU A 1121 80 . -4.944 5.660 3.212 1.00 20.00 ? ? ? ? ? . 80 LEU A CA 1121 ATOM 432 C C . LEU A 1121 80 . -4.373 4.324 3.633 1.00 20.00 ? ? ? ? ? . 80 LEU A C 1121 ATOM 433 O O . LEU A 1121 80 . -3.287 4.255 4.208 1.00 20.00 ? ? ? ? ? . 80 LEU A O 1121 ATOM 434 C CB . LEU A 1121 80 . -3.894 6.531 2.501 1.00 20.00 ? ? ? ? ? . 80 LEU A CB 1121 ATOM 435 C CG . LEU A 1121 80 . -3.295 5.934 1.224 1.00 20.00 ? ? ? ? ? . 80 LEU A CG 1121 ATOM 436 C CD1 . LEU A 1121 80 . -4.372 5.750 0.158 1.00 20.00 ? ? ? ? ? . 80 LEU A CD1 1121 ATOM 437 C CD2 . LEU A 1121 80 . -2.145 6.818 0.726 1.00 20.00 ? ? ? ? ? . 80 LEU A CD2 1121 ATOM 438 N N . VAL A 1121 81 . -5.120 3.260 3.369 1.00 20.00 ? ? ? ? ? . 81 VAL A N 1121 ATOM 439 C CA . VAL A 1121 81 . -4.763 1.952 3.900 1.00 20.00 ? ? ? ? ? . 81 VAL A CA 1121 ATOM 440 C C . VAL A 1121 81 . -4.991 0.869 2.863 1.00 20.00 ? ? ? ? ? . 81 VAL A C 1121 ATOM 441 O O . VAL A 1121 81 . -5.418 1.147 1.741 1.00 20.00 ? ? ? ? ? . 81 VAL A O 1121 ATOM 442 C CB . VAL A 1121 81 . -5.552 1.636 5.199 1.00 20.00 ? ? ? ? ? . 81 VAL A CB 1121 ATOM 443 C CG1 . VAL A 1121 81 . -5.072 2.538 6.326 1.00 20.00 ? ? ? ? ? . 81 VAL A CG1 1121 ATOM 444 C CG2 . VAL A 1121 81 . -7.032 1.839 4.971 1.00 20.00 ? ? ? ? ? . 81 VAL A CG2 1121 ATOM 445 N N . HIS A 1121 82 . -4.679 -0.372 3.229 1.00 20.00 ? ? ? ? ? . 82 HIS A N 1121 ATOM 446 C CA . HIS A 1121 82 . -4.797 -1.497 2.315 1.00 20.00 ? ? ? ? ? . 82 HIS A CA 1121 ATOM 447 C C . HIS A 1121 82 . -5.168 -2.754 3.051 1.00 20.00 ? ? ? ? ? . 82 HIS A C 1121 ATOM 448 O O . HIS A 1121 82 . -4.379 -3.722 3.118 1.00 20.00 ? ? ? ? ? . 82 HIS A O 1121 ATOM 449 C CB . HIS A 1121 82 . -3.491 -1.701 1.556 1.00 20.00 ? ? ? ? ? . 82 HIS A CB 1121 ATOM 450 C CG . HIS A 1121 82 . -2.260 -1.603 2.426 1.00 20.00 ? ? ? ? ? . 82 HIS A CG 1121 ATOM 451 C CD2 . HIS A 1121 82 . -1.504 -0.501 2.820 1.00 20.00 ? ? ? ? ? . 82 HIS A CD2 1121 ATOM 452 N ND1 . HIS A 1121 82 . -1.682 -2.681 2.985 1.00 20.00 ? ? ? ? ? . 82 HIS A ND1 1121 ATOM 453 C CE1 . HIS A 1121 82 . -0.610 -2.294 3.701 1.00 20.00 ? ? ? ? ? . 82 HIS A CE1 1121 ATOM 454 N NE2 . HIS A 1121 82 . -0.502 -0.959 3.600 1.00 20.00 ? ? ? ? ? . 82 HIS A NE2 1121 ATOM 455 N N . ALA A 1121 83 . -6.370 -2.755 3.614 1.00 20.00 ? ? ? ? ? . 83 ALA A N 1121 ATOM 456 C CA . ALA A 1121 83 . -6.875 -3.874 4.396 1.00 20.00 ? ? ? ? ? . 83 ALA A CA 1121 ATOM 457 C C . ALA A 1121 83 . -8.401 -3.924 4.243 1.00 20.00 ? ? ? ? ? . 83 ALA A C 1121 ATOM 458 O O . ALA A 1121 83 . -9.149 -3.427 5.099 1.00 20.00 ? ? ? ? ? . 83 ALA A O 1121 ATOM 459 C CB . ALA A 1121 83 . -6.476 -3.709 5.854 1.00 20.00 ? ? ? ? ? . 83 ALA A CB 1121 ATOM 460 N N . PRO A 1121 84 . -8.867 -4.510 3.130 1.00 20.00 ? ? ? ? ? . 84 PRO A N 1121 ATOM 461 C CA . PRO A 1121 84 . -10.279 -4.389 2.756 1.00 20.00 ? ? ? ? ? . 84 PRO A CA 1121 ATOM 462 C C . PRO A 1121 84 . -11.292 -4.782 3.829 1.00 20.00 ? ? ? ? ? . 84 PRO A C 1121 ATOM 463 O O . PRO A 1121 84 . -12.246 -4.043 4.019 1.00 20.00 ? ? ? ? ? . 84 PRO A O 1121 ATOM 464 C CB . PRO A 1121 84 . -10.380 -5.286 1.529 1.00 20.00 ? ? ? ? ? . 84 PRO A CB 1121 ATOM 465 C CG . PRO A 1121 84 . -9.016 -5.142 0.891 1.00 20.00 ? ? ? ? ? . 84 PRO A CG 1121 ATOM 466 C CD . PRO A 1121 84 . -8.060 -5.078 2.035 1.00 20.00 ? ? ? ? ? . 84 PRO A CD 1121 ATOM 467 N N . ALA A 1121 85 . -11.097 -5.889 4.535 1.00 20.00 ? ? ? ? ? . 85 ALA A N 1121 ATOM 468 C CA . ALA A 1121 85 . -12.089 -6.304 5.529 1.00 20.00 ? ? ? ? ? . 85 ALA A CA 1121 ATOM 469 C C . ALA A 1121 85 . -12.160 -5.310 6.681 1.00 20.00 ? ? ? ? ? . 85 ALA A C 1121 ATOM 470 O O . ALA A 1121 85 . -13.244 -4.913 7.098 1.00 20.00 ? ? ? ? ? . 85 ALA A O 1121 ATOM 471 C CB . ALA A 1121 85 . -11.779 -7.694 6.047 1.00 20.00 ? ? ? ? ? . 85 ALA A CB 1121 ATOM 472 N N . ALA A 1121 86 . -11.002 -4.895 7.181 1.00 20.00 ? ? ? ? ? . 86 ALA A N 1121 ATOM 473 C CA . ALA A 1121 86 . -10.960 -3.939 8.264 1.00 20.00 ? ? ? ? ? . 86 ALA A CA 1121 ATOM 474 C C . ALA A 1121 86 . -11.519 -2.597 7.813 1.00 20.00 ? ? ? ? ? . 86 ALA A C 1121 ATOM 475 O O . ALA A 1121 86 . -12.147 -1.909 8.604 1.00 20.00 ? ? ? ? ? . 86 ALA A O 1121 ATOM 476 C CB . ALA A 1121 86 . -9.556 -3.778 8.753 1.00 20.00 ? ? ? ? ? . 86 ALA A CB 1121 ATOM 477 N N . GLU A 1121 87 . -11.258 -2.214 6.561 1.00 20.00 ? ? ? ? ? . 87 GLU A N 1121 ATOM 478 C CA . GLU A 1121 87 . -11.814 -0.978 6.012 1.00 20.00 ? ? ? ? ? . 87 GLU A CA 1121 ATOM 479 C C . GLU A 1121 87 . -13.343 -1.004 5.962 1.00 20.00 ? ? ? ? ? . 87 GLU A C 1121 ATOM 480 O O . GLU A 1121 87 . -14.010 -0.012 6.287 1.00 20.00 ? ? ? ? ? . 87 GLU A O 1121 ATOM 481 C CB . GLU A 1121 87 . -11.264 -0.729 4.614 1.00 20.00 ? ? ? ? ? . 87 GLU A CB 1121 ATOM 482 C CG . GLU A 1121 87 . -9.787 -0.380 4.556 1.00 20.00 ? ? ? ? ? . 87 GLU A CG 1121 ATOM 483 C CD . GLU A 1121 87 . -9.290 -0.338 3.135 1.00 20.00 ? ? ? ? ? . 87 GLU A CD 1121 ATOM 484 O OE1 . GLU A 1121 87 . -10.087 0.055 2.264 1.00 20.00 ? ? ? ? ? . 87 GLU A OE1 1121 ATOM 485 O OE2 . GLU A 1121 87 . -8.129 -0.703 2.870 1.00 20.00 ? ? ? ? ? 1- 87 GLU A OE2 1121 ATOM 486 N N . LYS A 1121 88 . -13.894 -2.125 5.517 1.00 20.00 ? ? ? ? ? . 88 LYS A N 1121 ATOM 487 C CA . LYS A 1121 88 . -15.349 -2.278 5.471 1.00 20.00 ? ? ? ? ? . 88 LYS A CA 1121 ATOM 488 C C . LYS A 1121 88 . -15.940 -2.133 6.879 1.00 20.00 ? ? ? ? ? . 88 LYS A C 1121 ATOM 489 O O . LYS A 1121 88 . -16.983 -1.494 7.064 1.00 20.00 ? ? ? ? ? . 88 LYS A O 1121 ATOM 490 C CB . LYS A 1121 88 . -15.746 -3.605 4.820 1.00 20.00 ? ? ? ? ? . 88 LYS A CB 1121 ATOM 491 C CG . LYS A 1121 88 . -15.496 -3.649 3.317 1.00 20.00 ? ? ? ? ? . 88 LYS A CG 1121 ATOM 492 C CD . LYS A 1121 88 . -15.622 -5.055 2.753 1.00 20.00 ? ? ? ? ? . 88 LYS A CD 1121 ATOM 493 C CE . LYS A 1121 88 . -15.249 -5.087 1.276 1.00 20.00 ? ? ? ? ? . 88 LYS A CE 1121 ATOM 494 N NZ . LYS A 1121 88 . -15.349 -6.464 0.705 1.00 20.00 ? ? ? ? ? 1+ 88 LYS A NZ 1121 ATOM 495 N N . ALA A 1121 89 . -15.272 -2.698 7.877 1.00 20.00 ? ? ? ? ? . 89 ALA A N 1121 ATOM 496 C CA . ALA A 1121 89 . -15.770 -2.595 9.247 1.00 20.00 ? ? ? ? ? . 89 ALA A CA 1121 ATOM 497 C C . ALA A 1121 89 . -15.699 -1.155 9.779 1.00 20.00 ? ? ? ? ? . 89 ALA A C 1121 ATOM 498 O O . ALA A 1121 89 . -16.568 -0.720 10.541 1.00 20.00 ? ? ? ? ? . 89 ALA A O 1121 ATOM 499 C CB . ALA A 1121 89 . -15.009 -3.537 10.160 1.00 20.00 ? ? ? ? ? . 89 ALA A CB 1121 ATOM 500 N N . PHE A 1121 90 . -14.679 -0.414 9.355 1.00 20.00 ? ? ? ? ? . 90 PHE A N 1121 ATOM 501 C CA . PHE A 1121 90 . -14.504 0.977 9.758 1.00 20.00 ? ? ? ? ? . 90 PHE A CA 1121 ATOM 502 C C . PHE A 1121 90 . -15.641 1.842 9.187 1.00 20.00 ? ? ? ? ? . 90 PHE A C 1121 ATOM 503 O O . PHE A 1121 90 . -16.239 2.674 9.882 1.00 20.00 ? ? ? ? ? . 90 PHE A O 1121 ATOM 504 C CB . PHE A 1121 90 . -13.132 1.437 9.265 1.00 20.00 ? ? ? ? ? . 90 PHE A CB 1121 ATOM 505 C CG . PHE A 1121 90 . -12.757 2.840 9.642 1.00 20.00 ? ? ? ? ? . 90 PHE A CG 1121 ATOM 506 C CD1 . PHE A 1121 90 . -12.152 3.111 10.848 1.00 20.00 ? ? ? ? ? . 90 PHE A CD1 1121 ATOM 507 C CD2 . PHE A 1121 90 . -12.977 3.888 8.757 1.00 20.00 ? ? ? ? ? . 90 PHE A CD2 1121 ATOM 508 C CE1 . PHE A 1121 90 . -11.789 4.387 11.170 1.00 20.00 ? ? ? ? ? . 90 PHE A CE1 1121 ATOM 509 C CE2 . PHE A 1121 90 . -12.612 5.165 9.080 1.00 20.00 ? ? ? ? ? . 90 PHE A CE2 1121 ATOM 510 C CZ . PHE A 1121 90 . -12.015 5.413 10.270 1.00 20.00 ? ? ? ? ? . 90 PHE A CZ 1121 ATOM 511 N N . VAL A 1121 91 . -15.962 1.613 7.921 1.00 20.00 ? ? ? ? ? . 91 VAL A N 1121 ATOM 512 C CA . VAL A 1121 91 . -17.067 2.315 7.278 1.00 20.00 ? ? ? ? ? . 91 VAL A CA 1121 ATOM 513 C C . VAL A 1121 91 . -18.398 1.898 7.926 1.00 20.00 ? ? ? ? ? . 91 VAL A C 1121 ATOM 514 O O . VAL A 1121 91 . -19.221 2.757 8.244 1.00 20.00 ? ? ? ? ? . 91 VAL A O 1121 ATOM 515 C CB . VAL A 1121 91 . -17.062 2.087 5.742 1.00 20.00 ? ? ? ? ? . 91 VAL A CB 1121 ATOM 516 C CG1 . VAL A 1121 91 . -18.349 2.613 5.096 1.00 20.00 ? ? ? ? ? . 91 VAL A CG1 1121 ATOM 517 C CG2 . VAL A 1121 91 . -15.836 2.760 5.091 1.00 20.00 ? ? ? ? ? . 91 VAL A CG2 1121 ATOM 518 N N . ASP A 1121 92 . -18.591 0.598 8.170 1.00 20.00 ? ? ? ? ? . 92 ASP A N 1121 ATOM 519 C CA . ASP A 1121 92 . -19.840 0.117 8.775 1.00 20.00 ? ? ? ? ? . 92 ASP A CA 1121 ATOM 520 C C . ASP A 1121 92 . -20.063 0.666 10.186 1.00 20.00 ? ? ? ? ? . 92 ASP A C 1121 ATOM 521 O O . ASP A 1121 92 . -21.209 0.887 10.605 1.00 20.00 ? ? ? ? ? . 92 ASP A O 1121 ATOM 522 C CB . ASP A 1121 92 . -19.899 -1.417 8.799 1.00 20.00 ? ? ? ? ? . 92 ASP A CB 1121 ATOM 523 C CG . ASP A 1121 92 . -19.961 -2.018 7.410 1.00 20.00 ? ? ? ? ? . 92 ASP A CG 1121 ATOM 524 O OD1 . ASP A 1121 92 . -20.258 -1.264 6.460 1.00 20.00 ? ? ? ? ? . 92 ASP A OD1 1121 ATOM 525 O OD2 . ASP A 1121 92 . -19.718 -3.240 7.270 1.00 20.00 ? ? ? ? ? 1- 92 ASP A OD2 1121 ATOM 526 N N . ALA A 1121 93 . -18.981 0.885 10.913 1.00 20.00 ? ? ? ? ? . 93 ALA A N 1121 ATOM 527 C CA . ALA A 1121 93 . -19.036 1.452 12.252 1.00 20.00 ? ? ? ? ? . 93 ALA A CA 1121 ATOM 528 C C . ALA A 1121 93 . -19.470 2.913 12.233 1.00 20.00 ? ? ? ? ? . 93 ALA A C 1121 ATOM 529 O O . ALA A 1121 93 . -19.823 3.462 13.271 1.00 20.00 ? ? ? ? ? . 93 ALA A O 1121 ATOM 530 C CB . ALA A 1121 93 . -17.671 1.327 12.924 1.00 20.00 ? ? ? ? ? . 93 ALA A CB 1121 ATOM 531 N N . GLY A 1121 94 . -19.409 3.543 11.064 1.00 20.00 ? ? ? ? ? . 94 GLY A N 1121 ATOM 532 C CA . GLY A 1121 94 . -19.723 4.957 10.937 1.00 20.00 ? ? ? ? ? . 94 GLY A CA 1121 ATOM 533 C C . GLY A 1121 94 . -18.513 5.843 11.154 1.00 20.00 ? ? ? ? ? . 94 GLY A C 1121 ATOM 534 O O . GLY A 1121 94 . -18.637 7.062 11.210 1.00 20.00 ? ? ? ? ? . 94 GLY A O 1121 ATOM 535 N N . PHE A 1121 95 . -17.334 5.231 11.265 1.00 20.00 ? ? ? ? ? . 95 PHE A N 1121 ATOM 536 C CA . PHE A 1121 95 . -16.112 5.986 11.504 1.00 20.00 ? ? ? ? ? . 95 PHE A CA 1121 ATOM 537 C C . PHE A 1121 95 . -15.600 6.658 10.230 1.00 20.00 ? ? ? ? ? . 95 PHE A C 1121 ATOM 538 O O . PHE A 1121 95 . -14.943 7.678 10.312 1.00 20.00 ? ? ? ? ? . 95 PHE A O 1121 ATOM 539 C CB . PHE A 1121 95 . -15.010 5.100 12.090 1.00 20.00 ? ? ? ? ? . 95 PHE A CB 1121 ATOM 540 C CG . PHE A 1121 95 . -15.390 4.388 13.357 1.00 20.00 ? ? ? ? ? . 95 PHE A CG 1121 ATOM 541 C CD1 . PHE A 1121 95 . -16.365 4.878 14.205 1.00 20.00 ? ? ? ? ? . 95 PHE A CD1 1121 ATOM 542 C CD2 . PHE A 1121 95 . -14.760 3.191 13.694 1.00 20.00 ? ? ? ? ? . 95 PHE A CD2 1121 ATOM 543 C CE1 . PHE A 1121 95 . -16.688 4.190 15.370 1.00 20.00 ? ? ? ? ? . 95 PHE A CE1 1121 ATOM 544 C CE2 . PHE A 1121 95 . -15.085 2.507 14.847 1.00 20.00 ? ? ? ? ? . 95 PHE A CE2 1121 ATOM 545 C CZ . PHE A 1121 95 . -16.053 2.996 15.676 1.00 20.00 ? ? ? ? ? . 95 PHE A CZ 1121 ATOM 546 N N . GLY A 1121 96 . -15.911 6.064 9.080 1.00 20.00 ? ? ? ? ? . 96 GLY A N 1121 ATOM 547 C CA . GLY A 1121 96 . -15.546 6.582 7.767 1.00 20.00 ? ? ? ? ? . 96 GLY A CA 1121 ATOM 548 C C . GLY A 1121 96 . -16.753 6.655 6.857 1.00 20.00 ? ? ? ? ? . 96 GLY A C 1121 ATOM 549 O O . GLY A 1121 96 . -17.764 6.009 7.090 1.00 20.00 ? ? ? ? ? . 96 GLY A O 1121 ATOM 550 N N . THR A 1121 97 . -16.654 7.463 5.809 1.00 20.00 ? ? ? ? ? . 97 THR A N 1121 ATOM 551 C CA . THR A 1121 97 . -17.781 7.681 4.924 1.00 20.00 ? ? ? ? ? . 97 THR A CA 1121 ATOM 552 C C . THR A 1121 97 . -17.860 6.586 3.860 1.00 20.00 ? ? ? ? ? . 97 THR A C 1121 ATOM 553 O O . THR A 1121 97 . -18.908 5.977 3.663 1.00 20.00 ? ? ? ? ? . 97 THR A O 1121 ATOM 554 C CB . THR A 1121 97 . -17.658 9.050 4.257 1.00 20.00 ? ? ? ? ? . 97 THR A CB 1121 ATOM 555 C CG2 . THR A 1121 97 . -17.656 10.136 5.324 1.00 20.00 ? ? ? ? ? . 97 THR A CG2 1121 ATOM 556 O OG1 . THR A 1121 97 . -16.430 9.123 3.528 1.00 20.00 ? ? ? ? ? . 97 THR A OG1 1121 ATOM 557 N N . ALA A 1121 98 . -16.739 6.301 3.203 1.00 20.00 ? ? ? ? ? . 98 ALA A N 1121 ATOM 558 C CA . ALA A 1121 98 . -16.715 5.311 2.135 1.00 20.00 ? ? ? ? ? . 98 ALA A CA 1121 ATOM 559 C C . ALA A 1121 98 . -15.281 5.037 1.706 1.00 20.00 ? ? ? ? ? . 98 ALA A C 1121 ATOM 560 O O . ALA A 1121 98 . -14.406 5.896 1.869 1.00 20.00 ? ? ? ? ? . 98 ALA A O 1121 ATOM 561 C CB . ALA A 1121 98 . -17.529 5.782 0.946 1.00 20.00 ? ? ? ? ? . 98 ALA A CB 1121 ATOM 562 N N . ARG A 1121 99 . -15.055 3.839 1.175 1.00 20.00 ? ? ? ? ? . 99 ARG A N 1121 ATOM 563 C CA . ARG A 1121 99 . -13.775 3.473 0.594 1.00 20.00 ? ? ? ? ? . 99 ARG A CA 1121 ATOM 564 C C . ARG A 1121 99 . -13.732 3.869 -0.864 1.00 20.00 ? ? ? ? ? . 99 ARG A C 1121 ATOM 565 O O . ARG A 1121 99 . -14.630 3.511 -1.620 1.00 20.00 ? ? ? ? ? . 99 ARG A O 1121 ATOM 566 C CB . ARG A 1121 99 . -13.560 1.963 0.615 1.00 20.00 ? ? ? ? ? . 99 ARG A CB 1121 ATOM 567 C CG . ARG A 1121 99 . -13.612 1.292 1.963 1.00 20.00 ? ? ? ? ? . 99 ARG A CG 1121 ATOM 568 C CD . ARG A 1121 99 . -13.687 -0.217 1.786 1.00 20.00 ? ? ? ? ? . 99 ARG A CD 1121 ATOM 569 N NE . ARG A 1121 99 . -12.441 -0.744 1.226 1.00 20.00 ? ? ? ? ? . 99 ARG A NE 1121 ATOM 570 C CZ . ARG A 1121 99 . -12.357 -1.717 0.330 1.00 20.00 ? ? ? ? ? . 99 ARG A CZ 1121 ATOM 571 N NH1 . ARG A 1121 99 . -13.446 -2.310 -0.126 1.00 20.00 ? ? ? ? ? 1+ 99 ARG A NH1 1121 ATOM 572 N NH2 . ARG A 1121 99 . -11.169 -2.113 -0.102 1.00 20.00 ? ? ? ? ? . 99 ARG A NH2 1121 ATOM 573 N N . THR A 1121 100 . -12.685 4.590 -1.265 1.00 20.00 ? ? ? ? ? . 100 THR A N 1121 ATOM 574 C CA . THR A 1121 100 . -12.414 4.828 -2.674 1.00 20.00 ? ? ? ? ? . 100 THR A CA 1121 ATOM 575 C C . THR A 1121 100 . -11.131 4.106 -3.063 1.00 20.00 ? ? ? ? ? . 100 THR A C 1121 ATOM 576 O O . THR A 1121 100 . -10.068 4.432 -2.580 1.00 20.00 ? ? ? ? ? . 100 THR A O 1121 ATOM 577 C CB . THR A 1121 100 . -12.317 6.331 -3.005 1.00 20.00 ? ? ? ? ? . 100 THR A CB 1121 ATOM 578 C CG2 . THR A 1121 100 . -11.956 6.531 -4.469 1.00 20.00 ? ? ? ? ? . 100 THR A CG2 1121 ATOM 579 O OG1 . THR A 1121 100 . -13.586 6.950 -2.744 1.00 20.00 ? ? ? ? ? . 100 THR A OG1 1121 ATOM 580 N N . GLN A 1121 101 . -11.263 3.104 -3.921 1.00 20.00 ? ? ? ? ? . 101 GLN A N 1121 ATOM 581 C CA . GLN A 1121 101 . -10.117 2.346 -4.415 1.00 20.00 ? ? ? ? ? . 101 GLN A CA 1121 ATOM 582 C C . GLN A 1121 101 . -9.274 3.236 -5.311 1.00 20.00 ? ? ? ? ? . 101 GLN A C 1121 ATOM 583 O O . GLN A 1121 101 . -9.809 3.953 -6.154 1.00 20.00 ? ? ? ? ? . 101 GLN A O 1121 ATOM 584 C CB . GLN A 1121 101 . -10.583 1.133 -5.211 1.00 20.00 ? ? ? ? ? . 101 GLN A CB 1121 ATOM 585 C CG . GLN A 1121 101 . -10.907 -0.065 -4.342 1.00 20.00 ? ? ? ? ? . 101 GLN A CG 1121 ATOM 586 C CD . GLN A 1121 101 . -12.193 0.095 -3.590 1.00 20.00 ? ? ? ? ? . 101 GLN A CD 1121 ATOM 587 N NE2 . GLN A 1121 101 . -12.087 0.334 -2.290 1.00 20.00 ? ? ? ? ? . 101 GLN A NE2 1121 ATOM 588 O OE1 . GLN A 1121 101 . -13.284 -0.005 -4.165 1.00 20.00 ? ? ? ? ? . 101 GLN A OE1 1121 ATOM 589 N N . LEU A 1121 102 . -7.959 3.169 -5.171 1.00 20.00 ? ? ? ? ? . 102 LEU A N 1121 ATOM 590 C CA . LEU A 1121 102 . -7.079 4.105 -5.893 1.00 20.00 ? ? ? ? ? . 102 LEU A CA 1121 ATOM 591 C C . LEU A 1121 102 . -5.961 3.421 -6.688 1.00 20.00 ? ? ? ? ? . 102 LEU A C 1121 ATOM 592 O O . LEU A 1121 102 . -5.738 3.772 -7.845 1.00 20.00 ? ? ? ? ? . 102 LEU A O 1121 ATOM 593 C CB . LEU A 1121 102 . -6.494 5.161 -4.952 1.00 20.00 ? ? ? ? ? . 102 LEU A CB 1121 ATOM 594 C CG . LEU A 1121 102 . -7.506 6.154 -4.356 1.00 20.00 ? ? ? ? ? . 102 LEU A CG 1121 ATOM 595 C CD1 . LEU A 1121 102 . -6.852 6.978 -3.232 1.00 20.00 ? ? ? ? ? . 102 LEU A CD1 1121 ATOM 596 C CD2 . LEU A 1121 102 . -8.140 7.061 -5.449 1.00 20.00 ? ? ? ? ? . 102 LEU A CD2 1121 ATOM 597 N N . MET A 1121 103 . -5.284 2.446 -6.092 1.00 20.00 ? ? ? ? ? . 103 MET A N 1121 ATOM 598 C CA . MET A 1121 103 . -4.225 1.712 -6.763 1.00 20.00 ? ? ? ? ? . 103 MET A CA 1121 ATOM 599 C C . MET A 1121 103 . -3.910 0.455 -5.970 1.00 20.00 ? ? ? ? ? . 103 MET A C 1121 ATOM 600 O O . MET A 1121 103 . -4.366 0.301 -4.844 1.00 20.00 ? ? ? ? ? . 103 MET A O 1121 ATOM 601 C CB . MET A 1121 103 . -2.950 2.544 -6.883 1.00 20.00 ? ? ? ? ? . 103 MET A CB 1121 ATOM 602 C CG . MET A 1121 103 . -2.232 2.848 -5.582 1.00 20.00 ? ? ? ? ? . 103 MET A CG 1121 ATOM 603 S SD . MET A 1121 103 . -2.940 4.165 -4.568 1.00 20.00 ? ? ? ? ? . 103 MET A SD 1121 ATOM 604 C CE . MET A 1121 103 . -1.675 4.303 -3.328 1.00 20.00 ? ? ? ? ? . 103 MET A CE 1121 ATOM 605 N N . TYR A 1121 104 . -3.129 -0.444 -6.555 1.00 20.00 ? ? ? ? ? . 104 TYR A N 1121 ATOM 606 C CA . TYR A 1121 104 . -2.597 -1.563 -5.793 1.00 20.00 ? ? ? ? ? . 104 TYR A CA 1121 ATOM 607 C C . TYR A 1121 104 . -1.118 -1.760 -6.070 1.00 20.00 ? ? ? ? ? . 104 TYR A C 1121 ATOM 608 O O . TYR A 1121 104 . -0.657 -1.505 -7.184 1.00 20.00 ? ? ? ? ? . 104 TYR A O 1121 ATOM 609 C CB . TYR A 1121 104 . -3.379 -2.844 -6.091 1.00 20.00 ? ? ? ? ? . 104 TYR A CB 1121 ATOM 610 C CG . TYR A 1121 104 . -3.347 -3.344 -7.524 1.00 20.00 ? ? ? ? ? . 104 TYR A CG 1121 ATOM 611 C CD1 . TYR A 1121 104 . -2.355 -4.222 -7.955 1.00 20.00 ? ? ? ? ? . 104 TYR A CD1 1121 ATOM 612 C CD2 . TYR A 1121 104 . -4.326 -2.972 -8.433 1.00 20.00 ? ? ? ? ? . 104 TYR A CD2 1121 ATOM 613 C CE1 . TYR A 1121 104 . -2.336 -4.705 -9.257 1.00 20.00 ? ? ? ? ? . 104 TYR A CE1 1121 ATOM 614 C CE2 . TYR A 1121 104 . -4.321 -3.458 -9.720 1.00 20.00 ? ? ? ? ? . 104 TYR A CE2 1121 ATOM 615 C CZ . TYR A 1121 104 . -3.321 -4.309 -10.134 1.00 20.00 ? ? ? ? ? . 104 TYR A CZ 1121 ATOM 616 O OH . TYR A 1121 104 . -3.311 -4.780 -11.426 1.00 20.00 ? ? ? ? ? . 104 TYR A OH 1121 ATOM 617 N N . ASN A 1121 105 . -0.402 -2.218 -5.046 1.00 20.00 ? ? ? ? ? . 105 ASN A N 1121 ATOM 618 C CA . ASN A 1121 105 . 0.920 -2.801 -5.189 1.00 20.00 ? ? ? ? ? . 105 ASN A CA 1121 ATOM 619 C C . ASN A 1121 105 . 0.695 -4.306 -5.174 1.00 20.00 ? ? ? ? ? . 105 ASN A C 1121 ATOM 620 O O . ASN A 1121 105 . -0.452 -4.748 -5.252 1.00 20.00 ? ? ? ? ? . 105 ASN A O 1121 ATOM 621 C CB . ASN A 1121 105 . 1.834 -2.379 -4.042 1.00 20.00 ? ? ? ? ? . 105 ASN A CB 1121 ATOM 622 C CG . ASN A 1121 105 . 1.179 -2.539 -2.685 1.00 20.00 ? ? ? ? ? . 105 ASN A CG 1121 ATOM 623 N ND2 . ASN A 1121 105 . 1.800 -1.972 -1.657 1.00 20.00 ? ? ? ? ? . 105 ASN A ND2 1121 ATOM 624 O OD1 . ASN A 1121 105 . 0.126 -3.165 -2.561 1.00 20.00 ? ? ? ? ? . 105 ASN A OD1 1121 ATOM 625 N N . ASP A 1121 106 . 1.750 -5.108 -5.082 1.00 20.00 ? ? ? ? ? . 106 ASP A N 1121 ATOM 626 C CA . ASP A 1121 106 . 1.535 -6.539 -5.100 1.00 20.00 ? ? ? ? ? . 106 ASP A CA 1121 ATOM 627 C C . ASP A 1121 106 . 2.627 -7.325 -4.395 1.00 20.00 ? ? ? ? ? . 106 ASP A C 1121 ATOM 628 O O . ASP A 1121 106 . 3.705 -6.811 -4.074 1.00 20.00 ? ? ? ? ? . 106 ASP A O 1121 ATOM 629 C CB . ASP A 1121 106 . 1.309 -7.058 -6.535 1.00 20.00 ? ? ? ? ? . 106 ASP A CB 1121 ATOM 630 C CG . ASP A 1121 106 . 2.554 -6.992 -7.409 1.00 20.00 ? ? ? ? ? . 106 ASP A CG 1121 ATOM 631 O OD1 . ASP A 1121 106 . 3.494 -6.232 -7.088 1.00 20.00 ? ? ? ? ? . 106 ASP A OD1 1121 ATOM 632 O OD2 . ASP A 1121 106 . 2.581 -7.689 -8.452 1.00 20.00 ? ? ? ? ? 1- 106 ASP A OD2 1121 ATOM 633 N N . PHE A 1121 107 . 2.287 -8.579 -4.142 1.00 20.00 ? ? ? ? ? . 107 PHE A N 1121 ATOM 634 C CA . PHE A 1121 107 . 3.181 -9.551 -3.546 1.00 20.00 ? ? ? ? ? . 107 PHE A CA 1121 ATOM 635 C C . PHE A 1121 107 . 3.600 -10.533 -4.618 1.00 20.00 ? ? ? ? ? . 107 PHE A C 1121 ATOM 636 O O . PHE A 1121 107 . 2.913 -10.687 -5.615 1.00 20.00 ? ? ? ? ? . 107 PHE A O 1121 ATOM 637 C CB . PHE A 1121 107 . 2.466 -10.297 -2.412 1.00 20.00 ? ? ? ? ? . 107 PHE A CB 1121 ATOM 638 C CG . PHE A 1121 107 . 2.111 -9.426 -1.240 1.00 20.00 ? ? ? ? ? . 107 PHE A CG 1121 ATOM 639 C CD1 . PHE A 1121 107 . 3.017 -9.217 -0.225 1.00 20.00 ? ? ? ? ? . 107 PHE A CD1 1121 ATOM 640 C CD2 . PHE A 1121 107 . 0.864 -8.796 -1.166 1.00 20.00 ? ? ? ? ? . 107 PHE A CD2 1121 ATOM 641 C CE1 . PHE A 1121 107 . 2.705 -8.396 0.849 1.00 20.00 ? ? ? ? ? . 107 PHE A CE1 1121 ATOM 642 C CE2 . PHE A 1121 107 . 0.534 -7.986 -0.091 1.00 20.00 ? ? ? ? ? . 107 PHE A CE2 1121 ATOM 643 C CZ . PHE A 1121 107 . 1.459 -7.783 0.916 1.00 20.00 ? ? ? ? ? . 107 PHE A CZ 1121 ATOM 644 N N . VAL A 1121 108 . 4.731 -11.197 -4.404 1.00 20.00 ? ? ? ? ? . 108 VAL A N 1121 ATOM 645 C CA . VAL A 1121 108 . 5.256 -12.174 -5.344 1.00 20.00 ? ? ? ? ? . 108 VAL A CA 1121 ATOM 646 C C . VAL A 1121 108 . 5.842 -13.339 -4.562 1.00 20.00 ? ? ? ? ? . 108 VAL A C 1121 ATOM 647 O O . VAL A 1121 108 . 6.174 -13.212 -3.383 1.00 20.00 ? ? ? ? ? . 108 VAL A O 1121 ATOM 648 C CB . VAL A 1121 108 . 6.343 -11.562 -6.273 1.00 20.00 ? ? ? ? ? . 108 VAL A CB 1121 ATOM 649 C CG1 . VAL A 1121 108 . 5.747 -10.480 -7.178 1.00 20.00 ? ? ? ? ? . 108 VAL A CG1 1121 ATOM 650 C CG2 . VAL A 1121 108 . 7.507 -11.027 -5.476 1.00 20.00 ? ? ? ? ? . 108 VAL A CG2 1121 ATOM 651 N N . ILE A 1121 109 . 5.957 -14.481 -5.225 1.00 20.00 ? ? ? ? ? . 109 ILE A N 1121 ATOM 652 C CA . ILE A 1121 109 . 6.687 -15.602 -4.650 1.00 20.00 ? ? ? ? ? . 109 ILE A CA 1121 ATOM 653 C C . ILE A 1121 109 . 8.008 -15.717 -5.378 1.00 20.00 ? ? ? ? ? . 109 ILE A C 1121 ATOM 654 O O . ILE A 1121 109 . 8.055 -15.689 -6.607 1.00 20.00 ? ? ? ? ? . 109 ILE A O 1121 ATOM 655 C CB . ILE A 1121 109 . 5.891 -16.924 -4.719 1.00 20.00 ? ? ? ? ? . 109 ILE A CB 1121 ATOM 656 C CG1 . ILE A 1121 109 . 4.564 -16.736 -3.978 1.00 20.00 ? ? ? ? ? . 109 ILE A CG1 1121 ATOM 657 C CG2 . ILE A 1121 109 . 6.701 -18.077 -4.142 1.00 20.00 ? ? ? ? ? . 109 ILE A CG2 1121 ATOM 658 C CD1 . ILE A 1121 109 . 3.587 -17.820 -4.222 1.00 20.00 ? ? ? ? ? . 109 ILE A CD1 1121 ATOM 659 N N . ILE A 1121 110 . 9.072 -15.818 -4.596 1.00 20.00 ? ? ? ? ? . 110 ILE A N 1121 ATOM 660 C CA . ILE A 1121 110 . 10.423 -15.894 -5.120 1.00 20.00 ? ? ? ? ? . 110 ILE A CA 1121 ATOM 661 C C . ILE A 1121 110 . 11.032 -17.203 -4.654 1.00 20.00 ? ? ? ? ? . 110 ILE A C 1121 ATOM 662 O O . ILE A 1121 110 . 10.565 -17.831 -3.686 1.00 20.00 ? ? ? ? ? . 110 ILE A O 1121 ATOM 663 C CB . ILE A 1121 110 . 11.296 -14.675 -4.675 1.00 20.00 ? ? ? ? ? . 110 ILE A CB 1121 ATOM 664 C CG1 . ILE A 1121 110 . 11.601 -14.723 -3.173 1.00 20.00 ? ? ? ? ? . 110 ILE A CG1 1121 ATOM 665 C CG2 . ILE A 1121 110 . 10.607 -13.380 -5.059 1.00 20.00 ? ? ? ? ? . 110 ILE A CG2 1121 ATOM 666 C CD1 . ILE A 1121 110 . 12.451 -13.581 -2.645 1.00 20.00 ? ? ? ? ? . 110 ILE A CD1 1121 ATOM 667 N N . GLY A 1121 111 . 12.082 -17.611 -5.351 1.00 20.00 ? ? ? ? ? . 111 GLY A N 1121 ATOM 668 C CA . GLY A 1121 111 . 12.776 -18.847 -5.051 1.00 20.00 ? ? ? ? ? . 111 GLY A CA 1121 ATOM 669 C C . GLY A 1121 111 . 14.051 -18.907 -5.859 1.00 20.00 ? ? ? ? ? . 111 GLY A C 1121 ATOM 670 O O . GLY A 1121 111 . 14.309 -18.018 -6.688 1.00 20.00 ? ? ? ? ? . 111 GLY A O 1121 ATOM 671 N N . PRO A 1121 112 . 14.847 -19.966 -5.653 1.00 20.00 ? ? ? ? ? . 112 PRO A N 1121 ATOM 672 C CA . PRO A 1121 112 . 16.083 -20.136 -6.414 1.00 20.00 ? ? ? ? ? . 112 PRO A CA 1121 ATOM 673 C C . PRO A 1121 112 . 15.834 -20.082 -7.907 1.00 20.00 ? ? ? ? ? . 112 PRO A C 1121 ATOM 674 O O . PRO A 1121 112 . 14.803 -20.571 -8.350 1.00 20.00 ? ? ? ? ? . 112 PRO A O 1121 ATOM 675 C CB . PRO A 1121 112 . 16.544 -21.536 -6.012 1.00 20.00 ? ? ? ? ? . 112 PRO A CB 1121 ATOM 676 C CG . PRO A 1121 112 . 15.950 -21.763 -4.678 1.00 20.00 ? ? ? ? ? . 112 PRO A CG 1121 ATOM 677 C CD . PRO A 1121 112 . 14.631 -21.068 -4.700 1.00 20.00 ? ? ? ? ? . 112 PRO A CD 1121 ATOM 678 N N . ALA A 1121 113 . 16.760 -19.497 -8.665 1.00 20.00 ? ? ? ? ? . 113 ALA A N 1121 ATOM 679 C CA . ALA A 1121 113 . 16.629 -19.450 -10.119 1.00 20.00 ? ? ? ? ? . 113 ALA A CA 1121 ATOM 680 C C . ALA A 1121 113 . 16.410 -20.850 -10.681 1.00 20.00 ? ? ? ? ? . 113 ALA A C 1121 ATOM 681 O O . ALA A 1121 113 . 15.629 -21.033 -11.612 1.00 20.00 ? ? ? ? ? . 113 ALA A O 1121 ATOM 682 C CB . ALA A 1121 113 . 17.861 -18.801 -10.756 1.00 20.00 ? ? ? ? ? . 113 ALA A CB 1121 ATOM 683 N N . ALA A 1121 114 . 17.075 -21.835 -10.077 1.00 20.00 ? ? ? ? ? . 114 ALA A N 1121 ATOM 684 C CA . ALA A 1121 114 . 16.981 -23.224 -10.518 1.00 20.00 ? ? ? ? ? . 114 ALA A CA 1121 ATOM 685 C C . ALA A 1121 114 . 15.610 -23.839 -10.222 1.00 20.00 ? ? ? ? ? . 114 ALA A C 1121 ATOM 686 O O . ALA A 1121 114 . 15.276 -24.890 -10.781 1.00 20.00 ? ? ? ? ? . 114 ALA A O 1121 ATOM 687 C CB . ALA A 1121 114 . 18.082 -24.065 -9.870 1.00 20.00 ? ? ? ? ? . 114 ALA A CB 1121 ATOM 688 N N . ASP A 1121 115 . 14.855 -23.205 -9.320 1.00 20.00 ? ? ? ? ? . 115 ASP A N 1121 ATOM 689 C CA . ASP A 1121 115 . 13.435 -23.509 -9.105 1.00 20.00 ? ? ? ? ? . 115 ASP A CA 1121 ATOM 690 C C . ASP A 1121 115 . 13.209 -25.006 -8.901 1.00 20.00 ? ? ? ? ? . 115 ASP A C 1121 ATOM 691 O O . ASP A 1121 115 . 12.592 -25.674 -9.731 1.00 20.00 ? ? ? ? ? . 115 ASP A O 1121 ATOM 692 C CB . ASP A 1121 115 . 12.651 -22.967 -10.312 1.00 20.00 ? ? ? ? ? . 115 ASP A CB 1121 ATOM 693 C CG . ASP A 1121 115 . 11.141 -23.094 -10.172 1.00 20.00 ? ? ? ? ? . 115 ASP A CG 1121 ATOM 694 O OD1 . ASP A 1121 115 . 10.617 -23.297 -9.061 1.00 20.00 ? ? ? ? ? . 115 ASP A OD1 1121 ATOM 695 O OD2 . ASP A 1121 115 . 10.471 -22.956 -11.212 1.00 20.00 ? ? ? ? ? 1- 115 ASP A OD2 1121 ATOM 696 N N . PRO A 1121 116 . 13.721 -25.546 -7.786 1.00 20.00 ? ? ? ? ? . 116 PRO A N 1121 ATOM 697 C CA . PRO A 1121 116 . 13.714 -27.004 -7.611 1.00 20.00 ? ? ? ? ? . 116 PRO A CA 1121 ATOM 698 C C . PRO A 1121 116 . 12.312 -27.615 -7.516 1.00 20.00 ? ? ? ? ? . 116 PRO A C 1121 ATOM 699 O O . PRO A 1121 116 . 12.178 -28.808 -7.794 1.00 20.00 ? ? ? ? ? . 116 PRO A O 1121 ATOM 700 C CB . PRO A 1121 116 . 14.484 -27.209 -6.300 1.00 20.00 ? ? ? ? ? . 116 PRO A CB 1121 ATOM 701 C CG . PRO A 1121 116 . 14.384 -25.880 -5.588 1.00 20.00 ? ? ? ? ? . 116 PRO A CG 1121 ATOM 702 C CD . PRO A 1121 116 . 14.406 -24.859 -6.678 1.00 20.00 ? ? ? ? ? . 116 PRO A CD 1121 ATOM 703 N N . ALA A 1121 117 . 11.301 -26.823 -7.159 1.00 20.00 ? ? ? ? ? . 117 ALA A N 1121 ATOM 704 C CA . ALA A 1121 117 . 9.921 -27.306 -7.137 1.00 20.00 ? ? ? ? ? . 117 ALA A CA 1121 ATOM 705 C C . ALA A 1121 117 . 9.240 -27.114 -8.479 1.00 20.00 ? ? ? ? ? . 117 ALA A C 1121 ATOM 706 O O . ALA A 1121 117 . 8.128 -27.602 -8.690 1.00 20.00 ? ? ? ? ? . 117 ALA A O 1121 ATOM 707 C CB . ALA A 1121 117 . 9.118 -26.596 -6.025 1.00 20.00 ? ? ? ? ? . 117 ALA A CB 1121 ATOM 708 N N . GLY A 1121 118 . 9.903 -26.398 -9.378 1.00 20.00 ? ? ? ? ? . 118 GLY A N 1121 ATOM 709 C CA . GLY A 1121 118 . 9.386 -26.163 -10.710 1.00 20.00 ? ? ? ? ? . 118 GLY A CA 1121 ATOM 710 C C . GLY A 1121 118 . 8.076 -25.391 -10.754 1.00 20.00 ? ? ? ? ? . 118 GLY A C 1121 ATOM 711 O O . GLY A 1121 118 . 7.165 -25.768 -11.491 1.00 20.00 ? ? ? ? ? . 118 GLY A O 1121 ATOM 712 N N . VAL A 1121 119 . 7.981 -24.306 -9.988 1.00 20.00 ? ? ? ? ? . 119 VAL A N 1121 ATOM 713 C CA . VAL A 1121 119 . 6.727 -23.556 -9.914 1.00 20.00 ? ? ? ? ? . 119 VAL A CA 1121 ATOM 714 C C . VAL A 1121 119 . 6.667 -22.320 -10.813 1.00 20.00 ? ? ? ? ? . 119 VAL A C 1121 ATOM 715 O O . VAL A 1121 119 . 5.629 -21.664 -10.879 1.00 20.00 ? ? ? ? ? . 119 VAL A O 1121 ATOM 716 C CB . VAL A 1121 119 . 6.428 -23.103 -8.470 1.00 20.00 ? ? ? ? ? . 119 VAL A CB 1121 ATOM 717 C CG1 . VAL A 1121 119 . 6.371 -24.315 -7.536 1.00 20.00 ? ? ? ? ? . 119 VAL A CG1 1121 ATOM 718 C CG2 . VAL A 1121 119 . 7.465 -22.075 -7.995 1.00 20.00 ? ? ? ? ? . 119 VAL A CG2 1121 ATOM 719 N N . LYS A 1121 120 . 7.755 -21.989 -11.506 1.00 20.00 ? ? ? ? ? . 120 LYS A N 1121 ATOM 720 C CA . LYS A 1121 120 . 7.761 -20.776 -12.318 1.00 20.00 ? ? ? ? ? . 120 LYS A CA 1121 ATOM 721 C C . LYS A 1121 120 . 6.599 -20.758 -13.288 1.00 20.00 ? ? ? ? ? . 120 LYS A C 1121 ATOM 722 O O . LYS A 1121 120 . 6.375 -21.724 -14.024 1.00 20.00 ? ? ? ? ? . 120 LYS A O 1121 ATOM 723 C CB . LYS A 1121 120 . 9.076 -20.614 -13.076 1.00 20.00 ? ? ? ? ? . 120 LYS A CB 1121 ATOM 724 C CG . LYS A 1121 120 . 9.200 -19.276 -13.777 1.00 20.00 ? ? ? ? ? . 120 LYS A CG 1121 ATOM 725 C CD . LYS A 1121 120 . 10.613 -19.017 -14.278 1.00 20.00 ? ? ? ? ? . 120 LYS A CD 1121 ATOM 726 C CE . LYS A 1121 120 . 10.744 -17.582 -14.763 1.00 20.00 ? ? ? ? ? . 120 LYS A CE 1121 ATOM 727 N NZ . LYS A 1121 120 . 12.141 -17.209 -15.090 1.00 20.00 ? ? ? ? ? 1+ 120 LYS A NZ 1121 ATOM 728 N N . GLY A 1121 121 . 5.859 -19.644 -13.269 1.00 20.00 ? ? ? ? ? . 121 GLY A N 1121 ATOM 729 C CA . GLY A 1121 121 . 4.771 -19.417 -14.197 1.00 20.00 ? ? ? ? ? . 121 GLY A CA 1121 ATOM 730 C C . GLY A 1121 121 . 3.460 -20.067 -13.795 1.00 20.00 ? ? ? ? ? . 121 GLY A C 1121 ATOM 731 O O . GLY A 1121 121 . 2.472 -19.957 -14.529 1.00 20.00 ? ? ? ? ? . 121 GLY A O 1121 ATOM 732 N N . MET A 1121 122 . 3.437 -20.745 -12.646 1.00 20.00 ? ? ? ? ? . 122 MET A N 1121 ATOM 733 C CA . MET A 1121 122 . 2.203 -21.341 -12.148 1.00 20.00 ? ? ? ? ? . 122 MET A CA 1121 ATOM 734 C C . MET A 1121 122 . 1.352 -20.264 -11.491 1.00 20.00 ? ? ? ? ? . 122 MET A C 1121 ATOM 735 O O . MET A 1121 122 . 1.864 -19.209 -11.128 1.00 20.00 ? ? ? ? ? . 122 MET A O 1121 ATOM 736 C CB . MET A 1121 122 . 2.505 -22.428 -11.105 1.00 20.00 ? ? ? ? ? . 122 MET A CB 1121 ATOM 737 C CG . MET A 1121 122 . 3.006 -23.757 -11.662 1.00 20.00 ? ? ? ? ? . 122 MET A CG 1121 ATOM 738 S SD . MET A 1121 122 . 3.230 -24.958 -10.314 1.00 20.00 ? ? ? ? ? . 122 MET A SD 1121 ATOM 739 C CE . MET A 1121 122 . 3.788 -26.401 -11.191 1.00 20.00 ? ? ? ? ? . 122 MET A CE 1121 ATOM 740 N N . THR A 1121 123 . 0.063 -20.545 -11.308 1.00 20.00 ? ? ? ? ? . 123 THR A N 1121 ATOM 741 C CA . THR A 1121 123 . -0.761 -19.744 -10.409 1.00 20.00 ? ? ? ? ? . 123 THR A CA 1121 ATOM 742 C C . THR A 1121 123 . -0.285 -19.924 -8.965 1.00 20.00 ? ? ? ? ? . 123 THR A C 1121 ATOM 743 O O . THR A 1121 123 . 0.426 -20.878 -8.634 1.00 20.00 ? ? ? ? ? . 123 THR A O 1121 ATOM 744 C CB . THR A 1121 123 . -2.231 -20.181 -10.434 1.00 20.00 ? ? ? ? ? . 123 THR A CB 1121 ATOM 745 C CG2 . THR A 1121 123 . -2.791 -20.117 -11.859 1.00 20.00 ? ? ? ? ? . 123 THR A CG2 1121 ATOM 746 O OG1 . THR A 1121 123 . -2.339 -21.509 -9.879 1.00 20.00 ? ? ? ? ? . 123 THR A OG1 1121 ATOM 747 N N . VAL A 1121 124 . -0.700 -19.015 -8.089 1.00 20.00 ? ? ? ? ? . 124 VAL A N 1121 ATOM 748 C CA . VAL A 1121 124 . -0.336 -19.104 -6.681 1.00 20.00 ? ? ? ? ? . 124 VAL A CA 1121 ATOM 749 C C . VAL A 1121 124 . -0.773 -20.431 -6.061 1.00 20.00 ? ? ? ? ? . 124 VAL A C 1121 ATOM 750 O O . VAL A 1121 124 . 0.001 -21.108 -5.364 1.00 20.00 ? ? ? ? ? . 124 VAL A O 1121 ATOM 751 C CB . VAL A 1121 124 . -0.946 -17.920 -5.888 1.00 20.00 ? ? ? ? ? . 124 VAL A CB 1121 ATOM 752 C CG1 . VAL A 1121 124 . -0.933 -18.183 -4.393 1.00 20.00 ? ? ? ? ? . 124 VAL A CG1 1121 ATOM 753 C CG2 . VAL A 1121 124 . -0.175 -16.662 -6.170 1.00 20.00 ? ? ? ? ? . 124 VAL A CG2 1121 ATOM 754 N N . ALA A 1121 125 . -2.005 -20.829 -6.331 1.00 20.00 ? ? ? ? ? . 125 ALA A N 1121 ATOM 755 C CA . ALA A 1121 125 . -2.523 -22.069 -5.767 1.00 20.00 ? ? ? ? ? . 125 ALA A CA 1121 ATOM 756 C C . ALA A 1121 125 . -1.750 -23.295 -6.258 1.00 20.00 ? ? ? ? ? . 125 ALA A C 1121 ATOM 757 O O . ALA A 1121 125 . -1.458 -24.192 -5.466 1.00 20.00 ? ? ? ? ? . 125 ALA A O 1121 ATOM 758 C CB . ALA A 1121 125 . -4.010 -22.217 -6.059 1.00 20.00 ? ? ? ? ? . 125 ALA A CB 1121 ATOM 759 N N . ALA A 1121 126 . -1.390 -23.335 -7.541 1.00 20.00 ? ? ? ? ? . 126 ALA A N 1121 ATOM 760 C CA . ALA A 1121 126 . -0.648 -24.485 -8.067 1.00 20.00 ? ? ? ? ? . 126 ALA A CA 1121 ATOM 761 C C . ALA A 1121 126 . 0.764 -24.491 -7.502 1.00 20.00 ? ? ? ? ? . 126 ALA A C 1121 ATOM 762 O O . ALA A 1121 126 . 1.305 -25.529 -7.154 1.00 20.00 ? ? ? ? ? . 126 ALA A O 1121 ATOM 763 C CB . ALA A 1121 126 . -0.620 -24.463 -9.588 1.00 20.00 ? ? ? ? ? . 126 ALA A CB 1121 ATOM 764 N N . ALA A 1121 127 . 1.343 -23.306 -7.386 1.00 20.00 ? ? ? ? ? . 127 ALA A N 1121 ATOM 765 C CA . ALA A 1121 127 . 2.712 -23.176 -6.905 1.00 20.00 ? ? ? ? ? . 127 ALA A CA 1121 ATOM 766 C C . ALA A 1121 127 . 2.827 -23.630 -5.467 1.00 20.00 ? ? ? ? ? . 127 ALA A C 1121 ATOM 767 O O . ALA A 1121 127 . 3.719 -24.399 -5.117 1.00 20.00 ? ? ? ? ? . 127 ALA A O 1121 ATOM 768 C CB . ALA A 1121 127 . 3.177 -21.744 -7.035 1.00 20.00 ? ? ? ? ? . 127 ALA A CB 1121 ATOM 769 N N . LEU A 1121 128 . 1.946 -23.117 -4.615 1.00 20.00 ? ? ? ? ? . 128 LEU A N 1121 ATOM 770 C CA . LEU A 1121 128 . 1.985 -23.481 -3.211 1.00 20.00 ? ? ? ? ? . 128 LEU A CA 1121 ATOM 771 C C . LEU A 1121 128 . 1.647 -24.960 -3.035 1.00 20.00 ? ? ? ? ? . 128 LEU A C 1121 ATOM 772 O O . LEU A 1121 128 . 2.246 -25.639 -2.211 1.00 20.00 ? ? ? ? ? . 128 LEU A O 1121 ATOM 773 C CB . LEU A 1121 128 . 1.032 -22.591 -2.410 1.00 20.00 ? ? ? ? ? . 128 LEU A CB 1121 ATOM 774 C CG . LEU A 1121 128 . 1.392 -21.099 -2.333 1.00 20.00 ? ? ? ? ? . 128 LEU A CG 1121 ATOM 775 C CD1 . LEU A 1121 128 . 0.380 -20.401 -1.457 1.00 20.00 ? ? ? ? ? . 128 LEU A CD1 1121 ATOM 776 C CD2 . LEU A 1121 128 . 2.803 -20.874 -1.832 1.00 20.00 ? ? ? ? ? . 128 LEU A CD2 1121 ATOM 777 N N . GLY A 1121 129 . 0.700 -25.472 -3.809 1.00 20.00 ? ? ? ? ? . 129 GLY A N 1121 ATOM 778 C CA . GLY A 1121 129 . 0.409 -26.903 -3.773 1.00 20.00 ? ? ? ? ? . 129 GLY A CA 1121 ATOM 779 C C . GLY A 1121 129 . 1.608 -27.775 -4.133 1.00 20.00 ? ? ? ? ? . 129 GLY A C 1121 ATOM 780 O O . GLY A 1121 129 . 1.861 -28.814 -3.507 1.00 20.00 ? ? ? ? ? . 129 GLY A O 1121 ATOM 781 N N . LYS A 1121 130 . 2.357 -27.331 -5.138 1.00 20.00 ? ? ? ? ? . 130 LYS A N 1121 ATOM 782 C CA . LYS A 1121 130 . 3.530 -28.051 -5.632 1.00 20.00 ? ? ? ? ? . 130 LYS A CA 1121 ATOM 783 C C . LYS A 1121 130 . 4.693 -27.982 -4.642 1.00 20.00 ? ? ? ? ? . 130 LYS A C 1121 ATOM 784 O O . LYS A 1121 130 . 5.406 -28.974 -4.424 1.00 20.00 ? ? ? ? ? . 130 LYS A O 1121 ATOM 785 C CB . LYS A 1121 130 . 3.940 -27.468 -6.993 1.00 20.00 ? ? ? ? ? . 130 LYS A CB 1121 ATOM 786 C CG . LYS A 1121 130 . 5.096 -28.169 -7.666 1.00 20.00 ? ? ? ? ? . 130 LYS A CG 1121 ATOM 787 C CD . LYS A 1121 130 . 4.788 -29.636 -7.857 1.00 20.00 ? ? ? ? ? . 130 LYS A CD 1121 ATOM 788 C CE . LYS A 1121 130 . 5.531 -30.226 -9.036 1.00 20.00 ? ? ? ? ? . 130 LYS A CE 1121 ATOM 789 N NZ . LYS A 1121 130 . 6.995 -30.225 -8.837 1.00 20.00 ? ? ? ? ? 1+ 130 LYS A NZ 1121 ATOM 790 N N . ILE A 1121 131 . 4.894 -26.803 -4.045 1.00 20.00 ? ? ? ? ? . 131 ILE A N 1121 ATOM 791 C CA . ILE A 1121 131 . 5.890 -26.652 -2.993 1.00 20.00 ? ? ? ? ? . 131 ILE A CA 1121 ATOM 792 C C . ILE A 1121 131 . 5.608 -27.640 -1.851 1.00 20.00 ? ? ? ? ? . 131 ILE A C 1121 ATOM 793 O O . ILE A 1121 131 . 6.507 -28.360 -1.372 1.00 20.00 ? ? ? ? ? . 131 ILE A O 1121 ATOM 794 C CB . ILE A 1121 131 . 5.933 -25.186 -2.512 1.00 20.00 ? ? ? ? ? . 131 ILE A CB 1121 ATOM 795 C CG1 . ILE A 1121 131 . 6.658 -24.344 -3.561 1.00 20.00 ? ? ? ? ? . 131 ILE A CG1 1121 ATOM 796 C CG2 . ILE A 1121 131 . 6.585 -25.051 -1.137 1.00 20.00 ? ? ? ? ? . 131 ILE A CG2 1121 ATOM 797 C CD1 . ILE A 1121 131 . 6.368 -22.864 -3.468 1.00 20.00 ? ? ? ? ? . 131 ILE A CD1 1121 ATOM 798 N N . ALA A 1121 132 . 4.346 -27.706 -1.442 1.00 20.00 ? ? ? ? ? . 132 ALA A N 1121 ATOM 799 C CA . ALA A 1121 132 . 3.951 -28.602 -0.368 1.00 20.00 ? ? ? ? ? . 132 ALA A CA 1121 ATOM 800 C C . ALA A 1121 132 . 4.140 -30.056 -0.792 1.00 20.00 ? ? ? ? ? . 132 ALA A C 1121 ATOM 801 O O . ALA A 1121 132 . 4.635 -30.851 -0.005 1.00 20.00 ? ? ? ? ? . 132 ALA A O 1121 ATOM 802 C CB . ALA A 1121 132 . 2.532 -28.354 0.036 1.00 20.00 ? ? ? ? ? . 132 ALA A CB 1121 ATOM 803 N N . ALA A 1121 133 . 3.758 -30.394 -2.022 1.00 20.00 ? ? ? ? ? . 133 ALA A N 1121 ATOM 804 C CA . ALA A 1121 133 . 3.826 -31.773 -2.502 1.00 20.00 ? ? ? ? ? . 133 ALA A CA 1121 ATOM 805 C C . ALA A 1121 133 . 5.278 -32.241 -2.549 1.00 20.00 ? ? ? ? ? . 133 ALA A C 1121 ATOM 806 O O . ALA A 1121 133 . 5.599 -33.396 -2.200 1.00 20.00 ? ? ? ? ? . 133 ALA A O 1121 ATOM 807 C CB . ALA A 1121 133 . 3.193 -31.867 -3.880 1.00 20.00 ? ? ? ? ? . 133 ALA A CB 1121 ATOM 808 N N . ASP A 1121 134 . 6.153 -31.337 -2.982 1.00 20.00 ? ? ? ? ? . 134 ASP A N 1121 ATOM 809 C CA . ASP A 1121 134 . 7.571 -31.640 -3.137 1.00 20.00 ? ? ? ? ? . 134 ASP A CA 1121 ATOM 810 C C . ASP A 1121 134 . 8.344 -31.440 -1.828 1.00 20.00 ? ? ? ? ? . 134 ASP A C 1121 ATOM 811 O O . ASP A 1121 134 . 9.555 -31.669 -1.778 1.00 20.00 ? ? ? ? ? . 134 ASP A O 1121 ATOM 812 C CB . ASP A 1121 134 . 8.166 -30.787 -4.272 1.00 20.00 ? ? ? ? ? . 134 ASP A CB 1121 ATOM 813 C CG . ASP A 1121 134 . 7.713 -31.267 -5.661 1.00 20.00 ? ? ? ? ? . 134 ASP A CG 1121 ATOM 814 O OD1 . ASP A 1121 134 . 6.800 -32.114 -5.728 1.00 20.00 ? ? ? ? ? . 134 ASP A OD1 1121 ATOM 815 O OD2 . ASP A 1121 134 . 8.252 -30.796 -6.691 1.00 20.00 ? ? ? ? ? 1- 134 ASP A OD2 1121 ATOM 816 N N . ASN A 1121 135 . 7.639 -31.031 -0.771 1.00 20.00 ? ? ? ? ? . 135 ASN A N 1121 ATOM 817 C CA . ASN A 1121 135 . 8.266 -30.715 0.508 1.00 20.00 ? ? ? ? ? . 135 ASN A CA 1121 ATOM 818 C C . ASN A 1121 135 . 9.398 -29.686 0.371 1.00 20.00 ? ? ? ? ? . 135 ASN A C 1121 ATOM 819 O O . ASN A 1121 135 . 10.390 -29.732 1.090 1.00 20.00 ? ? ? ? ? . 135 ASN A O 1121 ATOM 820 C CB . ASN A 1121 135 . 8.810 -31.985 1.178 1.00 20.00 ? ? ? ? ? . 135 ASN A CB 1121 ATOM 821 C CG . ASN A 1121 135 . 7.717 -32.854 1.820 1.00 20.00 ? ? ? ? ? . 135 ASN A CG 1121 ATOM 822 N ND2 . ASN A 1121 135 . 8.141 -33.895 2.460 1.00 20.00 ? ? ? ? ? . 135 ASN A ND2 1121 ATOM 823 O OD1 . ASN A 1121 135 . 6.521 -32.577 1.748 1.00 20.00 ? ? ? ? ? . 135 ASN A OD1 1121 ATOM 824 N N . ALA A 1121 136 . 9.263 -28.758 -0.571 1.00 20.00 ? ? ? ? ? . 136 ALA A N 1121 ATOM 825 C CA . ALA A 1121 136 . 10.267 -27.711 -0.760 1.00 20.00 ? ? ? ? ? . 136 ALA A CA 1121 ATOM 826 C C . ALA A 1121 136 . 10.241 -26.741 0.404 1.00 20.00 ? ? ? ? ? . 136 ALA A C 1121 ATOM 827 O O . ALA A 1121 136 . 9.192 -26.496 0.990 1.00 20.00 ? ? ? ? ? . 136 ALA A O 1121 ATOM 828 C CB . ALA A 1121 136 . 10.032 -26.959 -2.084 1.00 20.00 ? ? ? ? ? . 136 ALA A CB 1121 ATOM 829 N N . VAL A 1121 137 . 11.397 -26.167 0.717 1.00 20.00 ? ? ? ? ? . 137 VAL A N 1121 ATOM 830 C CA . VAL A 1121 137 . 11.488 -25.196 1.799 1.00 20.00 ? ? ? ? ? . 137 VAL A CA 1121 ATOM 831 C C . VAL A 1121 137 . 10.673 -23.971 1.435 1.00 20.00 ? ? ? ? ? . 137 VAL A C 1121 ATOM 832 O O . VAL A 1121 137 . 10.795 -23.434 0.334 1.00 20.00 ? ? ? ? ? . 137 VAL A O 1121 ATOM 833 C CB . VAL A 1121 137 . 12.939 -24.791 2.114 1.00 20.00 ? ? ? ? ? . 137 VAL A CB 1121 ATOM 834 C CG1 . VAL A 1121 137 . 12.976 -23.625 3.096 1.00 20.00 ? ? ? ? ? . 137 VAL A CG1 1121 ATOM 835 C CG2 . VAL A 1121 137 . 13.707 -25.978 2.708 1.00 20.00 ? ? ? ? ? . 137 VAL A CG2 1121 ATOM 836 N N . PHE A 1121 138 . 9.823 -23.562 2.363 1.00 20.00 ? ? ? ? ? . 138 PHE A N 1121 ATOM 837 C CA . PHE A 1121 138 . 9.033 -22.333 2.231 1.00 20.00 ? ? ? ? ? . 138 PHE A CA 1121 ATOM 838 C C . PHE A 1121 138 . 9.175 -21.514 3.510 1.00 20.00 ? ? ? ? ? . 138 PHE A C 1121 ATOM 839 O O . PHE A 1121 138 . 8.969 -22.044 4.616 1.00 20.00 ? ? ? ? ? . 138 PHE A O 1121 ATOM 840 C CB . PHE A 1121 138 . 7.549 -22.613 1.971 1.00 20.00 ? ? ? ? ? . 138 PHE A CB 1121 ATOM 841 C CG . PHE A 1121 138 . 6.759 -21.355 1.704 1.00 20.00 ? ? ? ? ? . 138 PHE A CG 1121 ATOM 842 C CD1 . PHE A 1121 138 . 6.317 -20.574 2.764 1.00 20.00 ? ? ? ? ? . 138 PHE A CD1 1121 ATOM 843 C CD2 . PHE A 1121 138 . 6.523 -20.919 0.403 1.00 20.00 ? ? ? ? ? . 138 PHE A CD2 1121 ATOM 844 C CE1 . PHE A 1121 138 . 5.630 -19.394 2.541 1.00 20.00 ? ? ? ? ? . 138 PHE A CE1 1121 ATOM 845 C CE2 . PHE A 1121 138 . 5.828 -19.742 0.174 1.00 20.00 ? ? ? ? ? . 138 PHE A CE2 1121 ATOM 846 C CZ . PHE A 1121 138 . 5.395 -18.972 1.238 1.00 20.00 ? ? ? ? ? . 138 PHE A CZ 1121 ATOM 847 N N . VAL A 1121 139 . 9.498 -20.230 3.362 1.00 20.00 ? ? ? ? ? . 139 VAL A N 1121 ATOM 848 C CA . VAL A 1121 139 . 9.805 -19.379 4.497 1.00 20.00 ? ? ? ? ? . 139 VAL A CA 1121 ATOM 849 C C . VAL A 1121 139 . 8.716 -18.336 4.728 1.00 20.00 ? ? ? ? ? . 139 VAL A C 1121 ATOM 850 O O . VAL A 1121 139 . 8.416 -17.501 3.869 1.00 20.00 ? ? ? ? ? . 139 VAL A O 1121 ATOM 851 C CB . VAL A 1121 139 . 11.156 -18.680 4.337 1.00 20.00 ? ? ? ? ? . 139 VAL A CB 1121 ATOM 852 C CG1 . VAL A 1121 139 . 11.558 -18.062 5.652 1.00 20.00 ? ? ? ? ? . 139 VAL A CG1 1121 ATOM 853 C CG2 . VAL A 1121 139 . 12.215 -19.665 3.876 1.00 20.00 ? ? ? ? ? . 139 VAL A CG2 1121 ATOM 854 N N . SER A 1121 140 . 8.128 -18.441 5.911 1.00 20.00 ? ? ? ? ? . 140 SER A N 1121 ATOM 855 C CA . SER A 1121 140 . 7.102 -17.542 6.409 1.00 20.00 ? ? ? ? ? . 140 SER A CA 1121 ATOM 856 C C . SER A 1121 140 . 7.709 -16.519 7.361 1.00 20.00 ? ? ? ? ? . 140 SER A C 1121 ATOM 857 O O . SER A 1121 140 . 8.620 -16.820 8.145 1.00 20.00 ? ? ? ? ? . 140 SER A O 1121 ATOM 858 C CB . SER A 1121 140 . 6.021 -18.351 7.142 1.00 20.00 ? ? ? ? ? . 140 SER A CB 1121 ATOM 859 O OG . SER A 1121 140 . 5.069 -17.535 7.794 1.00 20.00 ? ? ? ? ? . 140 SER A OG 1121 ATOM 860 N N . ARG A 1121 141 . 7.158 -15.319 7.308 1.00 20.00 ? ? ? ? ? . 141 ARG A N 1121 ATOM 861 C CA . ARG A 1121 141 . 7.485 -14.256 8.257 1.00 20.00 ? ? ? ? ? . 141 ARG A CA 1121 ATOM 862 C C . ARG A 1121 141 . 7.213 -14.699 9.699 1.00 20.00 ? ? ? ? ? . 141 ARG A C 1121 ATOM 863 O O . ARG A 1121 141 . 7.991 -14.394 10.616 1.00 20.00 ? ? ? ? ? . 141 ARG A O 1121 ATOM 864 C CB . ARG A 1121 141 . 6.650 -13.009 7.949 1.00 20.00 ? ? ? ? ? . 141 ARG A CB 1121 ATOM 865 C CG . ARG A 1121 141 . 7.009 -12.262 6.648 1.00 20.00 ? ? ? ? ? . 141 ARG A CG 1121 ATOM 866 C CD . ARG A 1121 141 . 8.242 -11.407 6.804 1.00 20.00 ? ? ? ? ? . 141 ARG A CD 1121 ATOM 867 N NE . ARG A 1121 141 . 8.032 -10.375 7.815 1.00 20.00 ? ? ? ? ? . 141 ARG A NE 1121 ATOM 868 C CZ . ARG A 1121 141 . 7.516 -9.166 7.595 1.00 20.00 ? ? ? ? ? . 141 ARG A CZ 1121 ATOM 869 N NH1 . ARG A 1121 141 . 7.176 -8.759 6.367 1.00 20.00 ? ? ? ? ? 1+ 141 ARG A NH1 1121 ATOM 870 N NH2 . ARG A 1121 141 . 7.359 -8.338 8.615 1.00 20.00 ? ? ? ? ? . 141 ARG A NH2 1121 ATOM 871 N N . GLY A 1121 142 . 6.105 -15.415 9.906 1.00 20.00 ? ? ? ? ? . 142 GLY A N 1121 ATOM 872 C CA . GLY A 1121 142 . 5.735 -15.883 11.230 1.00 20.00 ? ? ? ? ? . 142 GLY A CA 1121 ATOM 873 C C . GLY A 1121 142 . 5.673 -14.823 12.311 1.00 20.00 ? ? ? ? ? . 142 GLY A C 1121 ATOM 874 O O . GLY A 1121 142 . 5.929 -15.137 13.459 1.00 20.00 ? ? ? ? ? . 142 GLY A O 1121 ATOM 875 N N . ASP A 1121 143 . 5.290 -13.593 11.966 1.00 20.00 ? ? ? ? ? . 143 ASP A N 1121 ATOM 876 C CA . ASP A 1121 143 . 5.378 -12.468 12.914 1.00 20.00 ? ? ? ? ? . 143 ASP A CA 1121 ATOM 877 C C . ASP A 1121 143 . 4.104 -11.631 13.063 1.00 20.00 ? ? ? ? ? . 143 ASP A C 1121 ATOM 878 O O . ASP A 1121 143 . 4.109 -10.571 13.687 1.00 20.00 ? ? ? ? ? . 143 ASP A O 1121 ATOM 879 C CB . ASP A 1121 143 . 6.531 -11.550 12.518 1.00 20.00 ? ? ? ? ? . 143 ASP A CB 1121 ATOM 880 C CG . ASP A 1121 143 . 6.276 -10.805 11.226 1.00 20.00 ? ? ? ? ? . 143 ASP A CG 1121 ATOM 881 O OD1 . ASP A 1121 143 . 5.351 -11.168 10.463 1.00 20.00 ? ? ? ? ? . 143 ASP A OD1 1121 ATOM 882 O OD2 . ASP A 1121 143 . 7.053 -9.875 10.950 1.00 20.00 ? ? ? ? ? 1- 143 ASP A OD2 1121 ATOM 883 N N . ASN A 1121 144 . 3.017 -12.142 12.507 1.00 20.00 ? ? ? ? ? . 144 ASN A N 1121 ATOM 884 C CA . ASN A 1121 144 . 1.697 -11.498 12.533 1.00 20.00 ? ? ? ? ? . 144 ASN A CA 1121 ATOM 885 C C . ASN A 1121 144 . 1.635 -10.131 11.839 1.00 20.00 ? ? ? ? ? . 144 ASN A C 1121 ATOM 886 O O . ASN A 1121 144 . 0.712 -9.349 12.068 1.00 20.00 ? ? ? ? ? . 144 ASN A O 1121 ATOM 887 C CB . ASN A 1121 144 . 1.173 -11.386 13.964 1.00 20.00 ? ? ? ? ? . 144 ASN A CB 1121 ATOM 888 C CG . ASN A 1121 144 . 1.193 -12.708 14.694 1.00 20.00 ? ? ? ? ? . 144 ASN A CG 1121 ATOM 889 N ND2 . ASN A 1121 144 . 0.542 -13.713 14.119 1.00 20.00 ? ? ? ? ? . 144 ASN A ND2 1121 ATOM 890 O OD1 . ASN A 1121 144 . 1.794 -12.830 15.763 1.00 20.00 ? ? ? ? ? . 144 ASN A OD1 1121 ATOM 891 N N . SER A 1121 145 . 2.612 -9.864 10.978 1.00 20.00 ? ? ? ? ? . 145 SER A N 1121 ATOM 892 C CA . SER A 1121 145 . 2.591 -8.679 10.142 1.00 20.00 ? ? ? ? ? . 145 SER A CA 1121 ATOM 893 C C . SER A 1121 145 . 1.503 -8.768 9.080 1.00 20.00 ? ? ? ? ? . 145 SER A C 1121 ATOM 894 O O . SER A 1121 145 . 0.962 -9.837 8.828 1.00 20.00 ? ? ? ? ? . 145 SER A O 1121 ATOM 895 C CB . SER A 1121 145 . 3.945 -8.518 9.451 1.00 20.00 ? ? ? ? ? . 145 SER A CB 1121 ATOM 896 O OG . SER A 1121 145 . 4.228 -9.627 8.615 1.00 20.00 ? ? ? ? ? . 145 SER A OG 1121 ATOM 897 N N . GLY A 1121 146 . 1.218 -7.649 8.422 1.00 20.00 ? ? ? ? ? . 146 GLY A N 1121 ATOM 898 C CA . GLY A 1121 146 . 0.313 -7.651 7.291 1.00 20.00 ? ? ? ? ? . 146 GLY A CA 1121 ATOM 899 C C . GLY A 1121 146 . 0.772 -8.620 6.221 1.00 20.00 ? ? ? ? ? . 146 GLY A C 1121 ATOM 900 O O . GLY A 1121 146 . -0.038 -9.312 5.615 1.00 20.00 ? ? ? ? ? . 146 GLY A O 1121 ATOM 901 N N . THR A 1121 147 . 2.078 -8.685 5.997 1.00 20.00 ? ? ? ? ? . 147 THR A N 1121 ATOM 902 C CA . THR A 1121 147 . 2.626 -9.611 5.011 1.00 20.00 ? ? ? ? ? . 147 THR A CA 1121 ATOM 903 C C . THR A 1121 147 . 2.372 -11.055 5.438 1.00 20.00 ? ? ? ? ? . 147 THR A C 1121 ATOM 904 O O . THR A 1121 147 . 1.964 -11.897 4.627 1.00 20.00 ? ? ? ? ? . 147 THR A O 1121 ATOM 905 C CB . THR A 1121 147 . 4.133 -9.347 4.805 1.00 20.00 ? ? ? ? ? . 147 THR A CB 1121 ATOM 906 C CG2 . THR A 1121 147 . 4.753 -10.336 3.827 1.00 20.00 ? ? ? ? ? . 147 THR A CG2 1121 ATOM 907 O OG1 . THR A 1121 147 . 4.297 -8.028 4.281 1.00 20.00 ? ? ? ? ? . 147 THR A OG1 1121 ATOM 908 N N . HIS A 1121 148 . 2.592 -11.336 6.718 1.00 20.00 ? ? ? ? ? . 148 HIS A N 1121 ATOM 909 C CA . HIS A 1121 148 . 2.357 -12.662 7.259 1.00 20.00 ? ? ? ? ? . 148 HIS A CA 1121 ATOM 910 C C . HIS A 1121 148 . 0.926 -13.071 7.062 1.00 20.00 ? ? ? ? ? . 148 HIS A C 1121 ATOM 911 O O . HIS A 1121 148 . 0.641 -14.194 6.593 1.00 20.00 ? ? ? ? ? . 148 HIS A O 1121 ATOM 912 C CB . HIS A 1121 148 . 2.708 -12.699 8.740 1.00 20.00 ? ? ? ? ? . 148 HIS A CB 1121 ATOM 913 C CG . HIS A 1121 148 . 2.629 -14.078 9.350 1.00 20.00 ? ? ? ? ? . 148 HIS A CG 1121 ATOM 914 C CD2 . HIS A 1121 148 . 2.741 -15.342 8.772 1.00 20.00 ? ? ? ? ? . 148 HIS A CD2 1121 ATOM 915 N ND1 . HIS A 1121 148 . 2.416 -14.278 10.663 1.00 20.00 ? ? ? ? ? . 148 HIS A ND1 1121 ATOM 916 C CE1 . HIS A 1121 148 . 2.394 -15.600 10.917 1.00 20.00 ? ? ? ? ? . 148 HIS A CE1 1121 ATOM 917 N NE2 . HIS A 1121 148 . 2.593 -16.250 9.759 1.00 20.00 ? ? ? ? ? . 148 HIS A NE2 1121 ATOM 918 N N . LYS A 1121 149 . 0.005 -12.178 7.412 1.00 20.00 ? ? ? ? ? . 149 LYS A N 1121 ATOM 919 C CA . LYS A 1121 149 . -1.417 -12.444 7.259 1.00 20.00 ? ? ? ? ? . 149 LYS A CA 1121 ATOM 920 C C . LYS A 1121 149 . -1.787 -12.738 5.800 1.00 20.00 ? ? ? ? ? . 149 LYS A C 1121 ATOM 921 O O . LYS A 1121 149 . -2.573 -13.638 5.507 1.00 20.00 ? ? ? ? ? . 149 LYS A O 1121 ATOM 922 C CB . LYS A 1121 149 . -2.226 -11.268 7.817 1.00 20.00 ? ? ? ? ? . 149 LYS A CB 1121 ATOM 923 C CG . LYS A 1121 149 . -2.166 -11.186 9.337 1.00 20.00 ? ? ? ? ? . 149 LYS A CG 1121 ATOM 924 C CD . LYS A 1121 149 . -2.779 -9.897 9.861 1.00 20.00 ? ? ? ? ? . 149 LYS A CD 1121 ATOM 925 C CE . LYS A 1121 149 . -2.604 -9.776 11.359 1.00 20.00 ? ? ? ? ? . 149 LYS A CE 1121 ATOM 926 N NZ . LYS A 1121 149 . -2.957 -8.418 11.834 1.00 20.00 ? ? ? ? ? 1+ 149 LYS A NZ 1121 ATOM 927 N N . MET A 1121 150 . -1.207 -11.981 4.882 1.00 20.00 ? ? ? ? ? . 150 MET A N 1121 ATOM 928 C CA . MET A 1121 150 . -1.424 -12.208 3.466 1.00 20.00 ? ? ? ? ? . 150 MET A CA 1121 ATOM 929 C C . MET A 1121 150 . -0.949 -13.613 3.070 1.00 20.00 ? ? ? ? ? . 150 MET A C 1121 ATOM 930 O O . MET A 1121 150 . -1.667 -14.379 2.410 1.00 20.00 ? ? ? ? ? . 150 MET A O 1121 ATOM 931 C CB . MET A 1121 150 . -0.684 -11.130 2.687 1.00 20.00 ? ? ? ? ? . 150 MET A CB 1121 ATOM 932 C CG . MET A 1121 150 . -0.613 -11.355 1.234 1.00 20.00 ? ? ? ? ? . 150 MET A CG 1121 ATOM 933 S SD . MET A 1121 150 . -2.213 -11.445 0.432 1.00 20.00 ? ? ? ? ? . 150 MET A SD 1121 ATOM 934 C CE . MET A 1121 150 . -1.491 -11.798 -1.149 1.00 20.00 ? ? ? ? ? . 150 MET A CE 1121 ATOM 935 N N . GLU A 1121 151 . 0.249 -13.978 3.519 1.00 20.00 ? ? ? ? ? . 151 GLU A N 1121 ATOM 936 C CA . GLU A 1121 151 . 0.804 -15.286 3.185 1.00 20.00 ? ? ? ? ? . 151 GLU A CA 1121 ATOM 937 C C . GLU A 1121 151 . -0.082 -16.420 3.733 1.00 20.00 ? ? ? ? ? . 151 GLU A C 1121 ATOM 938 O O . GLU A 1121 151 . -0.395 -17.393 3.029 1.00 20.00 ? ? ? ? ? . 151 GLU A O 1121 ATOM 939 C CB . GLU A 1121 151 . 2.235 -15.397 3.716 1.00 20.00 ? ? ? ? ? . 151 GLU A CB 1121 ATOM 940 C CG . GLU A 1121 151 . 2.913 -16.762 3.505 1.00 20.00 ? ? ? ? ? . 151 GLU A CG 1121 ATOM 941 C CD . GLU A 1121 151 . 3.133 -17.520 4.801 1.00 20.00 ? ? ? ? ? . 151 GLU A CD 1121 ATOM 942 O OE1 . GLU A 1121 151 . 3.381 -16.854 5.839 1.00 20.00 ? ? ? ? ? . 151 GLU A OE1 1121 ATOM 943 O OE2 . GLU A 1121 151 . 3.041 -18.777 4.771 1.00 20.00 ? ? ? ? ? 1- 151 GLU A OE2 1121 ATOM 944 N N . LYS A 1121 152 . -0.522 -16.271 4.977 1.00 20.00 ? ? ? ? ? . 152 LYS A N 1121 ATOM 945 C CA . LYS A 1121 152 . -1.383 -17.286 5.568 1.00 20.00 ? ? ? ? ? . 152 LYS A CA 1121 ATOM 946 C C . LYS A 1121 152 . -2.674 -17.412 4.771 1.00 20.00 ? ? ? ? ? . 152 LYS A C 1121 ATOM 947 O O . LYS A 1121 152 . -3.184 -18.508 4.569 1.00 20.00 ? ? ? ? ? . 152 LYS A O 1121 ATOM 948 C CB . LYS A 1121 152 . -1.686 -16.956 7.027 1.00 20.00 ? ? ? ? ? . 152 LYS A CB 1121 ATOM 949 C CG . LYS A 1121 152 . -0.491 -17.208 7.931 1.00 20.00 ? ? ? ? ? . 152 LYS A CG 1121 ATOM 950 C CD . LYS A 1121 152 . -0.836 -17.103 9.411 1.00 20.00 ? ? ? ? ? . 152 LYS A CD 1121 ATOM 951 C CE . LYS A 1121 152 . -1.043 -15.668 9.846 1.00 20.00 ? ? ? ? ? . 152 LYS A CE 1121 ATOM 952 N NZ . LYS A 1121 152 . -1.372 -15.590 11.298 1.00 20.00 ? ? ? ? ? 1+ 152 LYS A NZ 1121 ATOM 953 N N . SER A 1121 153 . -3.184 -16.288 4.280 1.00 20.00 ? ? ? ? ? . 153 SER A N 1121 ATOM 954 C CA . SER A 1121 153 . -4.418 -16.304 3.501 1.00 20.00 ? ? ? ? ? . 153 SER A CA 1121 ATOM 955 C C . SER A 1121 153 . -4.261 -17.070 2.179 1.00 20.00 ? ? ? ? ? . 153 SER A C 1121 ATOM 956 O O . SER A 1121 153 . -5.222 -17.640 1.685 1.00 20.00 ? ? ? ? ? . 153 SER A O 1121 ATOM 957 C CB . SER A 1121 153 . -4.926 -14.874 3.251 1.00 20.00 ? ? ? ? ? . 153 SER A CB 1121 ATOM 958 O OG . SER A 1121 153 . -4.313 -14.244 2.133 1.00 20.00 ? ? ? ? ? . 153 SER A OG 1121 ATOM 959 N N . LEU A 1121 154 . -3.062 -17.073 1.604 1.00 20.00 ? ? ? ? ? . 154 LEU A N 1121 ATOM 960 C CA . LEU A 1121 154 . -2.827 -17.804 0.360 1.00 20.00 ? ? ? ? ? . 154 LEU A CA 1121 ATOM 961 C C . LEU A 1121 154 . -2.960 -19.310 0.559 1.00 20.00 ? ? ? ? ? . 154 LEU A C 1121 ATOM 962 O O . LEU A 1121 154 . -3.503 -20.027 -0.302 1.00 20.00 ? ? ? ? ? . 154 LEU A O 1121 ATOM 963 C CB . LEU A 1121 154 . -1.437 -17.506 -0.200 1.00 20.00 ? ? ? ? ? . 154 LEU A CB 1121 ATOM 964 C CG . LEU A 1121 154 . -1.118 -16.040 -0.517 1.00 20.00 ? ? ? ? ? . 154 LEU A CG 1121 ATOM 965 C CD1 . LEU A 1121 154 . 0.253 -15.952 -1.132 1.00 20.00 ? ? ? ? ? . 154 LEU A CD1 1121 ATOM 966 C CD2 . LEU A 1121 154 . -2.155 -15.381 -1.436 1.00 20.00 ? ? ? ? ? . 154 LEU A CD2 1121 ATOM 967 N N . TRP A 1121 155 . -2.455 -19.790 1.690 1.00 20.00 ? ? ? ? ? . 155 TRP A N 1121 ATOM 968 C CA . TRP A 1121 155 . -2.488 -21.202 1.999 1.00 20.00 ? ? ? ? ? . 155 TRP A CA 1121 ATOM 969 C C . TRP A 1121 155 . -3.900 -21.685 2.130 1.00 20.00 ? ? ? ? ? . 155 TRP A C 1121 ATOM 970 O O . TRP A 1121 155 . -4.202 -22.859 1.824 1.00 20.00 ? ? ? ? ? . 155 TRP A O 1121 ATOM 971 C CB . TRP A 1121 155 . -1.725 -21.479 3.289 1.00 20.00 ? ? ? ? ? . 155 TRP A CB 1121 ATOM 972 C CG . TRP A 1121 155 . -0.225 -21.434 3.122 1.00 20.00 ? ? ? ? ? . 155 TRP A CG 1121 ATOM 973 C CD1 . TRP A 1121 155 . 0.658 -20.486 3.632 1.00 20.00 ? ? ? ? ? . 155 TRP A CD1 1121 ATOM 974 C CD2 . TRP A 1121 155 . 0.622 -22.382 2.384 1.00 20.00 ? ? ? ? ? . 155 TRP A CD2 1121 ATOM 975 C CE2 . TRP A 1121 155 . 1.997 -21.899 2.523 1.00 20.00 ? ? ? ? ? . 155 TRP A CE2 1121 ATOM 976 C CE3 . TRP A 1121 155 . 0.386 -23.536 1.652 1.00 20.00 ? ? ? ? ? . 155 TRP A CE3 1121 ATOM 977 N NE1 . TRP A 1121 155 . 1.950 -20.775 3.271 1.00 20.00 ? ? ? ? ? . 155 TRP A NE1 1121 ATOM 978 C CZ2 . TRP A 1121 155 . 3.068 -22.558 1.947 1.00 20.00 ? ? ? ? ? . 155 TRP A CZ2 1121 ATOM 979 C CZ3 . TRP A 1121 155 . 1.476 -24.192 1.075 1.00 20.00 ? ? ? ? ? . 155 TRP A CZ3 1121 ATOM 980 C CH2 . TRP A 1121 155 . 2.783 -23.713 1.221 1.00 20.00 ? ? ? ? ? . 155 TRP A CH2 1121 ATOM 981 N N . LYS A 1121 156 . -4.790 -20.807 2.583 1.00 20.00 ? ? ? ? ? . 156 LYS A N 1121 ATOM 982 C CA . LYS A 1121 156 . -6.174 -21.194 2.784 1.00 20.00 ? ? ? ? ? . 156 LYS A CA 1121 ATOM 983 C C . LYS A 1121 156 . -6.896 -21.491 1.468 1.00 20.00 ? ? ? ? ? . 156 LYS A C 1121 ATOM 984 O O . LYS A 1121 156 . -7.989 -22.057 1.483 1.00 20.00 ? ? ? ? ? . 156 LYS A O 1121 ATOM 985 C CB . LYS A 1121 156 . -6.912 -20.120 3.578 1.00 20.00 ? ? ? ? ? . 156 LYS A CB 1121 ATOM 986 C CG . LYS A 1121 156 . -6.505 -20.092 5.036 1.00 20.00 ? ? ? ? ? . 156 LYS A CG 1121 ATOM 987 C CD . LYS A 1121 156 . -7.322 -19.084 5.816 1.00 20.00 ? ? ? ? ? . 156 LYS A CD 1121 ATOM 988 C CE . LYS A 1121 156 . -6.886 -19.024 7.272 1.00 20.00 ? ? ? ? ? . 156 LYS A CE 1121 ATOM 989 N NZ . LYS A 1121 156 . -7.496 -17.857 7.980 1.00 20.00 ? ? ? ? ? 1+ 156 LYS A NZ 1121 ATOM 990 N N . GLN A 1121 157 . -6.274 -21.150 0.342 1.00 20.00 ? ? ? ? ? . 157 GLN A N 1121 ATOM 991 C CA . GLN A 1121 157 . -6.883 -21.352 -0.969 1.00 20.00 ? ? ? ? ? . 157 GLN A CA 1121 ATOM 992 C C . GLN A 1121 157 . -6.384 -22.595 -1.715 1.00 20.00 ? ? ? ? ? . 157 GLN A C 1121 ATOM 993 O O . GLN A 1121 157 . -6.844 -22.866 -2.827 1.00 20.00 ? ? ? ? ? . 157 GLN A O 1121 ATOM 994 C CB . GLN A 1121 157 . -6.671 -20.112 -1.843 1.00 20.00 ? ? ? ? ? . 157 GLN A CB 1121 ATOM 995 C CG . GLN A 1121 157 . -7.100 -18.809 -1.184 1.00 20.00 ? ? ? ? ? . 157 GLN A CG 1121 ATOM 996 C CD . GLN A 1121 157 . -8.518 -18.864 -0.629 1.00 20.00 ? ? ? ? ? . 157 GLN A CD 1121 ATOM 997 N NE2 . GLN A 1121 157 . -8.717 -18.283 0.553 1.00 20.00 ? ? ? ? ? . 157 GLN A NE2 1121 ATOM 998 O OE1 . GLN A 1121 157 . -9.421 -19.426 -1.253 1.00 20.00 ? ? ? ? ? . 157 GLN A OE1 1121 ATOM 999 N N . ILE A 1121 158 . -5.448 -23.341 -1.132 1.00 20.00 ? ? ? ? ? . 158 ILE A N 1121 ATOM 1000 C CA . ILE A 1121 158 . -5.043 -24.616 -1.723 1.00 20.00 ? ? ? ? ? . 158 ILE A CA 1121 ATOM 1001 C C . ILE A 1121 158 . -5.985 -25.697 -1.204 1.00 20.00 ? ? ? ? ? . 158 ILE A C 1121 ATOM 1002 O O . ILE A 1121 158 . -6.648 -25.506 -0.187 1.00 20.00 ? ? ? ? ? . 158 ILE A O 1121 ATOM 1003 C CB . ILE A 1121 158 . -3.551 -24.985 -1.436 1.00 20.00 ? ? ? ? ? . 158 ILE A CB 1121 ATOM 1004 C CG1 . ILE A 1121 158 . -3.344 -25.447 0.015 1.00 20.00 ? ? ? ? ? . 158 ILE A CG1 1121 ATOM 1005 C CG2 . ILE A 1121 158 . -2.644 -23.810 -1.779 1.00 20.00 ? ? ? ? ? . 158 ILE A CG2 1121 ATOM 1006 C CD1 . ILE A 1121 158 . -1.991 -26.084 0.276 1.00 20.00 ? ? ? ? ? . 158 ILE A CD1 1121 ATOM 1007 N N . GLU A 1121 159 . -6.046 -26.825 -1.896 1.00 20.00 ? ? ? ? ? . 159 GLU A N 1121 ATOM 1008 C CA . GLU A 1121 159 . -6.941 -27.903 -1.488 1.00 20.00 ? ? ? ? ? . 159 GLU A CA 1121 ATOM 1009 C C . GLU A 1121 159 . -6.339 -28.743 -0.369 1.00 20.00 ? ? ? ? ? . 159 GLU A C 1121 ATOM 1010 O O . GLU A 1121 159 . -7.070 -29.366 0.400 1.00 20.00 ? ? ? ? ? . 159 GLU A O 1121 ATOM 1011 C CB . GLU A 1121 159 . -7.300 -28.799 -2.675 1.00 20.00 ? ? ? ? ? . 159 GLU A CB 1121 ATOM 1012 C CG . GLU A 1121 159 . -8.323 -28.191 -3.616 1.00 20.00 ? ? ? ? ? . 159 GLU A CG 1121 ATOM 1013 C CD . GLU A 1121 159 . -7.817 -28.113 -5.038 1.00 20.00 ? ? ? ? ? . 159 GLU A CD 1121 ATOM 1014 O OE1 . GLU A 1121 159 . -7.515 -26.990 -5.504 1.00 20.00 ? ? ? ? ? . 159 GLU A OE1 1121 ATOM 1015 O OE2 . GLU A 1121 159 . -7.721 -29.179 -5.688 1.00 20.00 ? ? ? ? ? 1- 159 GLU A OE2 1121 ATOM 1016 N N . GLY A 1121 160 . -5.012 -28.755 -0.281 1.00 20.00 ? ? ? ? ? . 160 GLY A N 1121 ATOM 1017 C CA . GLY A 1121 160 . -4.320 -29.541 0.727 1.00 20.00 ? ? ? ? ? . 160 GLY A CA 1121 ATOM 1018 C C . GLY A 1121 160 . -4.395 -28.894 2.096 1.00 20.00 ? ? ? ? ? . 160 GLY A C 1121 ATOM 1019 O O . GLY A 1121 160 . -5.024 -27.844 2.257 1.00 20.00 ? ? ? ? ? . 160 GLY A O 1121 ATOM 1020 N N . PRO A 1121 161 . -3.738 -29.506 3.093 1.00 20.00 ? ? ? ? ? . 161 PRO A N 1121 ATOM 1021 C CA . PRO A 1121 161 . -3.821 -29.027 4.477 1.00 20.00 ? ? ? ? ? . 161 PRO A CA 1121 ATOM 1022 C C . PRO A 1121 161 . -2.916 -27.839 4.779 1.00 20.00 ? ? ? ? ? . 161 PRO A C 1121 ATOM 1023 O O . PRO A 1121 161 . -1.981 -27.554 4.027 1.00 20.00 ? ? ? ? ? . 161 PRO A O 1121 ATOM 1024 C CB . PRO A 1121 161 . -3.357 -30.238 5.284 1.00 20.00 ? ? ? ? ? . 161 PRO A CB 1121 ATOM 1025 C CG . PRO A 1121 161 . -2.429 -30.954 4.370 1.00 20.00 ? ? ? ? ? . 161 PRO A CG 1121 ATOM 1026 C CD . PRO A 1121 161 . -2.991 -30.774 2.993 1.00 20.00 ? ? ? ? ? . 161 PRO A CD 1121 ATOM 1027 N N . SER A 1121 162 . -3.203 -27.151 5.879 1.00 20.00 ? ? ? ? ? . 162 SER A N 1121 ATOM 1028 C CA . SER A 1121 162 . -2.328 -26.084 6.361 1.00 20.00 ? ? ? ? ? . 162 SER A CA 1121 ATOM 1029 C C . SER A 1121 162 . -0.910 -26.620 6.502 1.00 20.00 ? ? ? ? ? . 162 SER A C 1121 ATOM 1030 O O . SER A 1121 162 . -0.726 -27.730 6.996 1.00 20.00 ? ? ? ? ? . 162 SER A O 1121 ATOM 1031 C CB . SER A 1121 162 . -2.791 -25.599 7.732 1.00 20.00 ? ? ? ? ? . 162 SER A CB 1121 ATOM 1032 O OG . SER A 1121 162 . -1.855 -24.670 8.275 1.00 20.00 ? ? ? ? ? . 162 SER A OG 1121 ATOM 1033 N N . PRO A 1121 163 . 0.102 -25.823 6.123 1.00 20.00 ? ? ? ? ? . 163 PRO A N 1121 ATOM 1034 C CA . PRO A 1121 163 . 1.488 -26.304 6.177 1.00 20.00 ? ? ? ? ? . 163 PRO A CA 1121 ATOM 1035 C C . PRO A 1121 163 . 2.185 -26.041 7.498 1.00 20.00 ? ? ? ? ? . 163 PRO A C 1121 ATOM 1036 O O . PRO A 1121 163 . 3.382 -26.323 7.622 1.00 20.00 ? ? ? ? ? . 163 PRO A O 1121 ATOM 1037 C CB . PRO A 1121 163 . 2.172 -25.441 5.124 1.00 20.00 ? ? ? ? ? . 163 PRO A CB 1121 ATOM 1038 C CG . PRO A 1121 163 . 1.498 -24.167 5.251 1.00 20.00 ? ? ? ? ? . 163 PRO A CG 1121 ATOM 1039 C CD . PRO A 1121 163 . 0.033 -24.522 5.437 1.00 20.00 ? ? ? ? ? . 163 PRO A CD 1121 ATOM 1040 N N . GLU A 1121 164 . 1.454 -25.477 8.452 1.00 20.00 ? ? ? ? ? . 164 GLU A N 1121 ATOM 1041 C CA . GLU A 1121 164 . 2.050 -24.922 9.654 1.00 20.00 ? ? ? ? ? . 164 GLU A CA 1121 ATOM 1042 C C . GLU A 1121 164 . 2.889 -25.933 10.427 1.00 20.00 ? ? ? ? ? . 164 GLU A C 1121 ATOM 1043 O O . GLU A 1121 164 . 3.890 -25.553 11.017 1.00 20.00 ? ? ? ? ? . 164 GLU A O 1121 ATOM 1044 C CB . GLU A 1121 164 . 0.960 -24.310 10.554 1.00 20.00 ? ? ? ? ? . 164 GLU A CB 1121 ATOM 1045 C CG . GLU A 1121 164 . 0.213 -23.101 9.908 1.00 20.00 ? ? ? ? ? . 164 GLU A CG 1121 ATOM 1046 C CD . GLU A 1121 164 . 0.727 -21.721 10.364 1.00 20.00 ? ? ? ? ? . 164 GLU A CD 1121 ATOM 1047 O OE1 . GLU A 1121 164 . 1.693 -21.662 11.158 1.00 20.00 ? ? ? ? ? . 164 GLU A OE1 1121 ATOM 1048 O OE2 . GLU A 1121 164 . 0.150 -20.688 9.927 1.00 20.00 ? ? ? ? ? 1- 164 GLU A OE2 1121 ATOM 1049 N N . LYS A 1121 165 . 2.499 -27.212 10.391 1.00 20.00 ? ? ? ? ? . 165 LYS A N 1121 ATOM 1050 C CA . LYS A 1121 165 . 3.191 -28.254 11.147 1.00 20.00 ? ? ? ? ? . 165 LYS A CA 1121 ATOM 1051 C C . LYS A 1121 165 . 4.270 -29.016 10.374 1.00 20.00 ? ? ? ? ? . 165 LYS A C 1121 ATOM 1052 O O . LYS A 1121 165 . 4.916 -29.900 10.928 1.00 20.00 ? ? ? ? ? . 165 LYS A O 1121 ATOM 1053 C CB . LYS A 1121 165 . 2.180 -29.251 11.715 1.00 20.00 ? ? ? ? ? . 165 LYS A CB 1121 ATOM 1054 C CG . LYS A 1121 165 . 1.236 -28.633 12.720 1.00 20.00 ? ? ? ? ? . 165 LYS A CG 1121 ATOM 1055 C CD . LYS A 1121 165 . 0.521 -29.684 13.530 1.00 20.00 ? ? ? ? ? . 165 LYS A CD 1121 ATOM 1056 C CE . LYS A 1121 165 . -0.305 -29.044 14.626 1.00 20.00 ? ? ? ? ? . 165 LYS A CE 1121 ATOM 1057 N NZ . LYS A 1121 165 . -0.971 -30.063 15.470 1.00 20.00 ? ? ? ? ? 1+ 165 LYS A NZ 1121 ATOM 1058 N N . GLU A 1121 166 . 4.500 -28.655 9.115 1.00 20.00 ? ? ? ? ? . 166 GLU A N 1121 ATOM 1059 C CA . GLU A 1121 166 . 5.466 -29.381 8.279 1.00 20.00 ? ? ? ? ? . 166 GLU A CA 1121 ATOM 1060 C C . GLU A 1121 166 . 6.884 -28.839 8.470 1.00 20.00 ? ? ? ? ? . 166 GLU A C 1121 ATOM 1061 O O . GLU A 1121 166 . 7.105 -27.626 8.588 1.00 20.00 ? ? ? ? ? . 166 GLU A O 1121 ATOM 1062 C CB . GLU A 1121 166 . 5.075 -29.323 6.788 1.00 20.00 ? ? ? ? ? . 166 GLU A CB 1121 ATOM 1063 C CG . GLU A 1121 166 . 3.623 -29.714 6.467 1.00 20.00 ? ? ? ? ? . 166 GLU A CG 1121 ATOM 1064 C CD . GLU A 1121 166 . 3.194 -31.056 7.077 1.00 20.00 ? ? ? ? ? . 166 GLU A CD 1121 ATOM 1065 O OE1 . GLU A 1121 166 . 3.739 -32.094 6.665 1.00 20.00 ? ? ? ? ? . 166 GLU A OE1 1121 ATOM 1066 O OE2 . GLU A 1121 166 . 2.315 -31.062 7.982 1.00 20.00 ? ? ? ? ? 1- 166 GLU A OE2 1121 ATOM 1067 N N . ALA A 1121 167 . 7.845 -29.756 8.515 1.00 20.00 ? ? ? ? ? . 167 ALA A N 1121 ATOM 1068 C CA . ALA A 1121 167 . 9.233 -29.388 8.790 1.00 20.00 ? ? ? ? ? . 167 ALA A CA 1121 ATOM 1069 C C . ALA A 1121 167 . 9.840 -28.491 7.710 1.00 20.00 ? ? ? ? ? . 167 ALA A C 1121 ATOM 1070 O O . ALA A 1121 167 . 10.759 -27.710 8.009 1.00 20.00 ? ? ? ? ? . 167 ALA A O 1121 ATOM 1071 C CB . ALA A 1121 167 . 10.071 -30.623 8.984 1.00 20.00 ? ? ? ? ? . 167 ALA A CB 1121 ATOM 1072 N N . TRP A 1121 168 . 9.303 -28.537 6.494 1.00 20.00 ? ? ? ? ? . 168 TRP A N 1121 ATOM 1073 C CA . TRP A 1121 168 . 9.805 -27.709 5.402 1.00 20.00 ? ? ? ? ? . 168 TRP A CA 1121 ATOM 1074 C C . TRP A 1121 168 . 9.315 -26.282 5.456 1.00 20.00 ? ? ? ? ? . 168 TRP A C 1121 ATOM 1075 O O . TRP A 1121 168 . 9.845 -25.399 4.748 1.00 20.00 ? ? ? ? ? . 168 TRP A O 1121 ATOM 1076 C CB . TRP A 1121 168 . 9.424 -28.327 4.062 1.00 20.00 ? ? ? ? ? . 168 TRP A CB 1121 ATOM 1077 C CG . TRP A 1121 168 . 7.948 -28.618 3.927 1.00 20.00 ? ? ? ? ? . 168 TRP A CG 1121 ATOM 1078 C CD1 . TRP A 1121 168 . 7.294 -29.821 4.172 1.00 20.00 ? ? ? ? ? . 168 TRP A CD1 1121 ATOM 1079 C CD2 . TRP A 1121 168 . 6.890 -27.689 3.507 1.00 20.00 ? ? ? ? ? . 168 TRP A CD2 1121 ATOM 1080 C CE2 . TRP A 1121 168 . 5.639 -28.450 3.540 1.00 20.00 ? ? ? ? ? . 168 TRP A CE2 1121 ATOM 1081 C CE3 . TRP A 1121 168 . 6.854 -26.356 3.124 1.00 20.00 ? ? ? ? ? . 168 TRP A CE3 1121 ATOM 1082 N NE1 . TRP A 1121 168 . 5.947 -29.703 3.941 1.00 20.00 ? ? ? ? ? . 168 TRP A NE1 1121 ATOM 1083 C CZ2 . TRP A 1121 168 . 4.425 -27.881 3.200 1.00 20.00 ? ? ? ? ? . 168 TRP A CZ2 1121 ATOM 1084 C CZ3 . TRP A 1121 168 . 5.622 -25.793 2.784 1.00 20.00 ? ? ? ? ? . 168 TRP A CZ3 1121 ATOM 1085 C CH2 . TRP A 1121 168 . 4.439 -26.540 2.821 1.00 20.00 ? ? ? ? ? . 168 TRP A CH2 1121 ATOM 1086 N N . TYR A 1121 169 . 8.306 -26.032 6.285 1.00 20.00 ? ? ? ? ? . 169 TYR A N 1121 ATOM 1087 C CA . TYR A 1121 169 . 7.717 -24.711 6.443 1.00 20.00 ? ? ? ? ? . 169 TYR A CA 1121 ATOM 1088 C C . TYR A 1121 169 . 8.415 -24.008 7.597 1.00 20.00 ? ? ? ? ? . 169 TYR A C 1121 ATOM 1089 O O . TYR A 1121 169 . 8.312 -24.447 8.760 1.00 20.00 ? ? ? ? ? . 169 TYR A O 1121 ATOM 1090 C CB . TYR A 1121 169 . 6.239 -24.860 6.745 1.00 20.00 ? ? ? ? ? . 169 TYR A CB 1121 ATOM 1091 C CG . TYR A 1121 169 . 5.412 -23.564 6.801 1.00 20.00 ? ? ? ? ? . 169 TYR A CG 1121 ATOM 1092 C CD1 . TYR A 1121 169 . 5.055 -22.893 5.655 1.00 20.00 ? ? ? ? ? . 169 TYR A CD1 1121 ATOM 1093 C CD2 . TYR A 1121 169 . 4.944 -23.077 8.011 1.00 20.00 ? ? ? ? ? . 169 TYR A CD2 1121 ATOM 1094 C CE1 . TYR A 1121 169 . 4.277 -21.759 5.700 1.00 20.00 ? ? ? ? ? . 169 TYR A CE1 1121 ATOM 1095 C CE2 . TYR A 1121 169 . 4.175 -21.939 8.069 1.00 20.00 ? ? ? ? ? . 169 TYR A CE2 1121 ATOM 1096 C CZ . TYR A 1121 169 . 3.832 -21.286 6.904 1.00 20.00 ? ? ? ? ? . 169 TYR A CZ 1121 ATOM 1097 O OH . TYR A 1121 169 . 3.043 -20.162 6.986 1.00 20.00 ? ? ? ? ? . 169 TYR A OH 1121 ATOM 1098 N N . VAL A 1121 170 . 9.168 -22.967 7.258 1.00 20.00 ? ? ? ? ? . 170 VAL A N 1121 ATOM 1099 C CA . VAL A 1121 170 . 10.020 -22.240 8.199 1.00 20.00 ? ? ? ? ? . 170 VAL A CA 1121 ATOM 1100 C C . VAL A 1121 170 . 9.332 -20.933 8.596 1.00 20.00 ? ? ? ? ? . 170 VAL A C 1121 ATOM 1101 O O . VAL A 1121 170 . 8.854 -20.200 7.743 1.00 20.00 ? ? ? ? ? . 170 VAL A O 1121 ATOM 1102 C CB . VAL A 1121 170 . 11.368 -21.912 7.524 1.00 20.00 ? ? ? ? ? . 170 VAL A CB 1121 ATOM 1103 C CG1 . VAL A 1121 170 . 12.251 -21.061 8.431 1.00 20.00 ? ? ? ? ? . 170 VAL A CG1 1121 ATOM 1104 C CG2 . VAL A 1121 170 . 12.077 -23.196 7.128 1.00 20.00 ? ? ? ? ? . 170 VAL A CG2 1121 ATOM 1105 N N . GLN A 1121 171 . 9.274 -20.650 9.889 1.00 20.00 ? ? ? ? ? . 171 GLN A N 1121 ATOM 1106 C CA . GLN A 1121 171 . 8.714 -19.390 10.393 1.00 20.00 ? ? ? ? ? . 171 GLN A CA 1121 ATOM 1107 C C . GLN A 1121 171 . 9.814 -18.587 11.076 1.00 20.00 ? ? ? ? ? . 171 GLN A C 1121 ATOM 1108 O O . GLN A 1121 171 . 10.324 -18.979 12.116 1.00 20.00 ? ? ? ? ? . 171 GLN A O 1121 ATOM 1109 C CB . GLN A 1121 171 . 7.575 -19.686 11.363 1.00 20.00 ? ? ? ? ? . 171 GLN A CB 1121 ATOM 1110 C CG . GLN A 1121 171 . 6.412 -20.407 10.698 1.00 20.00 ? ? ? ? ? . 171 GLN A CG 1121 ATOM 1111 C CD . GLN A 1121 171 . 5.276 -20.699 11.651 1.00 20.00 ? ? ? ? ? . 171 GLN A CD 1121 ATOM 1112 N NE2 . GLN A 1121 171 . 5.527 -21.557 12.606 1.00 20.00 ? ? ? ? ? . 171 GLN A NE2 1121 ATOM 1113 O OE1 . GLN A 1121 171 . 4.186 -20.144 11.535 1.00 20.00 ? ? ? ? ? . 171 GLN A OE1 1121 ATOM 1114 N N . THR A 1121 172 . 10.213 -17.466 10.479 1.00 20.00 ? ? ? ? ? . 172 THR A N 1121 ATOM 1115 C CA . THR A 1121 172 . 11.398 -16.768 10.967 1.00 20.00 ? ? ? ? ? . 172 THR A CA 1121 ATOM 1116 C C . THR A 1121 172 . 11.132 -15.943 12.207 1.00 20.00 ? ? ? ? ? . 172 THR A C 1121 ATOM 1117 O O . THR A 1121 172 . 12.024 -15.757 13.034 1.00 20.00 ? ? ? ? ? . 172 THR A O 1121 ATOM 1118 C CB . THR A 1121 172 . 11.977 -15.851 9.893 1.00 20.00 ? ? ? ? ? . 172 THR A CB 1121 ATOM 1119 C CG2 . THR A 1121 172 . 12.300 -16.657 8.626 1.00 20.00 ? ? ? ? ? . 172 THR A CG2 1121 ATOM 1120 O OG1 . THR A 1121 172 . 11.023 -14.833 9.604 1.00 20.00 ? ? ? ? ? . 172 THR A OG1 1121 ATOM 1121 N N . GLY A 1121 173 . 9.921 -15.415 12.320 1.00 20.00 ? ? ? ? ? . 173 GLY A N 1121 ATOM 1122 C CA . GLY A 1121 173 . 9.629 -14.439 13.345 1.00 20.00 ? ? ? ? ? . 173 GLY A CA 1121 ATOM 1123 C C . GLY A 1121 173 . 10.309 -13.108 13.090 1.00 20.00 ? ? ? ? ? . 173 GLY A C 1121 ATOM 1124 O O . GLY A 1121 173 . 10.427 -12.300 14.002 1.00 20.00 ? ? ? ? ? . 173 GLY A O 1121 ATOM 1125 N N . GLN A 1121 174 . 10.715 -12.860 11.843 1.00 20.00 ? ? ? ? ? . 174 GLN A N 1121 ATOM 1126 C CA . GLN A 1121 174 . 11.490 -11.676 11.505 1.00 20.00 ? ? ? ? ? . 174 GLN A CA 1121 ATOM 1127 C C . GLN A 1121 174 . 10.861 -10.868 10.372 1.00 20.00 ? ? ? ? ? . 174 GLN A C 1121 ATOM 1128 O O . GLN A 1121 174 . 9.872 -11.299 9.762 1.00 20.00 ? ? ? ? ? . 174 GLN A O 1121 ATOM 1129 C CB . GLN A 1121 174 . 12.911 -12.083 11.116 1.00 20.00 ? ? ? ? ? . 174 GLN A CB 1121 ATOM 1130 C CG . GLN A 1121 174 . 13.718 -12.719 12.251 1.00 20.00 ? ? ? ? ? . 174 GLN A CG 1121 ATOM 1131 C CD . GLN A 1121 174 . 15.095 -13.189 11.791 1.00 20.00 ? ? ? ? ? . 174 GLN A CD 1121 ATOM 1132 N NE2 . GLN A 1121 174 . 16.127 -12.411 12.114 1.00 20.00 ? ? ? ? ? . 174 GLN A NE2 1121 ATOM 1133 O OE1 . GLN A 1121 174 . 15.227 -14.237 11.152 1.00 20.00 ? ? ? ? ? . 174 GLN A OE1 1121 ATOM 1134 N N . GLY A 1121 175 . 11.435 -9.691 10.117 1.00 20.00 ? ? ? ? ? . 175 GLY A N 1121 ATOM 1135 C CA . GLY A 1121 175 . 11.002 -8.831 9.042 1.00 20.00 ? ? ? ? ? . 175 GLY A CA 1121 ATOM 1136 C C . GLY A 1121 175 . 11.284 -9.377 7.655 1.00 20.00 ? ? ? ? ? . 175 GLY A C 1121 ATOM 1137 O O . GLY A 1121 175 . 11.852 -10.472 7.481 1.00 20.00 ? ? ? ? ? . 175 GLY A O 1121 ATOM 1138 N N . MET A 1121 176 . 10.887 -8.599 6.650 1.00 20.00 ? ? ? ? ? . 176 MET A N 1121 ATOM 1139 C CA . MET A 1121 176 . 10.879 -9.093 5.285 1.00 20.00 ? ? ? ? ? . 176 MET A CA 1121 ATOM 1140 C C . MET A 1121 176 . 12.290 -9.376 4.742 1.00 20.00 ? ? ? ? ? . 176 MET A C 1121 ATOM 1141 O O . MET A 1121 176 . 12.525 -10.445 4.146 1.00 20.00 ? ? ? ? ? . 176 MET A O 1121 ATOM 1142 C CB . MET A 1121 176 . 10.118 -8.133 4.363 1.00 20.00 ? ? ? ? ? . 176 MET A CB 1121 ATOM 1143 C CG . MET A 1121 176 . 9.744 -8.759 3.031 1.00 20.00 ? ? ? ? ? . 176 MET A CG 1121 ATOM 1144 S SD . MET A 1121 176 . 8.479 -10.030 3.199 1.00 20.00 ? ? ? ? ? . 176 MET A SD 1121 ATOM 1145 C CE . MET A 1121 176 . 9.470 -11.546 3.063 1.00 20.00 ? ? ? ? ? . 176 MET A CE 1121 ATOM 1146 N N . LEU A 1121 177 . 13.219 -8.443 4.931 1.00 20.00 ? ? ? ? ? . 177 LEU A N 1121 ATOM 1147 C CA . LEU A 1121 177 . 14.572 -8.629 4.419 1.00 20.00 ? ? ? ? ? . 177 LEU A CA 1121 ATOM 1148 C C . LEU A 1121 177 . 15.243 -9.835 5.062 1.00 20.00 ? ? ? ? ? . 177 LEU A C 1121 ATOM 1149 O O . LEU A 1121 177 . 15.847 -10.676 4.374 1.00 20.00 ? ? ? ? ? . 177 LEU A O 1121 ATOM 1150 C CB . LEU A 1121 177 . 15.420 -7.360 4.614 1.00 20.00 ? ? ? ? ? . 177 LEU A CB 1121 ATOM 1151 C CG . LEU A 1121 177 . 15.196 -6.271 3.560 1.00 20.00 ? ? ? ? ? . 177 LEU A CG 1121 ATOM 1152 C CD1 . LEU A 1121 177 . 15.954 -5.014 3.950 1.00 20.00 ? ? ? ? ? . 177 LEU A CD1 1121 ATOM 1153 C CD2 . LEU A 1121 177 . 15.633 -6.750 2.160 1.00 20.00 ? ? ? ? ? . 177 LEU A CD2 1121 ATOM 1154 N N . ARG A 1121 178 . 15.103 -9.967 6.370 1.00 20.00 ? ? ? ? ? . 178 ARG A N 1121 ATOM 1155 C CA . ARG A 1121 178 . 15.685 -11.120 7.042 1.00 20.00 ? ? ? ? ? . 178 ARG A CA 1121 ATOM 1156 C C . ARG A 1121 178 . 15.096 -12.438 6.530 1.00 20.00 ? ? ? ? ? . 178 ARG A C 1121 ATOM 1157 O O . ARG A 1121 178 . 15.794 -13.428 6.386 1.00 20.00 ? ? ? ? ? . 178 ARG A O 1121 ATOM 1158 C CB . ARG A 1121 178 . 15.447 -11.046 8.535 1.00 20.00 ? ? ? ? ? . 178 ARG A CB 1121 ATOM 1159 C CG . ARG A 1121 178 . 16.287 -10.035 9.267 1.00 20.00 ? ? ? ? ? . 178 ARG A CG 1121 ATOM 1160 C CD . ARG A 1121 178 . 17.771 -10.337 9.227 1.00 20.00 ? ? ? ? ? . 178 ARG A CD 1121 ATOM 1161 N NE . ARG A 1121 178 . 18.438 -9.539 10.248 1.00 20.00 ? ? ? ? ? . 178 ARG A NE 1121 ATOM 1162 C CZ . ARG A 1121 178 . 19.734 -9.556 10.539 1.00 20.00 ? ? ? ? ? . 178 ARG A CZ 1121 ATOM 1163 N NH1 . ARG A 1121 178 . 20.591 -10.306 9.860 1.00 20.00 ? ? ? ? ? 1+ 178 ARG A NH1 1121 ATOM 1164 N NH2 . ARG A 1121 178 . 20.173 -8.783 11.520 1.00 20.00 ? ? ? ? ? . 178 ARG A NH2 1121 ATOM 1165 N N . THR A 1121 179 . 13.798 -12.438 6.284 1.00 20.00 ? ? ? ? ? . 179 THR A N 1121 ATOM 1166 C CA . THR A 1121 179 . 13.096 -13.625 5.857 1.00 20.00 ? ? ? ? ? . 179 THR A CA 1121 ATOM 1167 C C . THR A 1121 179 . 13.549 -14.006 4.457 1.00 20.00 ? ? ? ? ? . 179 THR A C 1121 ATOM 1168 O O . THR A 1121 179 . 13.719 -15.196 4.162 1.00 20.00 ? ? ? ? ? . 179 THR A O 1121 ATOM 1169 C CB . THR A 1121 179 . 11.582 -13.376 5.940 1.00 20.00 ? ? ? ? ? . 179 THR A CB 1121 ATOM 1170 C CG2 . THR A 1121 179 . 10.777 -14.508 5.370 1.00 20.00 ? ? ? ? ? . 179 THR A CG2 1121 ATOM 1171 O OG1 . THR A 1121 179 . 11.223 -13.203 7.314 1.00 20.00 ? ? ? ? ? . 179 THR A OG1 1121 ATOM 1172 N N . ILE A 1121 180 . 13.737 -13.010 3.599 1.00 20.00 ? ? ? ? ? . 180 ILE A N 1121 ATOM 1173 C CA . ILE A 1121 180 . 14.266 -13.251 2.259 1.00 20.00 ? ? ? ? ? . 180 ILE A CA 1121 ATOM 1174 C C . ILE A 1121 180 . 15.640 -13.886 2.354 1.00 20.00 ? ? ? ? ? . 180 ILE A C 1121 ATOM 1175 O O . ILE A 1121 180 . 15.944 -14.841 1.643 1.00 20.00 ? ? ? ? ? . 180 ILE A O 1121 ATOM 1176 C CB . ILE A 1121 180 . 14.347 -11.947 1.421 1.00 20.00 ? ? ? ? ? . 180 ILE A CB 1121 ATOM 1177 C CG1 . ILE A 1121 180 . 12.946 -11.504 0.987 1.00 20.00 ? ? ? ? ? . 180 ILE A CG1 1121 ATOM 1178 C CG2 . ILE A 1121 180 . 15.227 -12.145 0.177 1.00 20.00 ? ? ? ? ? . 180 ILE A CG2 1121 ATOM 1179 C CD1 . ILE A 1121 180 . 12.895 -10.124 0.304 1.00 20.00 ? ? ? ? ? . 180 ILE A CD1 1121 ATOM 1180 N N . ASN A 1121 181 . 16.485 -13.347 3.223 1.00 20.00 ? ? ? ? ? . 181 ASN A N 1121 ATOM 1181 C CA . ASN A 1121 181 . 17.816 -13.901 3.390 1.00 20.00 ? ? ? ? ? . 181 ASN A CA 1121 ATOM 1182 C C . ASN A 1121 181 . 17.832 -15.331 3.929 1.00 20.00 ? ? ? ? ? . 181 ASN A C 1121 ATOM 1183 O O . ASN A 1121 181 . 18.700 -16.122 3.555 1.00 20.00 ? ? ? ? ? . 181 ASN A O 1121 ATOM 1184 C CB . ASN A 1121 181 . 18.676 -12.958 4.206 1.00 20.00 ? ? ? ? ? . 181 ASN A CB 1121 ATOM 1185 C CG . ASN A 1121 181 . 19.176 -11.807 3.362 1.00 20.00 ? ? ? ? ? . 181 ASN A CG 1121 ATOM 1186 N ND2 . ASN A 1121 181 . 18.711 -10.621 3.643 1.00 20.00 ? ? ? ? ? . 181 ASN A ND2 1121 ATOM 1187 O OD1 . ASN A 1121 181 . 19.947 -12.013 2.429 1.00 20.00 ? ? ? ? ? . 181 ASN A OD1 1121 ATOM 1188 N N . VAL A 1121 182 . 16.852 -15.681 4.757 1.00 20.00 ? ? ? ? ? . 182 VAL A N 1121 ATOM 1189 C CA . VAL A 1121 182 . 16.721 -17.060 5.207 1.00 20.00 ? ? ? ? ? . 182 VAL A CA 1121 ATOM 1190 C C . VAL A 1121 182 . 16.363 -17.967 4.029 1.00 20.00 ? ? ? ? ? . 182 VAL A C 1121 ATOM 1191 O O . VAL A 1121 182 . 16.962 -19.034 3.852 1.00 20.00 ? ? ? ? ? . 182 VAL A O 1121 ATOM 1192 C CB . VAL A 1121 182 . 15.683 -17.217 6.344 1.00 20.00 ? ? ? ? ? . 182 VAL A CB 1121 ATOM 1193 C CG1 . VAL A 1121 182 . 15.406 -18.698 6.632 1.00 20.00 ? ? ? ? ? . 182 VAL A CG1 1121 ATOM 1194 C CG2 . VAL A 1121 182 . 16.161 -16.505 7.599 1.00 20.00 ? ? ? ? ? . 182 VAL A CG2 1121 ATOM 1195 N N . ALA A 1121 183 . 15.424 -17.529 3.192 1.00 20.00 ? ? ? ? ? . 183 ALA A N 1121 ATOM 1196 C CA . ALA A 1121 183 . 15.074 -18.294 1.998 1.00 20.00 ? ? ? ? ? . 183 ALA A CA 1121 ATOM 1197 C C . ALA A 1121 183 . 16.300 -18.480 1.107 1.00 20.00 ? ? ? ? ? . 183 ALA A C 1121 ATOM 1198 O O . ALA A 1121 183 . 16.515 -19.562 0.548 1.00 20.00 ? ? ? ? ? . 183 ALA A O 1121 ATOM 1199 C CB . ALA A 1121 183 . 13.966 -17.598 1.229 1.00 20.00 ? ? ? ? ? . 183 ALA A CB 1121 ATOM 1200 N N . ALA A 1121 184 . 17.102 -17.428 0.959 1.00 20.00 ? ? ? ? ? . 184 ALA A N 1121 ATOM 1201 C CA . ALA A 1121 184 . 18.302 -17.525 0.128 1.00 20.00 ? ? ? ? ? . 184 ALA A CA 1121 ATOM 1202 C C . ALA A 1121 184 . 19.270 -18.552 0.704 1.00 20.00 ? ? ? ? ? . 184 ALA A C 1121 ATOM 1203 O O . ALA A 1121 184 . 19.811 -19.397 -0.017 1.00 20.00 ? ? ? ? ? . 184 ALA A O 1121 ATOM 1204 C CB . ALA A 1121 184 . 18.977 -16.179 0.011 1.00 20.00 ? ? ? ? ? . 184 ALA A CB 1121 ATOM 1205 N N . GLU A 1121 185 . 19.472 -18.490 2.013 1.00 20.00 ? ? ? ? ? . 185 GLU A N 1121 ATOM 1206 C CA . GLU A 1121 185 . 20.431 -19.372 2.667 1.00 20.00 ? ? ? ? ? . 185 GLU A CA 1121 ATOM 1207 C C . GLU A 1121 185 . 19.983 -20.838 2.570 1.00 20.00 ? ? ? ? ? . 185 GLU A C 1121 ATOM 1208 O O . GLU A 1121 185 . 20.810 -21.755 2.439 1.00 20.00 ? ? ? ? ? . 185 GLU A O 1121 ATOM 1209 C CB . GLU A 1121 185 . 20.617 -18.933 4.122 1.00 20.00 ? ? ? ? ? . 185 GLU A CB 1121 ATOM 1210 C CG . GLU A 1121 185 . 21.718 -19.648 4.886 1.00 20.00 ? ? ? ? ? . 185 GLU A CG 1121 ATOM 1211 C CD . GLU A 1121 185 . 21.265 -20.939 5.500 1.00 20.00 ? ? ? ? ? . 185 GLU A CD 1121 ATOM 1212 O OE1 . GLU A 1121 185 . 20.127 -20.980 6.026 1.00 20.00 ? ? ? ? ? . 185 GLU A OE1 1121 ATOM 1213 O OE2 . GLU A 1121 185 . 22.060 -21.904 5.461 1.00 20.00 ? ? ? ? ? 1- 185 GLU A OE2 1121 ATOM 1214 N N . LYS A 1121 186 . 18.674 -21.049 2.617 1.00 20.00 ? ? ? ? ? . 186 LYS A N 1121 ATOM 1215 C CA . LYS A 1121 186 . 18.115 -22.400 2.660 1.00 20.00 ? ? ? ? ? . 186 LYS A CA 1121 ATOM 1216 C C . LYS A 1121 186 . 17.770 -22.927 1.277 1.00 20.00 ? ? ? ? ? . 186 LYS A C 1121 ATOM 1217 O O . LYS A 1121 186 . 17.348 -24.065 1.138 1.00 20.00 ? ? ? ? ? . 186 LYS A O 1121 ATOM 1218 C CB . LYS A 1121 186 . 16.866 -22.405 3.540 1.00 20.00 ? ? ? ? ? . 186 LYS A CB 1121 ATOM 1219 C CG . LYS A 1121 186 . 17.166 -22.280 5.017 1.00 20.00 ? ? ? ? ? . 186 LYS A CG 1121 ATOM 1220 C CD . LYS A 1121 186 . 15.895 -22.435 5.834 1.00 20.00 ? ? ? ? ? . 186 LYS A CD 1121 ATOM 1221 C CE . LYS A 1121 186 . 16.148 -22.315 7.320 1.00 20.00 ? ? ? ? ? . 186 LYS A CE 1121 ATOM 1222 N NZ . LYS A 1121 186 . 16.942 -23.462 7.808 1.00 20.00 ? ? ? ? ? 1+ 186 LYS A NZ 1121 ATOM 1223 N N . GLY A 1121 187 . 17.941 -22.097 0.249 1.00 20.00 ? ? ? ? ? . 187 GLY A N 1121 ATOM 1224 C CA . GLY A 1121 187 . 17.519 -22.461 -1.093 1.00 20.00 ? ? ? ? ? . 187 GLY A CA 1121 ATOM 1225 C C . GLY A 1121 187 . 16.025 -22.707 -1.189 1.00 20.00 ? ? ? ? ? . 187 GLY A C 1121 ATOM 1226 O O . GLY A 1121 187 . 15.564 -23.662 -1.827 1.00 20.00 ? ? ? ? ? . 187 GLY A O 1121 ATOM 1227 N N . GLY A 1121 188 . 15.265 -21.830 -0.551 1.00 20.00 ? ? ? ? ? . 188 GLY A N 1121 ATOM 1228 C CA . GLY A 1121 188 . 13.837 -22.009 -0.414 1.00 20.00 ? ? ? ? ? . 188 GLY A CA 1121 ATOM 1229 C C . GLY A 1121 188 . 13.037 -20.922 -1.086 1.00 20.00 ? ? ? ? ? . 188 GLY A C 1121 ATOM 1230 O O . GLY A 1121 188 . 13.590 -20.006 -1.702 1.00 20.00 ? ? ? ? ? . 188 GLY A O 1121 ATOM 1231 N N . TYR A 1121 189 . 11.722 -21.076 -0.997 1.00 20.00 ? ? ? ? ? . 189 TYR A N 1121 ATOM 1232 C CA . TYR A 1121 189 . 10.767 -20.136 -1.558 1.00 20.00 ? ? ? ? ? . 189 TYR A CA 1121 ATOM 1233 C C . TYR A 1121 189 . 10.204 -19.232 -0.469 1.00 20.00 ? ? ? ? ? . 189 TYR A C 1121 ATOM 1234 O O . TYR A 1121 189 . 10.155 -19.614 0.699 1.00 20.00 ? ? ? ? ? . 189 TYR A O 1121 ATOM 1235 C CB . TYR A 1121 189 . 9.616 -20.910 -2.183 1.00 20.00 ? ? ? ? ? . 189 TYR A CB 1121 ATOM 1236 C CG . TYR A 1121 189 . 10.007 -21.739 -3.376 1.00 20.00 ? ? ? ? ? . 189 TYR A CG 1121 ATOM 1237 C CD1 . TYR A 1121 189 . 10.534 -23.009 -3.216 1.00 20.00 ? ? ? ? ? . 189 TYR A CD1 1121 ATOM 1238 C CD2 . TYR A 1121 189 . 9.866 -21.250 -4.654 1.00 20.00 ? ? ? ? ? . 189 TYR A CD2 1121 ATOM 1239 C CE1 . TYR A 1121 189 . 10.888 -23.770 -4.298 1.00 20.00 ? ? ? ? ? . 189 TYR A CE1 1121 ATOM 1240 C CE2 . TYR A 1121 189 . 10.216 -22.015 -5.753 1.00 20.00 ? ? ? ? ? . 189 TYR A CE2 1121 ATOM 1241 C CZ . TYR A 1121 189 . 10.751 -23.258 -5.573 1.00 20.00 ? ? ? ? ? . 189 TYR A CZ 1121 ATOM 1242 O OH . TYR A 1121 189 . 11.098 -24.037 -6.654 1.00 20.00 ? ? ? ? ? . 189 TYR A OH 1121 ATOM 1243 N N . THR A 1121 190 . 9.731 -18.050 -0.843 1.00 20.00 ? ? ? ? ? . 190 THR A N 1121 ATOM 1244 C CA . THR A 1121 190 . 9.089 -17.183 0.134 1.00 20.00 ? ? ? ? ? . 190 THR A CA 1121 ATOM 1245 C C . THR A 1121 190 . 8.188 -16.182 -0.591 1.00 20.00 ? ? ? ? ? . 190 THR A C 1121 ATOM 1246 O O . THR A 1121 190 . 8.385 -15.884 -1.767 1.00 20.00 ? ? ? ? ? . 190 THR A O 1121 ATOM 1247 C CB . THR A 1121 190 . 10.116 -16.454 1.037 1.00 20.00 ? ? ? ? ? . 190 THR A CB 1121 ATOM 1248 C CG2 . THR A 1121 190 . 10.893 -15.388 0.266 1.00 20.00 ? ? ? ? ? . 190 THR A CG2 1121 ATOM 1249 O OG1 . THR A 1121 190 . 9.429 -15.834 2.123 1.00 20.00 ? ? ? ? ? . 190 THR A OG1 1121 ATOM 1250 N N . MET A 1121 191 . 7.192 -15.681 0.125 1.00 20.00 ? ? ? ? ? . 191 MET A N 1121 ATOM 1251 C CA . MET A 1121 191 . 6.342 -14.614 -0.393 1.00 20.00 ? ? ? ? ? . 191 MET A CA 1121 ATOM 1252 C C . MET A 1121 191 . 6.837 -13.294 0.180 1.00 20.00 ? ? ? ? ? . 191 MET A C 1121 ATOM 1253 O O . MET A 1121 191 . 7.057 -13.178 1.382 1.00 20.00 ? ? ? ? ? . 191 MET A O 1121 ATOM 1254 C CB . MET A 1121 191 . 4.880 -14.836 -0.015 1.00 20.00 ? ? ? ? ? . 191 MET A CB 1121 ATOM 1255 C CG . MET A 1121 191 . 3.915 -13.889 -0.699 1.00 20.00 ? ? ? ? ? . 191 MET A CG 1121 ATOM 1256 S SD . MET A 1121 191 . 2.423 -13.503 0.241 1.00 20.00 ? ? ? ? ? . 191 MET A SD 1121 ATOM 1257 C CE . MET A 1121 191 . 3.117 -12.435 1.509 1.00 20.00 ? ? ? ? ? . 191 MET A CE 1121 ATOM 1258 N N . THR A 1121 192 . 6.975 -12.294 -0.685 1.00 20.00 ? ? ? ? ? . 192 THR A N 1121 ATOM 1259 C CA . THR A 1121 192 . 7.428 -10.981 -0.268 1.00 20.00 ? ? ? ? ? . 192 THR A CA 1121 ATOM 1260 C C . THR A 1121 192 . 6.638 -9.921 -1.003 1.00 20.00 ? ? ? ? ? . 192 THR A C 1121 ATOM 1261 O O . THR A 1121 192 . 6.103 -10.183 -2.064 1.00 20.00 ? ? ? ? ? . 192 THR A O 1121 ATOM 1262 C CB . THR A 1121 192 . 8.941 -10.809 -0.566 1.00 20.00 ? ? ? ? ? . 192 THR A CB 1121 ATOM 1263 C CG2 . THR A 1121 192 . 9.253 -11.047 -2.036 1.00 20.00 ? ? ? ? ? . 192 THR A CG2 1121 ATOM 1264 O OG1 . THR A 1121 192 . 9.378 -9.498 -0.194 1.00 20.00 ? ? ? ? ? . 192 THR A OG1 1121 ATOM 1265 N N . ASP A 1121 193 . 6.546 -8.724 -0.431 1.00 20.00 ? ? ? ? ? . 193 ASP A N 1121 ATOM 1266 C CA . ASP A 1121 193 . 6.028 -7.599 -1.201 1.00 20.00 ? ? ? ? ? . 193 ASP A CA 1121 ATOM 1267 C C . ASP A 1121 193 . 7.070 -7.317 -2.286 1.00 20.00 ? ? ? ? ? . 193 ASP A C 1121 ATOM 1268 O O . ASP A 1121 193 . 8.260 -7.533 -2.089 1.00 20.00 ? ? ? ? ? . 193 ASP A O 1121 ATOM 1269 C CB . ASP A 1121 193 . 5.831 -6.369 -0.318 1.00 20.00 ? ? ? ? ? . 193 ASP A CB 1121 ATOM 1270 C CG . ASP A 1121 193 . 7.123 -5.904 0.313 1.00 20.00 ? ? ? ? ? . 193 ASP A CG 1121 ATOM 1271 O OD1 . ASP A 1121 193 . 7.674 -6.640 1.179 1.00 20.00 ? ? ? ? ? . 193 ASP A OD1 1121 ATOM 1272 O OD2 . ASP A 1121 193 . 7.570 -4.807 -0.066 1.00 20.00 ? ? ? ? ? 1- 193 ASP A OD2 1121 ATOM 1273 N N . ARG A 1121 194 . 6.619 -6.839 -3.436 1.00 20.00 ? ? ? ? ? . 194 ARG A N 1121 ATOM 1274 C CA . ARG A 1121 194 . 7.528 -6.553 -4.534 1.00 20.00 ? ? ? ? ? . 194 ARG A CA 1121 ATOM 1275 C C . ARG A 1121 194 . 8.551 -5.487 -4.202 1.00 20.00 ? ? ? ? ? . 194 ARG A C 1121 ATOM 1276 O O . ARG A 1121 194 . 9.702 -5.584 -4.639 1.00 20.00 ? ? ? ? ? . 194 ARG A O 1121 ATOM 1277 C CB . ARG A 1121 194 . 6.755 -6.138 -5.776 1.00 20.00 ? ? ? ? ? . 194 ARG A CB 1121 ATOM 1278 C CG . ARG A 1121 194 . 7.633 -5.992 -7.028 1.00 20.00 ? ? ? ? ? . 194 ARG A CG 1121 ATOM 1279 C CD . ARG A 1121 194 . 6.835 -5.492 -8.209 1.00 20.00 ? ? ? ? ? . 194 ARG A CD 1121 ATOM 1280 N NE . ARG A 1121 194 . 5.832 -6.454 -8.657 1.00 20.00 ? ? ? ? ? . 194 ARG A NE 1121 ATOM 1281 C CZ . ARG A 1121 194 . 6.057 -7.427 -9.534 1.00 20.00 ? ? ? ? ? . 194 ARG A CZ 1121 ATOM 1282 N NH1 . ARG A 1121 194 . 7.261 -7.606 -10.064 1.00 20.00 ? ? ? ? ? 1+ 194 ARG A NH1 1121 ATOM 1283 N NH2 . ARG A 1121 194 . 5.063 -8.228 -9.876 1.00 20.00 ? ? ? ? ? . 194 ARG A NH2 1121 ATOM 1284 N N . GLY A 1121 195 . 8.147 -4.461 -3.458 1.00 20.00 ? ? ? ? ? . 195 GLY A N 1121 ATOM 1285 C CA . GLY A 1121 195 . 9.051 -3.364 -3.124 1.00 20.00 ? ? ? ? ? . 195 GLY A CA 1121 ATOM 1286 C C . GLY A 1121 195 . 10.282 -3.864 -2.381 1.00 20.00 ? ? ? ? ? . 195 GLY A C 1121 ATOM 1287 O O . GLY A 1121 195 . 11.404 -3.515 -2.716 1.00 20.00 ? ? ? ? ? . 195 GLY A O 1121 ATOM 1288 N N . THR A 1121 196 . 10.088 -4.718 -1.378 1.00 20.00 ? ? ? ? ? . 196 THR A N 1121 ATOM 1289 C CA . THR A 1121 196 . 11.235 -5.242 -0.652 1.00 20.00 ? ? ? ? ? . 196 THR A CA 1121 ATOM 1290 C C . THR A 1121 196 . 12.096 -6.094 -1.588 1.00 20.00 ? ? ? ? ? . 196 THR A C 1121 ATOM 1291 O O . THR A 1121 196 . 13.326 -6.034 -1.529 1.00 20.00 ? ? ? ? ? . 196 THR A O 1121 ATOM 1292 C CB . THR A 1121 196 . 10.825 -6.060 0.579 1.00 20.00 ? ? ? ? ? . 196 THR A CB 1121 ATOM 1293 C CG2 . THR A 1121 196 . 12.055 -6.471 1.380 1.00 20.00 ? ? ? ? ? . 196 THR A CG2 1121 ATOM 1294 O OG1 . THR A 1121 196 . 9.976 -5.272 1.424 1.00 20.00 ? ? ? ? ? . 196 THR A OG1 1121 ATOM 1295 N N . TYR A 1121 197 . 11.467 -6.874 -2.460 1.00 20.00 ? ? ? ? ? . 197 TYR A N 1121 ATOM 1296 C CA . TYR A 1121 197 . 12.251 -7.626 -3.440 1.00 20.00 ? ? ? ? ? . 197 TYR A CA 1121 ATOM 1297 C C . TYR A 1121 197 . 13.129 -6.719 -4.318 1.00 20.00 ? ? ? ? ? . 197 TYR A C 1121 ATOM 1298 O O . TYR A 1121 197 . 14.308 -7.013 -4.551 1.00 20.00 ? ? ? ? ? . 197 TYR A O 1121 ATOM 1299 C CB . TYR A 1121 197 . 11.381 -8.508 -4.343 1.00 20.00 ? ? ? ? ? . 197 TYR A CB 1121 ATOM 1300 C CG . TYR A 1121 197 . 12.258 -9.300 -5.265 1.00 20.00 ? ? ? ? ? . 197 TYR A CG 1121 ATOM 1301 C CD1 . TYR A 1121 197 . 12.979 -10.387 -4.781 1.00 20.00 ? ? ? ? ? . 197 TYR A CD1 1121 ATOM 1302 C CD2 . TYR A 1121 197 . 12.418 -8.948 -6.609 1.00 20.00 ? ? ? ? ? . 197 TYR A CD2 1121 ATOM 1303 C CE1 . TYR A 1121 197 . 13.823 -11.110 -5.613 1.00 20.00 ? ? ? ? ? . 197 TYR A CE1 1121 ATOM 1304 C CE2 . TYR A 1121 197 . 13.270 -9.673 -7.443 1.00 20.00 ? ? ? ? ? . 197 TYR A CE2 1121 ATOM 1305 C CZ . TYR A 1121 197 . 13.970 -10.730 -6.938 1.00 20.00 ? ? ? ? ? . 197 TYR A CZ 1121 ATOM 1306 O OH . TYR A 1121 197 . 14.786 -11.443 -7.769 1.00 20.00 ? ? ? ? ? . 197 TYR A OH 1121 ATOM 1307 N N . ILE A 1121 198 . 12.540 -5.646 -4.829 1.00 20.00 ? ? ? ? ? . 198 ILE A N 1121 ATOM 1308 C CA . ILE A 1121 198 . 13.275 -4.690 -5.658 1.00 20.00 ? ? ? ? ? . 198 ILE A CA 1121 ATOM 1309 C C . ILE A 1121 198 . 14.519 -4.181 -4.908 1.00 20.00 ? ? ? ? ? . 198 ILE A C 1121 ATOM 1310 O O . ILE A 1121 198 . 15.623 -4.126 -5.472 1.00 20.00 ? ? ? ? ? . 198 ILE A O 1121 ATOM 1311 C CB . ILE A 1121 198 . 12.363 -3.536 -6.099 1.00 20.00 ? ? ? ? ? . 198 ILE A CB 1121 ATOM 1312 C CG1 . ILE A 1121 198 . 11.361 -4.041 -7.127 1.00 20.00 ? ? ? ? ? . 198 ILE A CG1 1121 ATOM 1313 C CG2 . ILE A 1121 198 . 13.171 -2.339 -6.675 1.00 20.00 ? ? ? ? ? . 198 ILE A CG2 1121 ATOM 1314 C CD1 . ILE A 1121 198 . 10.203 -3.122 -7.335 1.00 20.00 ? ? ? ? ? . 198 ILE A CD1 1121 ATOM 1315 N N . LYS A 1121 199 . 14.347 -3.825 -3.637 1.00 20.00 ? ? ? ? ? . 199 LYS A N 1121 ATOM 1316 C CA . LYS A 1121 199 . 15.470 -3.338 -2.849 1.00 20.00 ? ? ? ? ? . 199 LYS A CA 1121 ATOM 1317 C C . LYS A 1121 199 . 16.512 -4.447 -2.646 1.00 20.00 ? ? ? ? ? . 199 LYS A C 1121 ATOM 1318 O O . LYS A 1121 199 . 17.715 -4.219 -2.818 1.00 20.00 ? ? ? ? ? . 199 LYS A O 1121 ATOM 1319 C CB . LYS A 1121 199 . 14.974 -2.762 -1.514 1.00 20.00 ? ? ? ? ? . 199 LYS A CB 1121 ATOM 1320 C CG . LYS A 1121 199 . 14.108 -1.507 -1.698 1.00 20.00 ? ? ? ? ? . 199 LYS A CG 1121 ATOM 1321 C CD . LYS A 1121 199 . 13.522 -0.969 -0.405 1.00 20.00 ? ? ? ? ? . 199 LYS A CD 1121 ATOM 1322 C CE . LYS A 1121 199 . 12.889 0.407 -0.664 1.00 20.00 ? ? ? ? ? . 199 LYS A CE 1121 ATOM 1323 N NZ . LYS A 1121 199 . 12.024 0.943 0.455 1.00 20.00 ? ? ? ? ? 1+ 199 LYS A NZ 1121 ATOM 1324 N N . TYR A 1121 200 . 16.046 -5.646 -2.318 1.00 20.00 ? ? ? ? ? . 200 TYR A N 1121 ATOM 1325 C CA . TYR A 1121 200 . 16.924 -6.802 -2.160 1.00 20.00 ? ? ? ? ? . 200 TYR A CA 1121 ATOM 1326 C C . TYR A 1121 200 . 17.701 -7.118 -3.461 1.00 20.00 ? ? ? ? ? . 200 TYR A C 1121 ATOM 1327 O O . TYR A 1121 200 . 18.909 -7.349 -3.446 1.00 20.00 ? ? ? ? ? . 200 TYR A O 1121 ATOM 1328 C CB . TYR A 1121 200 . 16.069 -8.002 -1.715 1.00 20.00 ? ? ? ? ? . 200 TYR A CB 1121 ATOM 1329 C CG . TYR A 1121 200 . 16.737 -9.341 -1.903 1.00 20.00 ? ? ? ? ? . 200 TYR A CG 1121 ATOM 1330 C CD1 . TYR A 1121 200 . 17.771 -9.734 -1.080 1.00 20.00 ? ? ? ? ? . 200 TYR A CD1 1121 ATOM 1331 C CD2 . TYR A 1121 200 . 16.315 -10.224 -2.905 1.00 20.00 ? ? ? ? ? . 200 TYR A CD2 1121 ATOM 1332 C CE1 . TYR A 1121 200 . 18.395 -10.956 -1.253 1.00 20.00 ? ? ? ? ? . 200 TYR A CE1 1121 ATOM 1333 C CE2 . TYR A 1121 200 . 16.918 -11.453 -3.071 1.00 20.00 ? ? ? ? ? . 200 TYR A CE2 1121 ATOM 1334 C CZ . TYR A 1121 200 . 17.955 -11.815 -2.247 1.00 20.00 ? ? ? ? ? . 200 TYR A CZ 1121 ATOM 1335 O OH . TYR A 1121 200 . 18.554 -13.046 -2.445 1.00 20.00 ? ? ? ? ? . 200 TYR A OH 1121 ATOM 1336 N N . GLU A 1121 201 . 17.005 -7.079 -4.592 1.00 20.00 ? ? ? ? ? . 201 GLU A N 1121 ATOM 1337 C CA . GLU A 1121 201 . 17.602 -7.372 -5.882 1.00 20.00 ? ? ? ? ? . 201 GLU A CA 1121 ATOM 1338 C C . GLU A 1121 201 . 18.724 -6.359 -6.175 1.00 20.00 ? ? ? ? ? . 201 GLU A C 1121 ATOM 1339 O O . GLU A 1121 201 . 19.800 -6.724 -6.650 1.00 20.00 ? ? ? ? ? . 201 GLU A O 1121 ATOM 1340 C CB . GLU A 1121 201 . 16.511 -7.291 -6.951 1.00 20.00 ? ? ? ? ? . 201 GLU A CB 1121 ATOM 1341 C CG . GLU A 1121 201 . 16.972 -7.522 -8.363 1.00 20.00 ? ? ? ? ? . 201 GLU A CG 1121 ATOM 1342 C CD . GLU A 1121 201 . 15.857 -7.275 -9.364 1.00 20.00 ? ? ? ? ? . 201 GLU A CD 1121 ATOM 1343 O OE1 . GLU A 1121 201 . 15.125 -6.281 -9.216 1.00 20.00 ? ? ? ? ? . 201 GLU A OE1 1121 ATOM 1344 O OE2 . GLU A 1121 201 . 15.692 -8.092 -10.282 1.00 20.00 ? ? ? ? ? 1- 201 GLU A OE2 1121 ATOM 1345 N N . ALA A 1121 202 . 18.479 -5.089 -5.858 1.00 20.00 ? ? ? ? ? . 202 ALA A N 1121 ATOM 1346 C CA . ALA A 1121 202 . 19.487 -4.042 -6.061 1.00 20.00 ? ? ? ? ? . 202 ALA A CA 1121 ATOM 1347 C C . ALA A 1121 202 . 20.681 -4.231 -5.118 1.00 20.00 ? ? ? ? ? . 202 ALA A C 1121 ATOM 1348 O O . ALA A 1121 202 . 21.817 -3.964 -5.492 1.00 20.00 ? ? ? ? ? . 202 ALA A O 1121 ATOM 1349 C CB . ALA A 1121 202 . 18.856 -2.653 -5.868 1.00 20.00 ? ? ? ? ? . 202 ALA A CB 1121 ATOM 1350 N N . SER A 1121 203 . 20.428 -4.720 -3.906 1.00 20.00 ? ? ? ? ? . 203 SER A N 1121 ATOM 1351 C CA . SER A 1121 203 . 21.508 -4.954 -2.948 1.00 20.00 ? ? ? ? ? . 203 SER A CA 1121 ATOM 1352 C C . SER A 1121 203 . 22.439 -6.060 -3.420 1.00 20.00 ? ? ? ? ? . 203 SER A C 1121 ATOM 1353 O O . SER A 1121 203 . 23.562 -6.199 -2.911 1.00 20.00 ? ? ? ? ? . 203 SER A O 1121 ATOM 1354 C CB . SER A 1121 203 . 20.954 -5.295 -1.562 1.00 20.00 ? ? ? ? ? . 203 SER A CB 1121 ATOM 1355 O OG . SER A 1121 203 . 20.453 -6.618 -1.508 1.00 20.00 ? ? ? ? ? . 203 SER A OG 1121 ATOM 1356 N N . MET A 1121 204 . 21.979 -6.850 -4.388 1.00 20.00 ? ? ? ? ? . 204 MET A N 1121 ATOM 1357 C CA . MET A 1121 204 . 22.804 -7.902 -4.969 1.00 20.00 ? ? ? ? ? . 204 MET A CA 1121 ATOM 1358 C C . MET A 1121 204 . 23.217 -7.552 -6.400 1.00 20.00 ? ? ? ? ? . 204 MET A C 1121 ATOM 1359 O O . MET A 1121 204 . 23.445 -8.443 -7.218 1.00 20.00 ? ? ? ? ? . 204 MET A O 1121 ATOM 1360 C CB . MET A 1121 204 . 22.033 -9.221 -4.964 1.00 20.00 ? ? ? ? ? . 204 MET A CB 1121 ATOM 1361 C CG . MET A 1121 204 . 21.493 -9.634 -3.591 1.00 20.00 ? ? ? ? ? . 204 MET A CG 1121 ATOM 1362 S SD . MET A 1121 204 . 22.726 -10.261 -2.443 1.00 20.00 ? ? ? ? ? . 204 MET A SD 1121 ATOM 1363 C CE . MET A 1121 204 . 23.395 -11.648 -3.355 1.00 20.00 ? ? ? ? ? . 204 MET A CE 1121 ATOM 1364 N N . ASP A 1121 205 . 23.301 -6.259 -6.700 1.00 20.00 ? ? ? ? ? . 205 ASP A N 1121 ATOM 1365 C CA . ASP A 1121 205 . 23.725 -5.790 -8.024 1.00 20.00 ? ? ? ? ? . 205 ASP A CA 1121 ATOM 1366 C C . ASP A 1121 205 . 22.865 -6.334 -9.169 1.00 20.00 ? ? ? ? ? . 205 ASP A C 1121 ATOM 1367 O O . ASP A 1121 205 . 23.357 -6.557 -10.274 1.00 20.00 ? ? ? ? ? . 205 ASP A O 1121 ATOM 1368 C CB . ASP A 1121 205 . 25.188 -6.156 -8.282 1.00 20.00 ? ? ? ? ? . 205 ASP A CB 1121 ATOM 1369 C CG . ASP A 1121 205 . 26.149 -5.409 -7.376 1.00 20.00 ? ? ? ? ? . 205 ASP A CG 1121 ATOM 1370 O OD1 . ASP A 1121 205 . 25.984 -4.181 -7.219 1.00 20.00 ? ? ? ? ? . 205 ASP A OD1 1121 ATOM 1371 O OD2 . ASP A 1121 205 . 27.068 -6.053 -6.818 1.00 20.00 ? ? ? ? ? 1- 205 ASP A OD2 1121 ATOM 1372 N N . GLY A 1121 206 . 21.581 -6.549 -8.904 1.00 20.00 ? ? ? ? ? . 206 GLY A N 1121 ATOM 1373 C CA . GLY A 1121 206 . 20.666 -6.973 -9.941 1.00 20.00 ? ? ? ? ? . 206 GLY A CA 1121 ATOM 1374 C C . GLY A 1121 206 . 20.725 -8.454 -10.231 1.00 20.00 ? ? ? ? ? . 206 GLY A C 1121 ATOM 1375 O O . GLY A 1121 206 . 20.058 -8.926 -11.153 1.00 20.00 ? ? ? ? ? . 206 GLY A O 1121 ATOM 1376 N N . ASN A 1121 207 . 21.518 -9.183 -9.451 1.00 20.00 ? ? ? ? ? . 207 ASN A N 1121 ATOM 1377 C CA . ASN A 1121 207 . 21.689 -10.614 -9.646 1.00 20.00 ? ? ? ? ? . 207 ASN A CA 1121 ATOM 1378 C C . ASN A 1121 207 . 21.625 -11.386 -8.332 1.00 20.00 ? ? ? ? ? . 207 ASN A C 1121 ATOM 1379 O O . ASN A 1121 207 . 22.567 -12.083 -7.947 1.00 20.00 ? ? ? ? ? . 207 ASN A O 1121 ATOM 1380 C CB . ASN A 1121 207 . 23.018 -10.886 -10.331 1.00 20.00 ? ? ? ? ? . 207 ASN A CB 1121 ATOM 1381 C CG . ASN A 1121 207 . 23.138 -12.311 -10.829 1.00 20.00 ? ? ? ? ? . 207 ASN A CG 1121 ATOM 1382 N ND2 . ASN A 1121 207 . 24.364 -12.756 -11.010 1.00 20.00 ? ? ? ? ? . 207 ASN A ND2 1121 ATOM 1383 O OD1 . ASN A 1121 207 . 22.139 -13.001 -11.054 1.00 20.00 ? ? ? ? ? . 207 ASN A OD1 1121 ATOM 1384 N N . PRO A 1121 208 . 20.494 -11.286 -7.636 1.00 20.00 ? ? ? ? ? . 208 PRO A N 1121 ATOM 1385 C CA . PRO A 1121 208 . 20.301 -12.107 -6.439 1.00 20.00 ? ? ? ? ? . 208 PRO A CA 1121 ATOM 1386 C C . PRO A 1121 208 . 20.071 -13.576 -6.801 1.00 20.00 ? ? ? ? ? . 208 PRO A C 1121 ATOM 1387 O O . PRO A 1121 208 . 19.636 -13.877 -7.908 1.00 20.00 ? ? ? ? ? . 208 PRO A O 1121 ATOM 1388 C CB . PRO A 1121 208 . 19.014 -11.541 -5.852 1.00 20.00 ? ? ? ? ? . 208 PRO A CB 1121 ATOM 1389 C CG . PRO A 1121 208 . 18.252 -11.087 -7.068 1.00 20.00 ? ? ? ? ? . 208 PRO A CG 1121 ATOM 1390 C CD . PRO A 1121 208 . 19.299 -10.494 -7.966 1.00 20.00 ? ? ? ? ? . 208 PRO A CD 1121 ATOM 1391 N N . PRO A 1121 209 . 20.307 -14.487 -5.851 1.00 20.00 ? ? ? ? ? . 209 PRO A N 1121 ATOM 1392 C CA . PRO A 1121 209 . 20.067 -15.907 -6.109 1.00 20.00 ? ? ? ? ? . 209 PRO A CA 1121 ATOM 1393 C C . PRO A 1121 209 . 18.591 -16.288 -6.142 1.00 20.00 ? ? ? ? ? . 209 PRO A C 1121 ATOM 1394 O O . PRO A 1121 209 . 18.256 -17.352 -6.684 1.00 20.00 ? ? ? ? ? . 209 PRO A O 1121 ATOM 1395 C CB . PRO A 1121 209 . 20.768 -16.596 -4.933 1.00 20.00 ? ? ? ? ? . 209 PRO A CB 1121 ATOM 1396 C CG . PRO A 1121 209 . 20.764 -15.556 -3.835 1.00 20.00 ? ? ? ? ? . 209 PRO A CG 1121 ATOM 1397 C CD . PRO A 1121 209 . 20.941 -14.256 -4.543 1.00 20.00 ? ? ? ? ? . 209 PRO A CD 1121 ATOM 1398 N N . LEU A 1121 210 . 17.734 -15.439 -5.570 1.00 20.00 ? ? ? ? ? . 210 LEU A N 1121 ATOM 1399 C CA . LEU A 1121 210 . 16.283 -15.652 -5.571 1.00 20.00 ? ? ? ? ? . 210 LEU A CA 1121 ATOM 1400 C C . LEU A 1121 210 . 15.664 -14.742 -6.617 1.00 20.00 ? ? ? ? ? . 210 LEU A C 1121 ATOM 1401 O O . LEU A 1121 210 . 15.985 -13.565 -6.686 1.00 20.00 ? ? ? ? ? . 210 LEU A O 1121 ATOM 1402 C CB . LEU A 1121 210 . 15.676 -15.364 -4.205 1.00 20.00 ? ? ? ? ? . 210 LEU A CB 1121 ATOM 1403 C CG . LEU A 1121 210 . 16.270 -16.151 -3.036 1.00 20.00 ? ? ? ? ? . 210 LEU A CG 1121 ATOM 1404 C CD1 . LEU A 1121 210 . 15.633 -15.654 -1.755 1.00 20.00 ? ? ? ? ? . 210 LEU A CD1 1121 ATOM 1405 C CD2 . LEU A 1121 210 . 16.079 -17.660 -3.209 1.00 20.00 ? ? ? ? ? . 210 LEU A CD2 1121 ATOM 1406 N N . LYS A 1121 211 . 14.804 -15.333 -7.429 1.00 20.00 ? ? ? ? ? . 211 LYS A N 1121 ATOM 1407 C CA . LYS A 1121 211 . 14.189 -14.672 -8.573 1.00 20.00 ? ? ? ? ? . 211 LYS A CA 1121 ATOM 1408 C C . LYS A 1121 211 . 12.680 -14.696 -8.369 1.00 20.00 ? ? ? ? ? . 211 LYS A C 1121 ATOM 1409 O O . LYS A 1121 211 . 12.168 -15.553 -7.659 1.00 20.00 ? ? ? ? ? . 211 LYS A O 1121 ATOM 1410 C CB . LYS A 1121 211 . 14.543 -15.438 -9.850 1.00 20.00 ? ? ? ? ? . 211 LYS A CB 1121 ATOM 1411 C CG . LYS A 1121 211 . 16.024 -15.764 -10.001 1.00 20.00 ? ? ? ? ? . 211 LYS A CG 1121 ATOM 1412 C CD . LYS A 1121 211 . 16.854 -14.507 -10.181 1.00 20.00 ? ? ? ? ? . 211 LYS A CD 1121 ATOM 1413 C CE . LYS A 1121 211 . 18.297 -14.824 -10.570 1.00 20.00 ? ? ? ? ? . 211 LYS A CE 1121 ATOM 1414 N NZ . LYS A 1121 211 . 19.155 -13.607 -10.593 1.00 20.00 ? ? ? ? ? 1+ 211 LYS A NZ 1121 ATOM 1415 N N . ILE A 1121 212 . 11.968 -13.767 -8.988 1.00 20.00 ? ? ? ? ? . 212 ILE A N 1121 ATOM 1416 C CA . ILE A 1121 212 . 10.516 -13.808 -8.962 1.00 20.00 ? ? ? ? ? . 212 ILE A CA 1121 ATOM 1417 C C . ILE A 1121 212 . 10.054 -14.974 -9.823 1.00 20.00 ? ? ? ? ? . 212 ILE A C 1121 ATOM 1418 O O . ILE A 1121 212 . 10.384 -15.058 -11.020 1.00 20.00 ? ? ? ? ? . 212 ILE A O 1121 ATOM 1419 C CB . ILE A 1121 212 . 9.883 -12.508 -9.487 1.00 20.00 ? ? ? ? ? . 212 ILE A CB 1121 ATOM 1420 C CG1 . ILE A 1121 212 . 10.251 -11.326 -8.574 1.00 20.00 ? ? ? ? ? . 212 ILE A CG1 1121 ATOM 1421 C CG2 . ILE A 1121 212 . 8.368 -12.657 -9.598 1.00 20.00 ? ? ? ? ? . 212 ILE A CG2 1121 ATOM 1422 C CD1 . ILE A 1121 212 . 9.744 -9.971 -9.070 1.00 20.00 ? ? ? ? ? . 212 ILE A CD1 1121 ATOM 1423 N N . LEU A 1121 213 . 9.290 -15.868 -9.206 1.00 20.00 ? ? ? ? ? . 213 LEU A N 1121 ATOM 1424 C CA . LEU A 1121 213 . 8.832 -17.072 -9.880 1.00 20.00 ? ? ? ? ? . 213 LEU A CA 1121 ATOM 1425 C C . LEU A 1121 213 . 7.309 -17.144 -10.028 1.00 20.00 ? ? ? ? ? . 213 LEU A C 1121 ATOM 1426 O O . LEU A 1121 213 . 6.819 -17.816 -10.923 1.00 20.00 ? ? ? ? ? . 213 LEU A O 1121 ATOM 1427 C CB . LEU A 1121 213 . 9.360 -18.304 -9.145 1.00 20.00 ? ? ? ? ? . 213 LEU A CB 1121 ATOM 1428 C CG . LEU A 1121 213 . 10.882 -18.473 -9.126 1.00 20.00 ? ? ? ? ? . 213 LEU A CG 1121 ATOM 1429 C CD1 . LEU A 1121 213 . 11.303 -19.651 -8.242 1.00 20.00 ? ? ? ? ? . 213 LEU A CD1 1121 ATOM 1430 C CD2 . LEU A 1121 213 . 11.458 -18.613 -10.537 1.00 20.00 ? ? ? ? ? . 213 LEU A CD2 1121 ATOM 1431 N N . VAL A 1121 214 . 6.570 -16.474 -9.154 1.00 20.00 ? ? ? ? ? . 214 VAL A N 1121 ATOM 1432 C CA . VAL A 1121 214 . 5.119 -16.427 -9.244 1.00 20.00 ? ? ? ? ? . 214 VAL A CA 1121 ATOM 1433 C C . VAL A 1121 214 . 4.678 -14.984 -8.999 1.00 20.00 ? ? ? ? ? . 214 VAL A C 1121 ATOM 1434 O O . VAL A 1121 214 . 4.979 -14.414 -7.951 1.00 20.00 ? ? ? ? ? . 214 VAL A O 1121 ATOM 1435 C CB . VAL A 1121 214 . 4.456 -17.335 -8.168 1.00 20.00 ? ? ? ? ? . 214 VAL A CB 1121 ATOM 1436 C CG1 . VAL A 1121 214 . 2.932 -17.347 -8.307 1.00 20.00 ? ? ? ? ? . 214 VAL A CG1 1121 ATOM 1437 C CG2 . VAL A 1121 214 . 5.017 -18.743 -8.211 1.00 20.00 ? ? ? ? ? . 214 VAL A CG2 1121 ATOM 1438 N N . GLU A 1121 215 . 3.991 -14.397 -9.981 1.00 20.00 ? ? ? ? ? . 215 GLU A N 1121 ATOM 1439 C CA . GLU A 1121 215 . 3.501 -13.021 -9.885 1.00 20.00 ? ? ? ? ? . 215 GLU A CA 1121 ATOM 1440 C C . GLU A 1121 215 . 2.297 -12.861 -10.809 1.00 20.00 ? ? ? ? ? . 215 GLU A C 1121 ATOM 1441 O O . GLU A 1121 215 . 2.094 -13.675 -11.726 1.00 20.00 ? ? ? ? ? . 215 GLU A O 1121 ATOM 1442 C CB . GLU A 1121 215 . 4.608 -12.031 -10.288 1.00 20.00 ? ? ? ? ? . 215 GLU A CB 1121 ATOM 1443 C CG . GLU A 1121 215 . 5.069 -12.178 -11.740 1.00 20.00 ? ? ? ? ? . 215 GLU A CG 1121 ATOM 1444 C CD . GLU A 1121 215 . 6.187 -11.215 -12.131 1.00 20.00 ? ? ? ? ? . 215 GLU A CD 1121 ATOM 1445 O OE1 . GLU A 1121 215 . 6.280 -10.117 -11.563 1.00 20.00 ? ? ? ? ? . 215 GLU A OE1 1121 ATOM 1446 O OE2 . GLU A 1121 215 . 6.991 -11.570 -13.021 1.00 20.00 ? ? ? ? ? 1- 215 GLU A OE2 1121 ATOM 1447 N N . GLY A 1121 216 . 1.499 -11.823 -10.569 1.00 20.00 ? ? ? ? ? . 216 GLY A N 1121 ATOM 1448 C CA . GLY A 1121 216 . 0.440 -11.432 -11.482 1.00 20.00 ? ? ? ? ? . 216 GLY A CA 1121 ATOM 1449 C C . GLY A 1121 216 . -0.946 -11.912 -11.104 1.00 20.00 ? ? ? ? ? . 216 GLY A C 1121 ATOM 1450 O O . GLY A 1121 216 . -1.943 -11.382 -11.589 1.00 20.00 ? ? ? ? ? . 216 GLY A O 1121 ATOM 1451 N N . ASP A 1121 217 . -1.013 -12.912 -10.235 1.00 20.00 ? ? ? ? ? . 217 ASP A N 1121 ATOM 1452 C CA . ASP A 1121 217 . -2.283 -13.445 -9.780 1.00 20.00 ? ? ? ? ? . 217 ASP A CA 1121 ATOM 1453 C C . ASP A 1121 217 . -3.043 -12.382 -9.021 1.00 20.00 ? ? ? ? ? . 217 ASP A C 1121 ATOM 1454 O O . ASP A 1121 217 . -2.465 -11.671 -8.216 1.00 20.00 ? ? ? ? ? . 217 ASP A O 1121 ATOM 1455 C CB . ASP A 1121 217 . -2.036 -14.601 -8.823 1.00 20.00 ? ? ? ? ? . 217 ASP A CB 1121 ATOM 1456 C CG . ASP A 1121 217 . -1.151 -15.643 -9.404 1.00 20.00 ? ? ? ? ? . 217 ASP A CG 1121 ATOM 1457 O OD1 . ASP A 1121 217 . 0.041 -15.347 -9.647 1.00 20.00 ? ? ? ? ? . 217 ASP A OD1 1121 ATOM 1458 O OD2 . ASP A 1121 217 . -1.643 -16.769 -9.588 1.00 20.00 ? ? ? ? ? 1- 217 ASP A OD2 1121 ATOM 1459 N N . LYS A 1121 218 . -4.344 -12.294 -9.251 1.00 20.00 ? ? ? ? ? . 218 LYS A N 1121 ATOM 1460 C CA . LYS A 1121 218 . -5.172 -11.294 -8.583 1.00 20.00 ? ? ? ? ? . 218 LYS A CA 1121 ATOM 1461 C C . LYS A 1121 218 . -5.104 -11.383 -7.063 1.00 20.00 ? ? ? ? ? . 218 LYS A C 1121 ATOM 1462 O O . LYS A 1121 218 . -5.144 -10.360 -6.369 1.00 20.00 ? ? ? ? ? . 218 LYS A O 1121 ATOM 1463 C CB . LYS A 1121 218 . -6.628 -11.446 -9.023 1.00 20.00 ? ? ? ? ? . 218 LYS A CB 1121 ATOM 1464 C CG . LYS A 1121 218 . -7.568 -10.447 -8.383 1.00 20.00 ? ? ? ? ? . 218 LYS A CG 1121 ATOM 1465 C CD . LYS A 1121 218 . -8.949 -10.557 -8.984 1.00 20.00 ? ? ? ? ? . 218 LYS A CD 1121 ATOM 1466 C CE . LYS A 1121 218 . -9.883 -9.487 -8.447 1.00 20.00 ? ? ? ? ? . 218 LYS A CE 1121 ATOM 1467 N NZ . LYS A 1121 218 . -11.314 -9.846 -8.685 1.00 20.00 ? ? ? ? ? 1+ 218 LYS A NZ 1121 ATOM 1468 N N . ILE A 1121 219 . -4.996 -12.606 -6.552 1.00 20.00 ? ? ? ? ? . 219 ILE A N 1121 ATOM 1469 C CA . ILE A 1121 219 . -4.952 -12.826 -5.121 1.00 20.00 ? ? ? ? ? . 219 ILE A CA 1121 ATOM 1470 C C . ILE A 1121 219 . -3.735 -12.165 -4.487 1.00 20.00 ? ? ? ? ? . 219 ILE A C 1121 ATOM 1471 O O . ILE A 1121 219 . -3.721 -11.934 -3.289 1.00 20.00 ? ? ? ? ? . 219 ILE A O 1121 ATOM 1472 C CB . ILE A 1121 219 . -4.982 -14.335 -4.777 1.00 20.00 ? ? ? ? ? . 219 ILE A CB 1121 ATOM 1473 C CG1 . ILE A 1121 219 . -5.321 -14.546 -3.300 1.00 20.00 ? ? ? ? ? . 219 ILE A CG1 1121 ATOM 1474 C CG2 . ILE A 1121 219 . -3.657 -15.015 -5.133 1.00 20.00 ? ? ? ? ? . 219 ILE A CG2 1121 ATOM 1475 C CD1 . ILE A 1121 219 . -5.675 -15.990 -2.963 1.00 20.00 ? ? ? ? ? . 219 ILE A CD1 1121 ATOM 1476 N N . LEU A 1121 220 . -2.725 -11.855 -5.290 1.00 20.00 ? ? ? ? ? . 220 LEU A N 1121 ATOM 1477 C CA . LEU A 1121 220 . -1.517 -11.214 -4.792 1.00 20.00 ? ? ? ? ? . 220 LEU A CA 1121 ATOM 1478 C C . LEU A 1121 220 . -1.588 -9.681 -4.783 1.00 20.00 ? ? ? ? ? . 220 LEU A C 1121 ATOM 1479 O O . LEU A 1121 220 . -0.640 -9.021 -4.366 1.00 20.00 ? ? ? ? ? . 220 LEU A O 1121 ATOM 1480 C CB . LEU A 1121 220 . -0.309 -11.651 -5.620 1.00 20.00 ? ? ? ? ? . 220 LEU A CB 1121 ATOM 1481 C CG . LEU A 1121 220 . 0.069 -13.133 -5.549 1.00 20.00 ? ? ? ? ? . 220 LEU A CG 1121 ATOM 1482 C CD1 . LEU A 1121 220 . 1.092 -13.458 -6.630 1.00 20.00 ? ? ? ? ? . 220 LEU A CD1 1121 ATOM 1483 C CD2 . LEU A 1121 220 . 0.586 -13.486 -4.168 1.00 20.00 ? ? ? ? ? . 220 LEU A CD2 1121 ATOM 1484 N N . PHE A 1121 221 . -2.693 -9.110 -5.256 1.00 20.00 ? ? ? ? ? . 221 PHE A N 1121 ATOM 1485 C CA . PHE A 1121 221 . -2.856 -7.647 -5.223 1.00 20.00 ? ? ? ? ? . 221 PHE A CA 1121 ATOM 1486 C C . PHE A 1121 221 . -3.046 -7.153 -3.809 1.00 20.00 ? ? ? ? ? . 221 PHE A C 1121 ATOM 1487 O O . PHE A 1121 221 . -3.704 -7.801 -2.998 1.00 20.00 ? ? ? ? ? . 221 PHE A O 1121 ATOM 1488 C CB . PHE A 1121 221 . -4.054 -7.194 -6.043 1.00 20.00 ? ? ? ? ? . 221 PHE A CB 1121 ATOM 1489 C CG . PHE A 1121 221 . -3.940 -7.480 -7.515 1.00 20.00 ? ? ? ? ? . 221 PHE A CG 1121 ATOM 1490 C CD1 . PHE A 1121 221 . -2.766 -7.987 -8.066 1.00 20.00 ? ? ? ? ? . 221 PHE A CD1 1121 ATOM 1491 C CD2 . PHE A 1121 221 . -5.017 -7.226 -8.354 1.00 20.00 ? ? ? ? ? . 221 PHE A CD2 1121 ATOM 1492 C CE1 . PHE A 1121 221 . -2.673 -8.238 -9.433 1.00 20.00 ? ? ? ? ? . 221 PHE A CE1 1121 ATOM 1493 C CE2 . PHE A 1121 221 . -4.934 -7.484 -9.712 1.00 20.00 ? ? ? ? ? . 221 PHE A CE2 1121 ATOM 1494 C CZ . PHE A 1121 221 . -3.760 -7.992 -10.252 1.00 20.00 ? ? ? ? ? . 221 PHE A CZ 1121 ATOM 1495 N N . ASN A 1121 222 . -2.441 -6.013 -3.535 1.00 20.00 ? ? ? ? ? . 222 ASN A N 1121 ATOM 1496 C CA . ASN A 1121 222 . -2.586 -5.299 -2.279 1.00 20.00 ? ? ? ? ? . 222 ASN A CA 1121 ATOM 1497 C C . ASN A 1121 222 . -3.305 -3.977 -2.551 1.00 20.00 ? ? ? ? ? . 222 ASN A C 1121 ATOM 1498 O O . ASN A 1121 222 . -2.676 -2.956 -2.835 1.00 20.00 ? ? ? ? ? . 222 ASN A O 1121 ATOM 1499 C CB . ASN A 1121 222 . -1.206 -5.056 -1.678 1.00 20.00 ? ? ? ? ? . 222 ASN A CB 1121 ATOM 1500 C CG . ASN A 1121 222 . -1.261 -4.499 -0.265 1.00 20.00 ? ? ? ? ? . 222 ASN A CG 1121 ATOM 1501 N ND2 . ASN A 1121 222 . -0.408 -3.524 0.009 1.00 20.00 ? ? ? ? ? . 222 ASN A ND2 1121 ATOM 1502 O OD1 . ASN A 1121 222 . -2.038 -4.959 0.579 1.00 20.00 ? ? ? ? ? . 222 ASN A OD1 1121 ATOM 1503 N N . GLN A 1121 223 . -4.626 -4.016 -2.479 1.00 20.00 ? ? ? ? ? . 223 GLN A N 1121 ATOM 1504 C CA . GLN A 1121 223 . -5.467 -2.893 -2.863 1.00 20.00 ? ? ? ? ? . 223 GLN A CA 1121 ATOM 1505 C C . GLN A 1121 223 . -5.436 -1.762 -1.838 1.00 20.00 ? ? ? ? ? . 223 GLN A C 1121 ATOM 1506 O O . GLN A 1121 223 . -5.749 -1.974 -0.672 1.00 20.00 ? ? ? ? ? . 223 GLN A O 1121 ATOM 1507 C CB . GLN A 1121 223 . -6.918 -3.336 -3.031 1.00 20.00 ? ? ? ? ? . 223 GLN A CB 1121 ATOM 1508 C CG . GLN A 1121 223 . -7.856 -2.249 -3.528 1.00 20.00 ? ? ? ? ? . 223 GLN A CG 1121 ATOM 1509 C CD . GLN A 1121 223 . -7.520 -1.788 -4.923 1.00 20.00 ? ? ? ? ? . 223 GLN A CD 1121 ATOM 1510 N NE2 . GLN A 1121 223 . -7.311 -0.500 -5.084 1.00 20.00 ? ? ? ? ? . 223 GLN A NE2 1121 ATOM 1511 O OE1 . GLN A 1121 223 . -7.413 -2.595 -5.849 1.00 20.00 ? ? ? ? ? . 223 GLN A OE1 1121 ATOM 1512 N N . TYR A 1121 224 . -5.130 -0.550 -2.313 1.00 20.00 ? ? ? ? ? . 224 TYR A N 1121 ATOM 1513 C CA . TYR A 1121 224 . -5.241 0.646 -1.510 1.00 20.00 ? ? ? ? ? . 224 TYR A CA 1121 ATOM 1514 C C . TYR A 1121 224 . -6.548 1.357 -1.713 1.00 20.00 ? ? ? ? ? . 224 TYR A C 1121 ATOM 1515 O O . TYR A 1121 224 . -7.008 1.503 -2.849 1.00 20.00 ? ? ? ? ? . 224 TYR A O 1121 ATOM 1516 C CB . TYR A 1121 224 . -4.165 1.647 -1.902 1.00 20.00 ? ? ? ? ? . 224 TYR A CB 1121 ATOM 1517 C CG . TYR A 1121 224 . -2.864 1.411 -1.222 1.00 20.00 ? ? ? ? ? . 224 TYR A CG 1121 ATOM 1518 C CD1 . TYR A 1121 224 . -2.005 0.401 -1.633 1.00 20.00 ? ? ? ? ? . 224 TYR A CD1 1121 ATOM 1519 C CD2 . TYR A 1121 224 . -2.486 2.199 -0.165 1.00 20.00 ? ? ? ? ? . 224 TYR A CD2 1121 ATOM 1520 C CE1 . TYR A 1121 224 . -0.801 0.189 -0.979 1.00 20.00 ? ? ? ? ? . 224 TYR A CE1 1121 ATOM 1521 C CE2 . TYR A 1121 224 . -1.304 2.002 0.476 1.00 20.00 ? ? ? ? ? . 224 TYR A CE2 1121 ATOM 1522 C CZ . TYR A 1121 224 . -0.461 1.002 0.067 1.00 20.00 ? ? ? ? ? . 224 TYR A CZ 1121 ATOM 1523 O OH . TYR A 1121 224 . 0.721 0.839 0.727 1.00 20.00 ? ? ? ? ? . 224 TYR A OH 1121 ATOM 1524 N N . SER A 1121 225 . -7.073 1.883 -0.615 1.00 20.00 ? ? ? ? ? . 225 SER A N 1121 ATOM 1525 C CA . SER A 1121 225 . -8.218 2.759 -0.636 1.00 20.00 ? ? ? ? ? . 225 SER A CA 1121 ATOM 1526 C C . SER A 1121 225 . -8.015 3.961 0.274 1.00 20.00 ? ? ? ? ? . 225 SER A C 1121 ATOM 1527 O O . SER A 1121 225 . -7.341 3.867 1.291 1.00 20.00 ? ? ? ? ? . 225 SER A O 1121 ATOM 1528 C CB . SER A 1121 225 . -9.455 2.016 -0.172 1.00 20.00 ? ? ? ? ? . 225 SER A CB 1121 ATOM 1529 O OG . SER A 1121 225 . -9.740 0.936 -1.023 1.00 20.00 ? ? ? ? ? . 225 SER A OG 1121 ATOM 1530 N N . ALA A 1121 226 . -8.640 5.076 -0.092 1.00 20.00 ? ? ? ? ? . 226 ALA A N 1121 ATOM 1531 C CA . ALA A 1121 226 . -8.709 6.227 0.787 1.00 20.00 ? ? ? ? ? . 226 ALA A CA 1121 ATOM 1532 C C . ALA A 1121 226 . -10.082 6.220 1.432 1.00 20.00 ? ? ? ? ? . 226 ALA A C 1121 ATOM 1533 O O . ALA A 1121 226 . -11.084 5.859 0.802 1.00 20.00 ? ? ? ? ? . 226 ALA A O 1121 ATOM 1534 C CB . ALA A 1121 226 . -8.463 7.546 0.010 1.00 20.00 ? ? ? ? ? . 226 ALA A CB 1121 ATOM 1535 N N . ILE A 1121 227 . -10.131 6.626 2.690 1.00 20.00 ? ? ? ? ? . 227 ILE A N 1121 ATOM 1536 C CA . ILE A 1121 227 . -11.382 6.691 3.444 1.00 20.00 ? ? ? ? ? . 227 ILE A CA 1121 ATOM 1537 C C . ILE A 1121 227 . -11.413 7.983 4.263 1.00 20.00 ? ? ? ? ? . 227 ILE A C 1121 ATOM 1538 O O . ILE A 1121 227 . -10.704 8.116 5.266 1.00 20.00 ? ? ? ? ? . 227 ILE A O 1121 ATOM 1539 C CB . ILE A 1121 227 . -11.518 5.501 4.419 1.00 20.00 ? ? ? ? ? . 227 ILE A CB 1121 ATOM 1540 C CG1 . ILE A 1121 227 . -11.351 4.163 3.679 1.00 20.00 ? ? ? ? ? . 227 ILE A CG1 1121 ATOM 1541 C CG2 . ILE A 1121 227 . -12.849 5.562 5.155 1.00 20.00 ? ? ? ? ? . 227 ILE A CG2 1121 ATOM 1542 C CD1 . ILE A 1121 227 . -11.228 2.972 4.598 1.00 20.00 ? ? ? ? ? . 227 ILE A CD1 1121 ATOM 1543 N N . PRO A 1121 228 . -12.240 8.942 3.839 1.00 20.00 ? ? ? ? ? . 228 PRO A N 1121 ATOM 1544 C CA . PRO A 1121 228 . -12.487 10.127 4.663 1.00 20.00 ? ? ? ? ? . 228 PRO A CA 1121 ATOM 1545 C C . PRO A 1121 228 . -13.109 9.717 5.997 1.00 20.00 ? ? ? ? ? . 228 PRO A C 1121 ATOM 1546 O O . PRO A 1121 228 . -14.012 8.881 6.033 1.00 20.00 ? ? ? ? ? . 228 PRO A O 1121 ATOM 1547 C CB . PRO A 1121 228 . -13.467 10.951 3.811 1.00 20.00 ? ? ? ? ? . 228 PRO A CB 1121 ATOM 1548 C CG . PRO A 1121 228 . -13.194 10.519 2.396 1.00 20.00 ? ? ? ? ? . 228 PRO A CG 1121 ATOM 1549 C CD . PRO A 1121 228 . -12.884 9.038 2.519 1.00 20.00 ? ? ? ? ? . 228 PRO A CD 1121 ATOM 1550 N N . VAL A 1121 229 . -12.611 10.297 7.083 1.00 20.00 ? ? ? ? ? . 229 VAL A N 1121 ATOM 1551 C CA . VAL A 1121 229 . -13.230 10.129 8.387 1.00 20.00 ? ? ? ? ? . 229 VAL A CA 1121 ATOM 1552 C C . VAL A 1121 229 . -14.594 10.836 8.375 1.00 20.00 ? ? ? ? ? . 229 VAL A C 1121 ATOM 1553 O O . VAL A 1121 229 . -14.748 11.894 7.802 1.00 20.00 ? ? ? ? ? . 229 VAL A O 1121 ATOM 1554 C CB . VAL A 1121 229 . -12.301 10.635 9.506 1.00 20.00 ? ? ? ? ? . 229 VAL A CB 1121 ATOM 1555 C CG1 . VAL A 1121 229 . -12.985 10.593 10.891 1.00 20.00 ? ? ? ? ? . 229 VAL A CG1 1121 ATOM 1556 C CG2 . VAL A 1121 229 . -11.043 9.783 9.541 1.00 20.00 ? ? ? ? ? . 229 VAL A CG2 1121 ATOM 1557 N N . ASN A 1121 230 . -15.582 10.202 8.979 1.00 20.00 ? ? ? ? ? . 230 ASN A N 1121 ATOM 1558 C CA . ASN A 1121 230 . -16.970 10.627 8.888 1.00 20.00 ? ? ? ? ? . 230 ASN A CA 1121 ATOM 1559 C C . ASN A 1121 230 . -17.280 11.771 9.840 1.00 20.00 ? ? ? ? ? . 230 ASN A C 1121 ATOM 1560 O O . ASN A 1121 230 . -17.099 11.621 11.040 1.00 20.00 ? ? ? ? ? . 230 ASN A O 1121 ATOM 1561 C CB . ASN A 1121 230 . -17.876 9.439 9.222 1.00 20.00 ? ? ? ? ? . 230 ASN A CB 1121 ATOM 1562 C CG . ASN A 1121 230 . -19.292 9.650 8.750 1.00 20.00 ? ? ? ? ? . 230 ASN A CG 1121 ATOM 1563 N ND2 . ASN A 1121 230 . -19.942 8.566 8.339 1.00 20.00 ? ? ? ? ? . 230 ASN A ND2 1121 ATOM 1564 O OD1 . ASN A 1121 230 . -19.790 10.776 8.724 1.00 20.00 ? ? ? ? ? . 230 ASN A OD1 1121 ATOM 1565 N N . PRO A 1121 231 . -17.760 12.915 9.318 1.00 20.00 ? ? ? ? ? . 231 PRO A N 1121 ATOM 1566 C CA . PRO A 1121 231 . -18.114 14.052 10.184 1.00 20.00 ? ? ? ? ? . 231 PRO A CA 1121 ATOM 1567 C C . PRO A 1121 231 . -19.202 13.737 11.220 1.00 20.00 ? ? ? ? ? . 231 PRO A C 1121 ATOM 1568 O O . PRO A 1121 231 . -19.283 14.410 12.255 1.00 20.00 ? ? ? ? ? . 231 PRO A O 1121 ATOM 1569 C CB . PRO A 1121 231 . -18.614 15.108 9.188 1.00 20.00 ? ? ? ? ? . 231 PRO A CB 1121 ATOM 1570 C CG . PRO A 1121 231 . -18.017 14.744 7.904 1.00 20.00 ? ? ? ? ? . 231 PRO A CG 1121 ATOM 1571 C CD . PRO A 1121 231 . -17.894 13.256 7.893 1.00 20.00 ? ? ? ? ? . 231 PRO A CD 1121 ATOM 1572 N N . ALA A 1121 232 . -20.025 12.727 10.962 1.00 20.00 ? ? ? ? ? . 232 ALA A N 1121 ATOM 1573 C CA . ALA A 1121 232 . -21.027 12.320 11.954 1.00 20.00 ? ? ? ? ? . 232 ALA A CA 1121 ATOM 1574 C C . ALA A 1121 232 . -20.374 11.712 13.196 1.00 20.00 ? ? ? ? ? . 232 ALA A C 1121 ATOM 1575 O O . ALA A 1121 232 . -20.953 11.739 14.290 1.00 20.00 ? ? ? ? ? . 232 ALA A O 1121 ATOM 1576 C CB . ALA A 1121 232 . -22.021 11.354 11.345 1.00 20.00 ? ? ? ? ? . 232 ALA A CB 1121 ATOM 1577 N N . HIS A 1121 233 . -19.161 11.190 13.044 1.00 20.00 ? ? ? ? ? . 233 HIS A N 1121 ATOM 1578 C CA . HIS A 1121 233 . -18.436 10.624 14.168 1.00 20.00 ? ? ? ? ? . 233 HIS A CA 1121 ATOM 1579 C C . HIS A 1121 233 . -17.441 11.607 14.717 1.00 20.00 ? ? ? ? ? . 233 HIS A C 1121 ATOM 1580 O O . HIS A 1121 233 . -17.163 11.629 15.936 1.00 20.00 ? ? ? ? ? . 233 HIS A O 1121 ATOM 1581 C CB . HIS A 1121 233 . -17.723 9.345 13.747 1.00 20.00 ? ? ? ? ? . 233 HIS A CB 1121 ATOM 1582 C CG . HIS A 1121 233 . -16.971 8.669 14.869 1.00 20.00 ? ? ? ? ? . 233 HIS A CG 1121 ATOM 1583 C CD2 . HIS A 1121 233 . -15.604 8.539 15.107 1.00 20.00 ? ? ? ? ? . 233 HIS A CD2 1121 ATOM 1584 N ND1 . HIS A 1121 233 . -17.595 8.043 15.883 1.00 20.00 ? ? ? ? ? . 233 HIS A ND1 1121 ATOM 1585 C CE1 . HIS A 1121 233 . -16.677 7.537 16.729 1.00 20.00 ? ? ? ? ? . 233 HIS A CE1 1121 ATOM 1586 N NE2 . HIS A 1121 233 . -15.459 7.842 16.253 1.00 20.00 ? ? ? ? ? . 233 HIS A NE2 1121 ATOM 1587 N N . CYS A 1121 234 . -16.892 12.428 13.830 1.00 20.00 ? ? ? ? ? . 234 CYS A N 1121 ATOM 1588 C CA . CYS A 1121 234 . -15.884 13.427 14.189 1.00 20.00 ? ? ? ? ? . 234 CYS A CA 1121 ATOM 1589 C C . CYS A 1121 234 . -16.301 14.782 13.616 1.00 20.00 ? ? ? ? ? . 234 CYS A C 1121 ATOM 1590 O O . CYS A 1121 234 . -15.919 15.129 12.504 1.00 20.00 ? ? ? ? ? . 234 CYS A O 1121 ATOM 1591 C CB . CYS A 1121 234 . -14.529 13.013 13.605 1.00 20.00 ? ? ? ? ? . 234 CYS A CB 1121 ATOM 1592 S SG . CYS A 1121 234 . -13.901 11.398 14.132 1.00 20.00 ? ? ? ? ? . 234 CYS A SG 1121 ATOM 1593 N N . PRO A 1121 235 . -17.081 15.568 14.377 1.00 20.00 ? ? ? ? ? . 235 PRO A N 1121 ATOM 1594 C CA . PRO A 1121 235 . -17.706 16.748 13.763 1.00 20.00 ? ? ? ? ? . 235 PRO A CA 1121 ATOM 1595 C C . PRO A 1121 235 . -16.739 17.814 13.271 1.00 20.00 ? ? ? ? ? . 235 PRO A C 1121 ATOM 1596 O O . PRO A 1121 235 . -17.135 18.591 12.398 1.00 20.00 ? ? ? ? ? . 235 PRO A O 1121 ATOM 1597 C CB . PRO A 1121 235 . -18.577 17.308 14.892 1.00 20.00 ? ? ? ? ? . 235 PRO A CB 1121 ATOM 1598 C CG . PRO A 1121 235 . -18.848 16.140 15.759 1.00 20.00 ? ? ? ? ? . 235 PRO A CG 1121 ATOM 1599 C CD . PRO A 1121 235 . -17.615 15.301 15.721 1.00 20.00 ? ? ? ? ? . 235 PRO A CD 1121 ATOM 1600 N N . LYS A 1121 236 . -15.510 17.854 13.786 1.00 20.00 ? ? ? ? ? . 236 LYS A N 1121 ATOM 1601 C CA . LYS A 1121 236 . -14.562 18.897 13.396 1.00 20.00 ? ? ? ? ? . 236 LYS A CA 1121 ATOM 1602 C C . LYS A 1121 236 . -13.597 18.428 12.302 1.00 20.00 ? ? ? ? ? . 236 LYS A C 1121 ATOM 1603 O O . LYS A 1121 236 . -12.629 19.110 11.974 1.00 20.00 ? ? ? ? ? . 236 LYS A O 1121 ATOM 1604 C CB . LYS A 1121 236 . -13.786 19.388 14.625 1.00 20.00 ? ? ? ? ? . 236 LYS A CB 1121 ATOM 1605 C CG . LYS A 1121 236 . -14.655 20.151 15.655 1.00 20.00 ? ? ? ? ? . 236 LYS A CG 1121 ATOM 1606 C CD . LYS A 1121 236 . -13.786 20.952 16.621 1.00 20.00 ? ? ? ? ? . 236 LYS A CD 1121 ATOM 1607 C CE . LYS A 1121 236 . -14.570 21.974 17.435 1.00 20.00 ? ? ? ? ? . 236 LYS A CE 1121 ATOM 1608 N NZ . LYS A 1121 236 . -13.649 22.919 18.169 1.00 20.00 ? ? ? ? ? 1+ 236 LYS A NZ 1121 ATOM 1609 N N . VAL A 1121 237 . -13.849 17.246 11.751 1.00 20.00 ? ? ? ? ? . 237 VAL A N 1121 ATOM 1610 C CA . VAL A 1121 237 . -12.958 16.690 10.742 1.00 20.00 ? ? ? ? ? . 237 VAL A CA 1121 ATOM 1611 C C . VAL A 1121 237 . -12.958 17.584 9.499 1.00 20.00 ? ? ? ? ? . 237 VAL A C 1121 ATOM 1612 O O . VAL A 1121 237 . -13.966 18.231 9.189 1.00 20.00 ? ? ? ? ? . 237 VAL A O 1121 ATOM 1613 C CB . VAL A 1121 237 . -13.365 15.242 10.385 1.00 20.00 ? ? ? ? ? . 237 VAL A CB 1121 ATOM 1614 C CG1 . VAL A 1121 237 . -14.596 15.210 9.480 1.00 20.00 ? ? ? ? ? . 237 VAL A CG1 1121 ATOM 1615 C CG2 . VAL A 1121 237 . -12.241 14.524 9.749 1.00 20.00 ? ? ? ? ? . 237 VAL A CG2 1121 ATOM 1616 N N . LYS A 1121 238 . -11.818 17.641 8.816 1.00 20.00 ? ? ? ? ? . 238 LYS A N 1121 ATOM 1617 C CA . LYS A 1121 238 . -11.686 18.464 7.617 1.00 20.00 ? ? ? ? ? . 238 LYS A CA 1121 ATOM 1618 C C . LYS A 1121 238 . -12.139 17.680 6.387 1.00 20.00 ? ? ? ? ? . 238 LYS A C 1121 ATOM 1619 O O . LYS A 1121 238 . -11.336 17.263 5.547 1.00 20.00 ? ? ? ? ? . 238 LYS A O 1121 ATOM 1620 C CB . LYS A 1121 238 . -10.242 18.957 7.476 1.00 20.00 ? ? ? ? ? . 238 LYS A CB 1121 ATOM 1621 C CG . LYS A 1121 238 . -9.807 19.924 8.566 1.00 20.00 ? ? ? ? ? . 238 LYS A CG 1121 ATOM 1622 C CD . LYS A 1121 238 . -10.620 21.217 8.510 1.00 20.00 ? ? ? ? ? . 238 LYS A CD 1121 ATOM 1623 C CE . LYS A 1121 238 . -9.968 22.354 9.294 1.00 20.00 ? ? ? ? ? . 238 LYS A CE 1121 ATOM 1624 N NZ . LYS A 1121 238 . -10.724 23.633 9.144 1.00 20.00 ? ? ? ? ? 1+ 238 LYS A NZ 1121 ATOM 1625 N N . LYS A 1121 239 . -13.447 17.467 6.308 1.00 20.00 ? ? ? ? ? . 239 LYS A N 1121 ATOM 1626 C CA . LYS A 1121 239 . -14.046 16.631 5.274 1.00 20.00 ? ? ? ? ? . 239 LYS A CA 1121 ATOM 1627 C C . LYS A 1121 239 . -13.812 17.167 3.879 1.00 20.00 ? ? ? ? ? . 239 LYS A C 1121 ATOM 1628 O O . LYS A 1121 239 . -13.541 16.398 2.956 1.00 20.00 ? ? ? ? ? . 239 LYS A O 1121 ATOM 1629 C CB . LYS A 1121 239 . -15.547 16.475 5.520 1.00 20.00 ? ? ? ? ? . 239 LYS A CB 1121 ATOM 1630 C CG . LYS A 1121 239 . -16.290 15.680 4.453 1.00 20.00 ? ? ? ? ? . 239 LYS A CG 1121 ATOM 1631 C CD . LYS A 1121 239 . -15.753 14.259 4.337 1.00 20.00 ? ? ? ? ? . 239 LYS A CD 1121 ATOM 1632 C CE . LYS A 1121 239 . -16.805 13.292 3.838 1.00 20.00 ? ? ? ? ? . 239 LYS A CE 1121 ATOM 1633 N NZ . LYS A 1121 239 . -17.354 13.654 2.502 1.00 20.00 ? ? ? ? ? 1+ 239 LYS A NZ 1121 ATOM 1634 N N . ASP A 1121 240 . -13.949 18.480 3.703 1.00 20.00 ? ? ? ? ? . 240 ASP A N 1121 ATOM 1635 C CA . ASP A 1121 240 . -13.735 19.061 2.391 1.00 20.00 ? ? ? ? ? . 240 ASP A CA 1121 ATOM 1636 C C . ASP A 1121 240 . -12.302 18.838 1.898 1.00 20.00 ? ? ? ? ? . 240 ASP A C 1121 ATOM 1637 O O . ASP A 1121 240 . -12.079 18.557 0.719 1.00 20.00 ? ? ? ? ? . 240 ASP A O 1121 ATOM 1638 C CB . ASP A 1121 240 . -14.062 20.552 2.411 1.00 20.00 ? ? ? ? ? . 240 ASP A CB 1121 ATOM 1639 C CG . ASP A 1121 240 . -15.540 20.816 2.553 1.00 20.00 ? ? ? ? ? . 240 ASP A CG 1121 ATOM 1640 O OD1 . ASP A 1121 240 . -16.348 19.918 2.209 1.00 20.00 ? ? ? ? ? . 240 ASP A OD1 1121 ATOM 1641 O OD2 . ASP A 1121 240 . -15.891 21.929 2.996 1.00 20.00 ? ? ? ? ? 1- 240 ASP A OD2 1121 ATOM 1642 N N . LEU A 1121 241 . -11.329 18.948 2.801 1.00 20.00 ? ? ? ? ? . 241 LEU A N 1121 ATOM 1643 C CA . LEU A 1121 241 . -9.933 18.710 2.413 1.00 20.00 ? ? ? ? ? . 241 LEU A CA 1121 ATOM 1644 C C . LEU A 1121 241 . -9.734 17.239 2.064 1.00 20.00 ? ? ? ? ? . 241 LEU A C 1121 ATOM 1645 O O . LEU A 1121 241 . -9.011 16.911 1.117 1.00 20.00 ? ? ? ? ? . 241 LEU A O 1121 ATOM 1646 C CB . LEU A 1121 241 . -8.965 19.097 3.516 1.00 20.00 ? ? ? ? ? . 241 LEU A CB 1121 ATOM 1647 C CG . LEU A 1121 241 . -8.965 20.550 3.986 1.00 20.00 ? ? ? ? ? . 241 LEU A CG 1121 ATOM 1648 C CD1 . LEU A 1121 241 . -7.858 20.799 4.985 1.00 20.00 ? ? ? ? ? . 241 LEU A CD1 1121 ATOM 1649 C CD2 . LEU A 1121 241 . -8.882 21.528 2.815 1.00 20.00 ? ? ? ? ? . 241 LEU A CD2 1121 ATOM 1650 N N . ALA A 1121 242 . -10.337 16.355 2.857 1.00 20.00 ? ? ? ? ? . 242 ALA A N 1121 ATOM 1651 C CA . ALA A 1121 242 . -10.199 14.918 2.625 1.00 20.00 ? ? ? ? ? . 242 ALA A CA 1121 ATOM 1652 C C . ALA A 1121 242 . -10.789 14.574 1.261 1.00 20.00 ? ? ? ? ? . 242 ALA A C 1121 ATOM 1653 O O . ALA A 1121 242 . -10.170 13.857 0.468 1.00 20.00 ? ? ? ? ? . 242 ALA A O 1121 ATOM 1654 C CB . ALA A 1121 242 . -10.890 14.144 3.717 1.00 20.00 ? ? ? ? ? . 242 ALA A CB 1121 ATOM 1655 N N . ASP A 1121 243 . -11.983 15.089 0.980 1.00 20.00 ? ? ? ? ? . 243 ASP A N 1121 ATOM 1656 C CA . ASP A 1121 243 . -12.608 14.864 -0.314 1.00 20.00 ? ? ? ? ? . 243 ASP A CA 1121 ATOM 1657 C C . ASP A 1121 243 . -11.724 15.379 -1.453 1.00 20.00 ? ? ? ? ? . 243 ASP A C 1121 ATOM 1658 O O . ASP A 1121 243 . -11.636 14.754 -2.484 1.00 20.00 ? ? ? ? ? . 243 ASP A O 1121 ATOM 1659 C CB . ASP A 1121 243 . -13.977 15.551 -0.393 1.00 20.00 ? ? ? ? ? . 243 ASP A CB 1121 ATOM 1660 C CG . ASP A 1121 243 . -15.044 14.853 0.427 1.00 20.00 ? ? ? ? ? . 243 ASP A CG 1121 ATOM 1661 O OD1 . ASP A 1121 243 . -14.818 13.690 0.859 1.00 20.00 ? ? ? ? ? . 243 ASP A OD1 1121 ATOM 1662 O OD2 . ASP A 1121 243 . -16.117 15.486 0.629 1.00 20.00 ? ? ? ? ? 1- 243 ASP A OD2 1121 ATOM 1663 N N . LYS A 1121 244 . -11.065 16.514 -1.255 1.00 20.00 ? ? ? ? ? . 244 LYS A N 1121 ATOM 1664 C CA . LYS A 1121 244 . -10.180 17.062 -2.275 1.00 20.00 ? ? ? ? ? . 244 LYS A CA 1121 ATOM 1665 C C . LYS A 1121 244 . -9.010 16.128 -2.569 1.00 20.00 ? ? ? ? ? . 244 LYS A C 1121 ATOM 1666 O O . LYS A 1121 244 . -8.619 15.965 -3.721 1.00 20.00 ? ? ? ? ? . 244 LYS A O 1121 ATOM 1667 C CB . LYS A 1121 244 . -9.668 18.432 -1.849 1.00 20.00 ? ? ? ? ? . 244 LYS A CB 1121 ATOM 1668 C CG . LYS A 1121 244 . -8.909 19.212 -2.904 1.00 20.00 ? ? ? ? ? . 244 LYS A CG 1121 ATOM 1669 C CD . LYS A 1121 244 . -9.773 19.641 -4.097 1.00 20.00 ? ? ? ? ? . 244 LYS A CD 1121 ATOM 1670 C CE . LYS A 1121 244 . -10.951 20.569 -3.732 1.00 20.00 ? ? ? ? ? . 244 LYS A CE 1121 ATOM 1671 N NZ . LYS A 1121 244 . -10.563 21.923 -3.198 1.00 20.00 ? ? ? ? ? 1+ 244 LYS A NZ 1121 ATOM 1672 N N . PHE A 1121 245 . -8.445 15.525 -1.530 1.00 20.00 ? ? ? ? ? . 245 PHE A N 1121 ATOM 1673 C CA . PHE A 1121 245 . -7.383 14.545 -1.722 1.00 20.00 ? ? ? ? ? . 245 PHE A CA 1121 ATOM 1674 C C . PHE A 1121 245 . -7.875 13.340 -2.518 1.00 20.00 ? ? ? ? ? . 245 PHE A C 1121 ATOM 1675 O O . PHE A 1121 245 . -7.175 12.867 -3.406 1.00 20.00 ? ? ? ? ? . 245 PHE A O 1121 ATOM 1676 C CB . PHE A 1121 245 . -6.782 14.100 -0.373 1.00 20.00 ? ? ? ? ? . 245 PHE A CB 1121 ATOM 1677 C CG . PHE A 1121 245 . -5.666 13.127 -0.513 1.00 20.00 ? ? ? ? ? . 245 PHE A CG 1121 ATOM 1678 C CD1 . PHE A 1121 245 . -4.410 13.553 -0.909 1.00 20.00 ? ? ? ? ? . 245 PHE A CD1 1121 ATOM 1679 C CD2 . PHE A 1121 245 . -5.878 11.790 -0.270 1.00 20.00 ? ? ? ? ? . 245 PHE A CD2 1121 ATOM 1680 C CE1 . PHE A 1121 245 . -3.374 12.653 -1.048 1.00 20.00 ? ? ? ? ? . 245 PHE A CE1 1121 ATOM 1681 C CE2 . PHE A 1121 245 . -4.829 10.871 -0.391 1.00 20.00 ? ? ? ? ? . 245 PHE A CE2 1121 ATOM 1682 C CZ . PHE A 1121 245 . -3.589 11.300 -0.791 1.00 20.00 ? ? ? ? ? . 245 PHE A CZ 1121 ATOM 1683 N N . VAL A 1121 246 . -9.052 12.814 -2.174 1.00 20.00 ? ? ? ? ? . 246 VAL A N 1121 ATOM 1684 C CA . VAL A 1121 246 . -9.614 11.683 -2.927 1.00 20.00 ? ? ? ? ? . 246 VAL A CA 1121 ATOM 1685 C C . VAL A 1121 246 . -9.811 12.051 -4.387 1.00 20.00 ? ? ? ? ? . 246 VAL A C 1121 ATOM 1686 O O . VAL A 1121 246 . -9.442 11.308 -5.282 1.00 20.00 ? ? ? ? ? . 246 VAL A O 1121 ATOM 1687 C CB . VAL A 1121 246 . -10.932 11.168 -2.279 1.00 20.00 ? ? ? ? ? . 246 VAL A CB 1121 ATOM 1688 C CG1 . VAL A 1121 246 . -11.553 10.050 -3.076 1.00 20.00 ? ? ? ? ? . 246 VAL A CG1 1121 ATOM 1689 C CG2 . VAL A 1121 246 . -10.679 10.729 -0.866 1.00 20.00 ? ? ? ? ? . 246 VAL A CG2 1121 ATOM 1690 N N . ASN A 1121 247 . -10.359 13.227 -4.609 1.00 20.00 ? ? ? ? ? . 247 ASN A N 1121 ATOM 1691 C CA . ASN A 1121 247 . -10.635 13.700 -5.943 1.00 20.00 ? ? ? ? ? . 247 ASN A CA 1121 ATOM 1692 C C . ASN A 1121 247 . -9.318 13.805 -6.730 1.00 20.00 ? ? ? ? ? . 247 ASN A C 1121 ATOM 1693 O O . ASN A 1121 247 . -9.217 13.369 -7.862 1.00 20.00 ? ? ? ? ? . 247 ASN A O 1121 ATOM 1694 C CB . ASN A 1121 247 . -11.337 15.055 -5.844 1.00 20.00 ? ? ? ? ? . 247 ASN A CB 1121 ATOM 1695 C CG . ASN A 1121 247 . -11.630 15.651 -7.189 1.00 20.00 ? ? ? ? ? . 247 ASN A CG 1121 ATOM 1696 N ND2 . ASN A 1121 247 . -12.832 15.423 -7.683 1.00 20.00 ? ? ? ? ? . 247 ASN A ND2 1121 ATOM 1697 O OD1 . ASN A 1121 247 . -10.781 16.304 -7.785 1.00 20.00 ? ? ? ? ? . 247 ASN A OD1 1121 ATOM 1698 N N . TRP A 1121 248 . -8.294 14.344 -6.079 1.00 20.00 ? ? ? ? ? . 248 TRP A N 1121 ATOM 1699 C CA . TRP A 1121 248 . -6.986 14.471 -6.690 1.00 20.00 ? ? ? ? ? . 248 TRP A CA 1121 ATOM 1700 C C . TRP A 1121 248 . -6.381 13.137 -7.035 1.00 20.00 ? ? ? ? ? . 248 TRP A C 1121 ATOM 1701 O O . TRP A 1121 248 . -5.849 12.952 -8.151 1.00 20.00 ? ? ? ? ? . 248 TRP A O 1121 ATOM 1702 C CB . TRP A 1121 248 . -6.047 15.236 -5.765 1.00 20.00 ? ? ? ? ? . 248 TRP A CB 1121 ATOM 1703 C CG . TRP A 1121 248 . -4.681 15.479 -6.358 1.00 20.00 ? ? ? ? ? . 248 TRP A CG 1121 ATOM 1704 C CD1 . TRP A 1121 248 . -4.334 16.396 -7.347 1.00 20.00 ? ? ? ? ? . 248 TRP A CD1 1121 ATOM 1705 C CD2 . TRP A 1121 248 . -3.424 14.797 -6.017 1.00 20.00 ? ? ? ? ? . 248 TRP A CD2 1121 ATOM 1706 C CE2 . TRP A 1121 248 . -2.390 15.391 -6.867 1.00 20.00 ? ? ? ? ? . 248 TRP A CE2 1121 ATOM 1707 C CE3 . TRP A 1121 248 . -3.067 13.794 -5.128 1.00 20.00 ? ? ? ? ? . 248 TRP A CE3 1121 ATOM 1708 N NE1 . TRP A 1121 248 . -2.992 16.329 -7.630 1.00 20.00 ? ? ? ? ? . 248 TRP A NE1 1121 ATOM 1709 C CZ2 . TRP A 1121 248 . -1.070 14.982 -6.810 1.00 20.00 ? ? ? ? ? . 248 TRP A CZ2 1121 ATOM 1710 C CZ3 . TRP A 1121 248 . -1.731 13.391 -5.080 1.00 20.00 ? ? ? ? ? . 248 TRP A CZ3 1121 ATOM 1711 C CH2 . TRP A 1121 248 . -0.759 13.971 -5.903 1.00 20.00 ? ? ? ? ? . 248 TRP A CH2 1121 ATOM 1712 N N . MET A 1121 249 . -6.436 12.191 -6.100 1.00 20.00 ? ? ? ? ? . 249 MET A N 1121 ATOM 1713 C CA . MET A 1121 249 . -5.788 10.903 -6.286 1.00 20.00 ? ? ? ? ? . 249 MET A CA 1121 ATOM 1714 C C . MET A 1121 249 . -6.458 10.113 -7.385 1.00 20.00 ? ? ? ? ? . 249 MET A C 1121 ATOM 1715 O O . MET A 1121 249 . -5.804 9.312 -8.056 1.00 20.00 ? ? ? ? ? . 249 MET A O 1121 ATOM 1716 C CB . MET A 1121 249 . -5.844 10.055 -5.005 1.00 20.00 ? ? ? ? ? . 249 MET A CB 1121 ATOM 1717 C CG . MET A 1121 249 . -4.909 10.511 -3.905 1.00 20.00 ? ? ? ? ? . 249 MET A CG 1121 ATOM 1718 S SD . MET A 1121 249 . -3.189 10.153 -4.290 1.00 20.00 ? ? ? ? ? . 249 MET A SD 1121 ATOM 1719 C CE . MET A 1121 249 . -3.167 8.401 -3.838 1.00 20.00 ? ? ? ? ? . 249 MET A CE 1121 ATOM 1720 N N . ALA A 1121 250 . -7.771 10.281 -7.526 1.00 20.00 ? ? ? ? ? . 250 ALA A N 1121 ATOM 1721 C CA . ALA A 1121 250 . -8.543 9.505 -8.520 1.00 20.00 ? ? ? ? ? . 250 ALA A CA 1121 ATOM 1722 C C . ALA A 1121 250 . -8.536 10.137 -9.911 1.00 20.00 ? ? ? ? ? . 250 ALA A C 1121 ATOM 1723 O O . ALA A 1121 250 . -9.028 9.545 -10.864 1.00 20.00 ? ? ? ? ? . 250 ALA A O 1121 ATOM 1724 C CB . ALA A 1121 250 . -9.999 9.353 -8.051 1.00 20.00 ? ? ? ? ? . 250 ALA A CB 1121 ATOM 1725 N N . SER A 1121 251 . -7.994 11.341 -10.017 1.00 20.00 ? ? ? ? ? . 251 SER A N 1121 ATOM 1726 C CA . SER A 1121 251 . -7.953 12.053 -11.287 1.00 20.00 ? ? ? ? ? . 251 SER A CA 1121 ATOM 1727 C C . SER A 1121 251 . -7.068 11.296 -12.270 1.00 20.00 ? ? ? ? ? . 251 SER A C 1121 ATOM 1728 O O . SER A 1121 251 . -6.075 10.658 -11.871 1.00 20.00 ? ? ? ? ? . 251 SER A O 1121 ATOM 1729 C CB . SER A 1121 251 . -7.424 13.472 -11.087 1.00 20.00 ? ? ? ? ? . 251 SER A CB 1121 ATOM 1730 O OG . SER A 1121 251 . -6.024 13.485 -10.850 1.00 20.00 ? ? ? ? ? . 251 SER A OG 1121 ATOM 1731 N N . PRO A 1121 252 . -7.430 11.337 -13.557 1.00 20.00 ? ? ? ? ? . 252 PRO A N 1121 ATOM 1732 C CA . PRO A 1121 252 . -6.589 10.684 -14.562 1.00 20.00 ? ? ? ? ? . 252 PRO A CA 1121 ATOM 1733 C C . PRO A 1121 252 . -5.114 11.071 -14.462 1.00 20.00 ? ? ? ? ? . 252 PRO A C 1121 ATOM 1734 O O . PRO A 1121 252 . -4.255 10.206 -14.586 1.00 20.00 ? ? ? ? ? . 252 PRO A O 1121 ATOM 1735 C CB . PRO A 1121 252 . -7.194 11.171 -15.876 1.00 20.00 ? ? ? ? ? . 252 PRO A CB 1121 ATOM 1736 C CG . PRO A 1121 252 . -8.656 11.361 -15.553 1.00 20.00 ? ? ? ? ? . 252 PRO A CG 1121 ATOM 1737 C CD . PRO A 1121 252 . -8.691 11.844 -14.131 1.00 20.00 ? ? ? ? ? . 252 PRO A CD 1121 ATOM 1738 N N . ALA A 1121 253 . -4.815 12.345 -14.240 1.00 20.00 ? ? ? ? ? . 253 ALA A N 1121 ATOM 1739 C CA . ALA A 1121 253 . -3.421 12.778 -14.211 1.00 20.00 ? ? ? ? ? . 253 ALA A CA 1121 ATOM 1740 C C . ALA A 1121 253 . -2.678 12.181 -13.014 1.00 20.00 ? ? ? ? ? . 253 ALA A C 1121 ATOM 1741 O O . ALA A 1121 253 . -1.543 11.744 -13.147 1.00 20.00 ? ? ? ? ? . 253 ALA A O 1121 ATOM 1742 C CB . ALA A 1121 253 . -3.326 14.311 -14.202 1.00 20.00 ? ? ? ? ? . 253 ALA A CB 1121 ATOM 1743 N N . THR A 1121 254 . -3.301 12.165 -11.835 1.00 20.00 ? ? ? ? ? . 254 THR A N 1121 ATOM 1744 C CA . THR A 1121 254 . -2.615 11.606 -10.680 1.00 20.00 ? ? ? ? ? . 254 THR A CA 1121 ATOM 1745 C C . THR A 1121 254 . -2.528 10.082 -10.767 1.00 20.00 ? ? ? ? ? . 254 THR A C 1121 ATOM 1746 O O . THR A 1121 254 . -1.545 9.509 -10.358 1.00 20.00 ? ? ? ? ? . 254 THR A O 1121 ATOM 1747 C CB . THR A 1121 254 . -3.266 12.039 -9.374 1.00 20.00 ? ? ? ? ? . 254 THR A CB 1121 ATOM 1748 C CG2 . THR A 1121 254 . -2.493 11.498 -8.183 1.00 20.00 ? ? ? ? ? . 254 THR A CG2 1121 ATOM 1749 O OG1 . THR A 1121 254 . -3.269 13.473 -9.321 1.00 20.00 ? ? ? ? ? . 254 THR A OG1 1121 ATOM 1750 N N . GLN A 1121 255 . -3.560 9.447 -11.307 1.00 20.00 ? ? ? ? ? . 255 GLN A N 1121 ATOM 1751 C CA . GLN A 1121 255 . -3.505 8.024 -11.588 1.00 20.00 ? ? ? ? ? . 255 GLN A CA 1121 ATOM 1752 C C . GLN A 1121 255 . -2.302 7.686 -12.464 1.00 20.00 ? ? ? ? ? . 255 GLN A C 1121 ATOM 1753 O O . GLN A 1121 255 . -1.597 6.718 -12.195 1.00 20.00 ? ? ? ? ? . 255 GLN A O 1121 ATOM 1754 C CB . GLN A 1121 255 . -4.815 7.563 -12.216 1.00 20.00 ? ? ? ? ? . 255 GLN A CB 1121 ATOM 1755 C CG . GLN A 1121 255 . -5.994 7.590 -11.243 1.00 20.00 ? ? ? ? ? . 255 GLN A CG 1121 ATOM 1756 C CD . GLN A 1121 255 . -6.049 6.344 -10.368 1.00 20.00 ? ? ? ? ? . 255 GLN A CD 1121 ATOM 1757 N NE2 . GLN A 1121 255 . -5.807 6.507 -9.064 1.00 20.00 ? ? ? ? ? . 255 GLN A NE2 1121 ATOM 1758 O OE1 . GLN A 1121 255 . -6.291 5.238 -10.866 1.00 20.00 ? ? ? ? ? . 255 GLN A OE1 1121 ATOM 1759 N N . LYS A 1121 256 . -2.046 8.495 -13.489 1.00 20.00 ? ? ? ? ? . 256 LYS A N 1121 ATOM 1760 C CA . LYS A 1121 256 . -0.900 8.271 -14.357 1.00 20.00 ? ? ? ? ? . 256 LYS A CA 1121 ATOM 1761 C C . LYS A 1121 256 . 0.382 8.444 -13.550 1.00 20.00 ? ? ? ? ? . 256 LYS A C 1121 ATOM 1762 O O . LYS A 1121 256 . 1.325 7.672 -13.703 1.00 20.00 ? ? ? ? ? . 256 LYS A O 1121 ATOM 1763 C CB . LYS A 1121 256 . -0.923 9.230 -15.562 1.00 20.00 ? ? ? ? ? . 256 LYS A CB 1121 ATOM 1764 C CG . LYS A 1121 256 . 0.225 9.042 -16.518 1.00 20.00 ? ? ? ? ? . 256 LYS A CG 1121 ATOM 1765 C CD . LYS A 1121 256 . 0.114 7.714 -17.269 1.00 20.00 ? ? ? ? ? . 256 LYS A CD 1121 ATOM 1766 C CE . LYS A 1121 256 . 1.319 7.470 -18.180 1.00 20.00 ? ? ? ? ? . 256 LYS A CE 1121 ATOM 1767 N NZ . LYS A 1121 256 . 1.860 8.732 -18.777 1.00 20.00 ? ? ? ? ? 1+ 256 LYS A NZ 1121 ATOM 1768 N N . THR A 1121 257 . 0.420 9.457 -12.695 1.00 20.00 ? ? ? ? ? . 257 THR A N 1121 ATOM 1769 C CA . THR A 1121 257 . 1.589 9.708 -11.857 1.00 20.00 ? ? ? ? ? . 257 THR A CA 1121 ATOM 1770 C C . THR A 1121 257 . 1.854 8.494 -10.960 1.00 20.00 ? ? ? ? ? . 257 THR A C 1121 ATOM 1771 O O . THR A 1121 257 . 3.011 8.090 -10.756 1.00 20.00 ? ? ? ? ? . 257 THR A O 1121 ATOM 1772 C CB . THR A 1121 257 . 1.380 10.961 -10.965 1.00 20.00 ? ? ? ? ? . 257 THR A CB 1121 ATOM 1773 C CG2 . THR A 1121 257 . 2.557 11.182 -10.020 1.00 20.00 ? ? ? ? ? . 257 THR A CG2 1121 ATOM 1774 O OG1 . THR A 1121 257 . 1.205 12.124 -11.790 1.00 20.00 ? ? ? ? ? . 257 THR A OG1 1121 ATOM 1775 N N . ILE A 1121 258 . 0.792 7.916 -10.398 1.00 20.00 ? ? ? ? ? . 258 ILE A N 1121 ATOM 1776 C CA . ILE A 1121 258 . 0.952 6.739 -9.544 1.00 20.00 ? ? ? ? ? . 258 ILE A CA 1121 ATOM 1777 C C . ILE A 1121 258 . 1.526 5.582 -10.361 1.00 20.00 ? ? ? ? ? . 258 ILE A C 1121 ATOM 1778 O O . ILE A 1121 258 . 2.468 4.915 -9.929 1.00 20.00 ? ? ? ? ? . 258 ILE A O 1121 ATOM 1779 C CB . ILE A 1121 258 . -0.385 6.358 -8.908 1.00 20.00 ? ? ? ? ? . 258 ILE A CB 1121 ATOM 1780 C CG1 . ILE A 1121 258 . -0.782 7.455 -7.915 1.00 20.00 ? ? ? ? ? . 258 ILE A CG1 1121 ATOM 1781 C CG2 . ILE A 1121 258 . -0.310 4.991 -8.202 1.00 20.00 ? ? ? ? ? . 258 ILE A CG2 1121 ATOM 1782 C CD1 . ILE A 1121 258 . -2.181 7.354 -7.397 1.00 20.00 ? ? ? ? ? . 258 ILE A CD1 1121 ATOM 1783 N N . GLY A 1121 259 . 0.993 5.363 -11.553 1.00 20.00 ? ? ? ? ? . 259 GLY A N 1121 ATOM 1784 C CA . GLY A 1121 259 . 1.450 4.270 -12.390 1.00 20.00 ? ? ? ? ? . 259 GLY A CA 1121 ATOM 1785 C C . GLY A 1121 259 . 2.888 4.446 -12.853 1.00 20.00 ? ? ? ? ? . 259 GLY A C 1121 ATOM 1786 O O . GLY A 1121 259 . 3.620 3.470 -13.079 1.00 20.00 ? ? ? ? ? . 259 GLY A O 1121 ATOM 1787 N N . ASP A 1121 260 . 3.298 5.703 -13.010 1.00 20.00 ? ? ? ? ? . 260 ASP A N 1121 ATOM 1788 C CA . ASP A 1121 260 . 4.655 6.018 -13.431 1.00 20.00 ? ? ? ? ? . 260 ASP A CA 1121 ATOM 1789 C C . ASP A 1121 260 . 5.659 6.079 -12.291 1.00 20.00 ? ? ? ? ? . 260 ASP A C 1121 ATOM 1790 O O . ASP A 1121 260 . 6.855 6.197 -12.543 1.00 20.00 ? ? ? ? ? . 260 ASP A O 1121 ATOM 1791 C CB . ASP A 1121 260 . 4.665 7.347 -14.184 1.00 20.00 ? ? ? ? ? . 260 ASP A CB 1121 ATOM 1792 C CG . ASP A 1121 260 . 3.980 7.257 -15.540 1.00 20.00 ? ? ? ? ? . 260 ASP A CG 1121 ATOM 1793 O OD1 . ASP A 1121 260 . 3.784 6.134 -16.052 1.00 20.00 ? ? ? ? ? . 260 ASP A OD1 1121 ATOM 1794 O OD2 . ASP A 1121 260 . 3.645 8.315 -16.101 1.00 20.00 ? ? ? ? ? 1- 260 ASP A OD2 1121 ATOM 1795 N N . PHE A 1121 261 . 5.194 5.954 -11.048 1.00 20.00 ? ? ? ? ? . 261 PHE A N 1121 ATOM 1796 C CA . PHE A 1121 261 . 6.099 5.959 -9.899 1.00 20.00 ? ? ? ? ? . 261 PHE A CA 1121 ATOM 1797 C C . PHE A 1121 261 . 7.042 4.773 -10.012 1.00 20.00 ? ? ? ? ? . 261 PHE A C 1121 ATOM 1798 O O . PHE A 1121 261 . 6.625 3.654 -10.358 1.00 20.00 ? ? ? ? ? . 261 PHE A O 1121 ATOM 1799 C CB . PHE A 1121 261 . 5.325 5.893 -8.573 1.00 20.00 ? ? ? ? ? . 261 PHE A CB 1121 ATOM 1800 C CG . PHE A 1121 261 . 6.214 5.886 -7.354 1.00 20.00 ? ? ? ? ? . 261 PHE A CG 1121 ATOM 1801 C CD1 . PHE A 1121 261 . 6.794 7.053 -6.894 1.00 20.00 ? ? ? ? ? . 261 PHE A CD1 1121 ATOM 1802 C CD2 . PHE A 1121 261 . 6.474 4.709 -6.670 1.00 20.00 ? ? ? ? ? . 261 PHE A CD2 1121 ATOM 1803 C CE1 . PHE A 1121 261 . 7.618 7.050 -5.779 1.00 20.00 ? ? ? ? ? . 261 PHE A CE1 1121 ATOM 1804 C CE2 . PHE A 1121 261 . 7.309 4.707 -5.554 1.00 20.00 ? ? ? ? ? . 261 PHE A CE2 1121 ATOM 1805 C CZ . PHE A 1121 261 . 7.867 5.878 -5.112 1.00 20.00 ? ? ? ? ? . 261 PHE A CZ 1121 ATOM 1806 N N . LYS A 1121 262 . 8.315 5.029 -9.747 1.00 20.00 ? ? ? ? ? . 262 LYS A N 1121 ATOM 1807 C CA . LYS A 1121 262 . 9.343 3.990 -9.767 1.00 20.00 ? ? ? ? ? . 262 LYS A CA 1121 ATOM 1808 C C . LYS A 1121 262 . 10.039 3.874 -8.426 1.00 20.00 ? ? ? ? ? . 262 LYS A C 1121 ATOM 1809 O O . LYS A 1121 262 . 10.331 4.879 -7.765 1.00 20.00 ? ? ? ? ? . 262 LYS A O 1121 ATOM 1810 C CB . LYS A 1121 262 . 10.431 4.309 -10.795 1.00 20.00 ? ? ? ? ? . 262 LYS A CB 1121 ATOM 1811 C CG . LYS A 1121 262 . 9.956 4.626 -12.203 1.00 20.00 ? ? ? ? ? . 262 LYS A CG 1121 ATOM 1812 C CD . LYS A 1121 262 . 9.404 3.399 -12.869 1.00 20.00 ? ? ? ? ? . 262 LYS A CD 1121 ATOM 1813 C CE . LYS A 1121 262 . 9.003 3.706 -14.292 1.00 20.00 ? ? ? ? ? . 262 LYS A CE 1121 ATOM 1814 N NZ . LYS A 1121 262 . 8.232 2.606 -14.901 1.00 20.00 ? ? ? ? ? 1+ 262 LYS A NZ 1121 ATOM 1815 N N . LEU A 1121 263 . 10.328 2.633 -8.055 1.00 20.00 ? ? ? ? ? . 263 LEU A N 1121 ATOM 1816 C CA . LEU A 1121 263 . 11.234 2.315 -6.964 1.00 20.00 ? ? ? ? ? . 263 LEU A CA 1121 ATOM 1817 C C . LEU A 1121 263 . 12.472 1.699 -7.596 1.00 20.00 ? ? ? ? ? . 263 LEU A C 1121 ATOM 1818 O O . LEU A 1121 263 . 12.387 0.659 -8.242 1.00 20.00 ? ? ? ? ? . 263 LEU A O 1121 ATOM 1819 C CB . LEU A 1121 263 . 10.584 1.312 -6.001 1.00 20.00 ? ? ? ? ? . 263 LEU A CB 1121 ATOM 1820 C CG . LEU A 1121 263 . 11.472 0.891 -4.829 1.00 20.00 ? ? ? ? ? . 263 LEU A CG 1121 ATOM 1821 C CD1 . LEU A 1121 263 . 11.717 2.073 -3.889 1.00 20.00 ? ? ? ? ? . 263 LEU A CD1 1121 ATOM 1822 C CD2 . LEU A 1121 263 . 10.871 -0.290 -4.077 1.00 20.00 ? ? ? ? ? . 263 LEU A CD2 1121 ATOM 1823 N N . MET A 1121 264 . 13.606 2.378 -7.452 1.00 20.00 ? ? ? ? ? . 264 MET A N 1121 ATOM 1824 C CA . MET A 1121 264 . 14.848 1.982 -8.102 1.00 20.00 ? ? ? ? ? . 264 MET A CA 1121 ATOM 1825 C C . MET A 1121 264 . 14.632 1.624 -9.569 1.00 20.00 ? ? ? ? ? . 264 MET A C 1121 ATOM 1826 O O . MET A 1121 264 . 15.124 0.615 -10.065 1.00 20.00 ? ? ? ? ? . 264 MET A O 1121 ATOM 1827 C CB . MET A 1121 264 . 15.510 0.856 -7.333 1.00 20.00 ? ? ? ? ? . 264 MET A CB 1121 ATOM 1828 C CG . MET A 1121 264 . 15.753 1.268 -5.910 1.00 20.00 ? ? ? ? ? . 264 MET A CG 1121 ATOM 1829 S SD . MET A 1121 264 . 16.474 -0.010 -4.912 1.00 20.00 ? ? ? ? ? . 264 MET A SD 1121 ATOM 1830 C CE . MET A 1121 264 . 16.751 0.939 -3.421 1.00 20.00 ? ? ? ? ? . 264 MET A CE 1121 ATOM 1831 N N . GLY A 1121 265 . 13.883 2.478 -10.261 1.00 20.00 ? ? ? ? ? . 265 GLY A N 1121 ATOM 1832 C CA . GLY A 1121 265 . 13.700 2.326 -11.686 1.00 20.00 ? ? ? ? ? . 265 GLY A CA 1121 ATOM 1833 C C . GLY A 1121 265 . 12.610 1.368 -12.108 1.00 20.00 ? ? ? ? ? . 265 GLY A C 1121 ATOM 1834 O O . GLY A 1121 265 . 12.403 1.185 -13.302 1.00 20.00 ? ? ? ? ? . 265 GLY A O 1121 ATOM 1835 N N . LYS A 1121 266 . 11.916 0.765 -11.148 1.00 20.00 ? ? ? ? ? . 266 LYS A N 1121 ATOM 1836 C CA . LYS A 1121 266 . 10.947 -0.279 -11.445 1.00 20.00 ? ? ? ? ? . 266 LYS A CA 1121 ATOM 1837 C C . LYS A 1121 266 . 9.554 0.069 -10.949 1.00 20.00 ? ? ? ? ? . 266 LYS A C 1121 ATOM 1838 O O . LYS A 1121 266 . 9.373 0.707 -9.913 1.00 20.00 ? ? ? ? ? . 266 LYS A O 1121 ATOM 1839 C CB . LYS A 1121 266 . 11.416 -1.621 -10.857 1.00 20.00 ? ? ? ? ? . 266 LYS A CB 1121 ATOM 1840 C CG . LYS A 1121 266 . 12.713 -2.115 -11.506 1.00 20.00 ? ? ? ? ? . 266 LYS A CG 1121 ATOM 1841 C CD . LYS A 1121 266 . 12.984 -3.591 -11.268 1.00 20.00 ? ? ? ? ? . 266 LYS A CD 1121 ATOM 1842 C CE . LYS A 1121 266 . 14.219 -4.061 -12.037 1.00 20.00 ? ? ? ? ? . 266 LYS A CE 1121 ATOM 1843 N NZ . LYS A 1121 266 . 14.516 -5.519 -11.894 1.00 20.00 ? ? ? ? ? 1+ 266 LYS A NZ 1121 ATOM 1844 N N . ALA A 1121 267 . 8.563 -0.394 -11.698 1.00 20.00 ? ? ? ? ? . 267 ALA A N 1121 ATOM 1845 C CA . ALA A 1121 267 . 7.164 -0.157 -11.383 1.00 20.00 ? ? ? ? ? . 267 ALA A CA 1121 ATOM 1846 C C . ALA A 1121 267 . 6.782 -0.802 -10.049 1.00 20.00 ? ? ? ? ? . 267 ALA A C 1121 ATOM 1847 O O . ALA A 1121 267 . 7.309 -1.854 -9.686 1.00 20.00 ? ? ? ? ? . 267 ALA A O 1121 ATOM 1848 C CB . ALA A 1121 267 . 6.306 -0.723 -12.494 1.00 20.00 ? ? ? ? ? . 267 ALA A CB 1121 ATOM 1849 N N . LEU A 1121 268 . 5.858 -0.174 -9.335 1.00 20.00 ? ? ? ? ? . 268 LEU A N 1121 ATOM 1850 C CA . LEU A 1121 268 . 5.435 -0.666 -8.029 1.00 20.00 ? ? ? ? ? . 268 LEU A CA 1121 ATOM 1851 C C . LEU A 1121 268 . 3.912 -0.664 -7.876 1.00 20.00 ? ? ? ? ? . 268 LEU A C 1121 ATOM 1852 O O . LEU A 1121 268 . 3.337 -1.615 -7.338 1.00 20.00 ? ? ? ? ? . 268 LEU A O 1121 ATOM 1853 C CB . LEU A 1121 268 . 6.099 0.172 -6.936 1.00 20.00 ? ? ? ? ? . 268 LEU A CB 1121 ATOM 1854 C CG . LEU A 1121 268 . 6.141 -0.401 -5.525 1.00 20.00 ? ? ? ? ? . 268 LEU A CG 1121 ATOM 1855 C CD1 . LEU A 1121 268 . 6.979 -1.663 -5.484 1.00 20.00 ? ? ? ? ? . 268 LEU A CD1 1121 ATOM 1856 C CD2 . LEU A 1121 268 . 6.712 0.597 -4.553 1.00 20.00 ? ? ? ? ? . 268 LEU A CD2 1121 ATOM 1857 N N . PHE A 1121 269 . 3.260 0.409 -8.322 1.00 20.00 ? ? ? ? ? . 269 PHE A N 1121 ATOM 1858 C CA . PHE A 1121 269 . 1.810 0.548 -8.184 1.00 20.00 ? ? ? ? ? . 269 PHE A CA 1121 ATOM 1859 C C . PHE A 1121 269 . 1.087 0.552 -9.517 1.00 20.00 ? ? ? ? ? . 269 PHE A C 1121 ATOM 1860 O O . PHE A 1121 269 . 1.546 1.171 -10.473 1.00 20.00 ? ? ? ? ? . 269 PHE A O 1121 ATOM 1861 C CB . PHE A 1121 269 . 1.464 1.867 -7.500 1.00 20.00 ? ? ? ? ? . 269 PHE A CB 1121 ATOM 1862 C CG . PHE A 1121 269 . 1.966 1.985 -6.093 1.00 20.00 ? ? ? ? ? . 269 PHE A CG 1121 ATOM 1863 C CD1 . PHE A 1121 269 . 1.227 1.485 -5.024 1.00 20.00 ? ? ? ? ? . 269 PHE A CD1 1121 ATOM 1864 C CD2 . PHE A 1121 269 . 3.182 2.600 -5.833 1.00 20.00 ? ? ? ? ? . 269 PHE A CD2 1121 ATOM 1865 C CE1 . PHE A 1121 269 . 1.704 1.606 -3.724 1.00 20.00 ? ? ? ? ? . 269 PHE A CE1 1121 ATOM 1866 C CE2 . PHE A 1121 269 . 3.650 2.724 -4.542 1.00 20.00 ? ? ? ? ? . 269 PHE A CE2 1121 ATOM 1867 C CZ . PHE A 1121 269 . 2.923 2.222 -3.492 1.00 20.00 ? ? ? ? ? . 269 PHE A CZ 1121 ATOM 1868 N N . THR A 1121 270 . -0.064 -0.104 -9.549 1.00 20.00 ? ? ? ? ? . 270 THR A N 1121 ATOM 1869 C CA . THR A 1121 270 . -0.967 -0.060 -10.682 1.00 20.00 ? ? ? ? ? . 270 THR A CA 1121 ATOM 1870 C C . THR A 1121 270 . -2.188 0.756 -10.273 1.00 20.00 ? ? ? ? ? . 270 THR A C 1121 ATOM 1871 O O . THR A 1121 270 . -2.903 0.387 -9.345 1.00 20.00 ? ? ? ? ? . 270 THR A O 1121 ATOM 1872 C CB . THR A 1121 270 . -1.406 -1.487 -11.087 1.00 20.00 ? ? ? ? ? . 270 THR A CB 1121 ATOM 1873 C CG2 . THR A 1121 270 . -2.343 -1.455 -12.283 1.00 20.00 ? ? ? ? ? . 270 THR A CG2 1121 ATOM 1874 O OG1 . THR A 1121 270 . -0.254 -2.265 -11.417 1.00 20.00 ? ? ? ? ? . 270 THR A OG1 1121 ATOM 1875 N N . PRO A 1121 271 . -2.428 1.894 -10.948 1.00 20.00 ? ? ? ? ? . 271 PRO A N 1121 ATOM 1876 C CA . PRO A 1121 271 . -3.624 2.689 -10.646 1.00 20.00 ? ? ? ? ? . 271 PRO A CA 1121 ATOM 1877 C C . PRO A 1121 271 . -4.876 1.954 -11.071 1.00 20.00 ? ? ? ? ? . 271 PRO A C 1121 ATOM 1878 O O . PRO A 1121 271 . -4.863 1.280 -12.101 1.00 20.00 ? ? ? ? ? . 271 PRO A O 1121 ATOM 1879 C CB . PRO A 1121 271 . -3.431 3.949 -11.493 1.00 20.00 ? ? ? ? ? . 271 PRO A CB 1121 ATOM 1880 C CG . PRO A 1121 271 . -2.554 3.551 -12.577 1.00 20.00 ? ? ? ? ? . 271 PRO A CG 1121 ATOM 1881 C CD . PRO A 1121 271 . -1.661 2.453 -12.075 1.00 20.00 ? ? ? ? ? . 271 PRO A CD 1121 ATOM 1882 N N . ASN A 1121 272 . -5.936 2.061 -10.287 1.00 20.00 ? ? ? ? ? . 272 ASN A N 1121 ATOM 1883 C CA . ASN A 1121 272 . -7.165 1.378 -10.631 1.00 20.00 ? ? ? ? ? . 272 ASN A CA 1121 ATOM 1884 C C . ASN A 1121 272 . -8.410 2.035 -10.066 1.00 20.00 ? ? ? ? ? . 272 ASN A C 1121 ATOM 1885 O O . ASN A 1121 272 . -9.393 1.360 -9.788 1.00 20.00 ? ? ? ? ? . 272 ASN A O 1121 ATOM 1886 C CB . ASN A 1121 272 . -7.076 -0.130 -10.287 1.00 20.00 ? ? ? ? ? . 272 ASN A CB 1121 ATOM 1887 C CG . ASN A 1121 272 . -7.208 -0.429 -8.795 1.00 20.00 ? ? ? ? ? . 272 ASN A CG 1121 ATOM 1888 N ND2 . ASN A 1121 272 . -7.640 -1.651 -8.491 1.00 20.00 ? ? ? ? ? . 272 ASN A ND2 1121 ATOM 1889 O OD1 . ASN A 1121 272 . -6.908 0.406 -7.931 1.00 20.00 ? ? ? ? ? . 272 ASN A OD1 1121 ATOM 1890 N N . ALA A 1121 273 . -8.381 3.360 -9.918 1.00 20.00 ? ? ? ? ? . 273 ALA A N 1121 ATOM 1891 C CA . ALA A 1121 273 . -9.573 4.082 -9.510 1.00 20.00 ? ? ? ? ? . 273 ALA A CA 1121 ATOM 1892 C C . ALA A 1121 273 . -10.684 3.816 -10.525 1.00 20.00 ? ? ? ? ? . 273 ALA A C 1121 ATOM 1893 O O . ALA A 1121 273 . -10.426 3.704 -11.726 1.00 20.00 ? ? ? ? ? . 273 ALA A O 1121 ATOM 1894 C CB . ALA A 1121 273 . -9.285 5.581 -9.395 1.00 20.00 ? ? ? ? ? . 273 ALA A CB 1121 ATOM 1895 N N . GLU A 1121 274 . -11.915 3.694 -10.038 1.00 20.00 ? ? ? ? ? . 274 GLU A N 1121 ATOM 1896 C CA . GLU A 1121 274 . -13.059 3.468 -10.909 1.00 20.00 ? ? ? ? ? . 274 GLU A CA 1121 ATOM 1897 C C . GLU A 1121 274 . -13.343 4.720 -11.726 1.00 20.00 ? ? ? ? ? . 274 GLU A C 1121 ATOM 1898 O O . GLU A 1121 274 . -12.939 5.822 -11.349 1.00 20.00 ? ? ? ? ? . 274 GLU A O 1121 ATOM 1899 C CB . GLU A 1121 274 . -14.292 3.094 -10.082 1.00 20.00 ? ? ? ? ? . 274 GLU A CB 1121 ATOM 1900 C CG . GLU A 1121 274 . -14.179 1.746 -9.375 1.00 20.00 ? ? ? ? ? . 274 GLU A CG 1121 ATOM 1901 C CD . GLU A 1121 274 . -14.175 0.581 -10.343 1.00 20.00 ? ? ? ? ? . 274 GLU A CD 1121 ATOM 1902 O OE1 . GLU A 1121 274 . -14.437 0.808 -11.545 1.00 20.00 ? ? ? ? ? . 274 GLU A OE1 1121 ATOM 1903 O OE2 . GLU A 1121 274 . -13.916 -0.562 -9.904 1.00 20.00 ? ? ? ? ? 1- 274 GLU A OE2 1121 ATOM 1904 O OXT . GLU A 1121 274 . -13.987 4.666 -12.776 1.00 20.00 ? ? ? ? ? 1- 274 GLU A OXT 1121 #