data_SASDBL5_MAIN # _sas_result.id 371 _sas_result.SASBDB_code SASDBL5 _sas_result.experimental_MW 60.690 _sas_result.experimental_MW_error . _sas_result.MW_standard 71.600 _sas_result.MW_standard_error . _sas_result.MW_Porod . _sas_result.MW_Porod_error . _sas_result.I0_from_PR 224.7000000000 _sas_result.I0_from_PR_error . _sas_result.I0_from_Guinier 225.0000000000 _sas_result.I0_from_Guinier_error . _sas_result.Rg_from_PR 2.612 _sas_result.Rg_from_PR_error . _sas_result.Rg_from_Guinier 2.620 _sas_result.Rg_from_Guinier_error . _sas_result.D_max 8.40 _sas_result.Porod_volume 100.00 _sas_result.Porod_volume_error . _sas_result.estimated_volume . _sas_result.estimated_volume_error . _sas_result.estimated_volume_method . _sas_result.Guinier_point_min . _sas_result.Guinier_point_max . _sas_result.type_of_curve merged _sas_result.standard . _sas_result.Dmax_error . _sas_result.comments . # _sas_scan.title "Cyclohexanone monooxygenase, NADP+, K328A" _sas_scan.detc_id 17 _sas_scan.id 371 _sas_scan.measurement_date 2014-07-15 _sas_scan.storage_temperature . _sas_scan.cell_temperature 20.0 _sas_scan.exposure_time . _sas_scan.number_of_frames 4 _sas_scan.unit 1/A _sas_scan.qmin 0.0240 _sas_scan.qmax 0.3226 _sas_scan.sample_id 333 _sas_scan.result_id 371 _sas_scan.beam_id 31 # _sas_beam.id 31 _sas_beam.instrument_name "Advanced Light Source (ALS) 12.3.1 (SIBYLS)" _sas_beam.instrument_city "Berkeley, CA" _sas_beam.instrument_country USA _sas_beam.shape . _sas_beam.type_of_source "X-ray synchrotron" _sas_beam.radiation_wavelength 0.100000 _sas_beam.dist_spec_to_detc 1.50000 # _sas_detc.id 17 _sas_detc.name "MAR 165 CCD" _sas_detc.type . _sas_detc.pixsize_x . # _sas_sample.id 333 _sas_sample.name "Cyclohexanone monooxygenase, NADP+, K328A" _sas_sample.ext_coefficient . _sas_sample.contrast . _sas_sample.specific_vol . _sas_sample.purity_method . _sas_sample.dry_vol . _sas_sample.sample_MW . _sas_sample.specimen_concentration 2.00-8.00 _sas_sample.concentration_method . _sas_sample.entity_id 373 # _sas_buffer.id 182 _sas_buffer.name "50 mM Tris 5 mM NADP+" _sas_buffer.concentration . _sas_buffer.unit . _sas_buffer.pK . _sas_buffer.pH 8.000 _sas_buffer.comment . _sas_buffer.composition . _sas_buffer.sample_id 333 # _entity.id 373 _entity.type protein _entity.pdbx_description "Cyclohexanone monooxygenase" _entity.formula_weight 60.689 _entity.pdbx_number_of_molecules 1 # _entity_name_com.entity_id 373 _entity_name_com.name . # _entity_poly.entity_id 373 _entity_poly.pdbx_seq_one_letter_code GSLEASMHMTAQTTHTVDAVVIGAGFGGIYAVHKLHHELGLTTVGFDKADGPGGTWYWNRYPGALSDTESHLYRFSFDRDLLQESTWKTTYITQPEILEYLEDVVDRFDLRRHFKFGTEVTSALYLDDENLWEVTTDHGEVYRAKYVVNAVGLLSAINFPNLPGLDTFEGETIHTAAWPEGKSLAGRRVGVIGTGSTGQQVITSLAPEVEHLTVFVRTPQYSVPVGNRPVNPEQIAEIKADYDRIWERAKNSAVAFGFEESTLPAMSVSEEERNRIFQEAWDHGGGFRFMFGTFGDIATDEAANEAAASFIRAKVAEIIEDPETARKLMPKGLFAARPLCDSGYYEVYNRPNVEAVAIKENPIREVTAKGVVTEDGVLHELDVLVFATGFDAVDGNYRRIEIRGRDGLHINDHWDGQPTSYLGVSTANFPNWFMVLGPNGPFTNLPPSIETQVEWISDTIGYAERNGVRAIEPTPEAEAEWTETCTEIANATLFTKGDSWIFGANIPGKKPSVLFYLGGLRNYRAVMAEVAADGYRGFEVKSAEMVTV # _entity_src_gen.entity_id 373 _entity_src_gen.gene_src_common_name "Rhodococcus sp. HI-31" # _struct_ref.id 1 _struct_ref.entity_id 373 _struct_ref.db_name UniProt _struct_ref.db_code C0STX7 _struct_ref.details http://www.uniprot.org/uniprot/C0STX7 # _citation.id 190 _citation.title "The Role of Conformational Flexibility in Baeyer-Villiger Monooxygenase Catalysis and Structure." _citation.year "2016 Aug 25" _citation.pdbx_database_id_DOI 10.1016/j.bbapap.2016.08.015 _citation.pdbx_database_id_PubMed 27570148 # loop_ _citation_author.citation_id _citation_author.ordinal _citation_author.name 190 1 "Yachnin BJ" 190 2 "Lau PC" # _pdbx_contact_author.id 85 _pdbx_contact_author.name_first Albert _pdbx_contact_author.name_last Berghuis _pdbx_contact_author.role . _pdbx_contact_author.address_1 McGill _pdbx_contact_author.address_2 "McGill University" _pdbx_contact_author.address_3 "Montreal, Quebec, Canada" # 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 2.402100E-02 1.962143E+02 3.717809E+00 371 2 2.462900E-02 1.960879E+02 1.377896E+00 371 3 2.523700E-02 1.951784E+02 1.135663E+00 371 4 2.584500E-02 1.933627E+02 9.944098E-01 371 5 2.645400E-02 1.921578E+02 8.256764E-01 371 6 2.706200E-02 1.907826E+02 8.024041E-01 371 7 2.767000E-02 1.892589E+02 7.474693E-01 371 8 2.827800E-02 1.876259E+02 6.604626E-01 371 9 2.888600E-02 1.860278E+02 6.136804E-01 371 10 2.949400E-02 1.845492E+02 5.418942E-01 371 11 3.010200E-02 1.830870E+02 4.398784E-01 371 12 3.071000E-02 1.814652E+02 3.862757E-01 371 13 3.131900E-02 1.800131E+02 3.598696E-01 371 14 3.192700E-02 1.785851E+02 3.502013E-01 371 15 3.253500E-02 1.769856E+02 3.438753E-01 371 16 3.314300E-02 1.750616E+02 3.368875E-01 371 17 3.375100E-02 1.732270E+02 3.339498E-01 371 18 3.435900E-02 1.713988E+02 3.448923E-01 371 19 3.496700E-02 1.695065E+02 3.584734E-01 371 20 3.557500E-02 1.676695E+02 3.495935E-01 371 21 3.618400E-02 1.658368E+02 3.356493E-01 371 22 3.679200E-02 1.640852E+02 3.216307E-01 371 23 3.740000E-02 1.624778E+02 3.111703E-01 371 24 3.800800E-02 1.609343E+02 3.043680E-01 371 25 3.861600E-02 1.593516E+02 3.005233E-01 371 26 3.922400E-02 1.575430E+02 2.981950E-01 371 27 3.983200E-02 1.558422E+02 2.993607E-01 371 28 4.044000E-02 1.542159E+02 2.987316E-01 371 29 4.104900E-02 1.526589E+02 2.906502E-01 371 30 4.165700E-02 1.509768E+02 2.891540E-01 371 31 4.226500E-02 1.490834E+02 2.837686E-01 371 32 4.287300E-02 1.474251E+02 2.773867E-01 371 33 4.348100E-02 1.458730E+02 2.721970E-01 371 34 4.408900E-02 1.441490E+02 2.737235E-01 371 35 4.469700E-02 1.423790E+02 2.731839E-01 371 36 4.530500E-02 1.405786E+02 2.672289E-01 371 37 4.591400E-02 1.387589E+02 2.627610E-01 371 38 4.652200E-02 1.370703E+02 2.653632E-01 371 39 4.713000E-02 1.353307E+02 2.674157E-01 371 40 4.773800E-02 1.335153E+02 2.649036E-01 371 41 4.834600E-02 1.316574E+02 2.593394E-01 371 42 4.895400E-02 1.298671E+02 2.574298E-01 371 43 4.956200E-02 1.281420E+02 2.569879E-01 371 44 5.017000E-02 1.262122E+02 3.575640E-01 371 45 5.077900E-02 1.235846E+02 6.521723E-01 371 46 5.138700E-02 1.223455E+02 3.747383E-01 371 47 5.199500E-02 1.210392E+02 2.598370E-01 371 48 5.260300E-02 1.195034E+02 2.588093E-01 371 49 5.321100E-02 1.178313E+02 2.407496E-01 371 50 5.381900E-02 1.162383E+02 2.395905E-01 371 51 5.442700E-02 1.144121E+02 2.481270E-01 371 52 5.503500E-02 1.129124E+02 2.410032E-01 371 53 5.564400E-02 1.110636E+02 2.364670E-01 371 54 5.625200E-02 1.092004E+02 2.450063E-01 371 55 5.686000E-02 1.073679E+02 2.343479E-01 371 56 5.746800E-02 1.056959E+02 2.209658E-01 371 57 5.807600E-02 1.039307E+02 2.149018E-01 371 58 5.868400E-02 1.023741E+02 2.234206E-01 371 59 5.929200E-02 1.007703E+02 2.234585E-01 371 60 5.990000E-02 9.890632E+01 2.238635E-01 371 61 6.050900E-02 9.715369E+01 2.315236E-01 371 62 6.111700E-02 9.559240E+01 2.232254E-01 371 63 6.172500E-02 9.418315E+01 2.249037E-01 371 64 6.233300E-02 9.227963E+01 2.258621E-01 371 65 6.294100E-02 9.061682E+01 2.293995E-01 371 66 6.354900E-02 8.901968E+01 2.237345E-01 371 67 6.415700E-02 8.748584E+01 2.238921E-01 371 68 6.476500E-02 8.592469E+01 2.137563E-01 371 69 6.537400E-02 8.433664E+01 2.095822E-01 371 70 6.598200E-02 8.279889E+01 2.077655E-01 371 71 6.659000E-02 8.121665E+01 2.165924E-01 371 72 6.719800E-02 7.894471E+01 3.467370E-01 371 73 6.780600E-02 7.797641E+01 1.644915E-01 371 74 6.841400E-02 7.666791E+01 1.719767E-01 371 75 6.902200E-02 7.490014E+01 1.614697E-01 371 76 6.963000E-02 7.351863E+01 1.678126E-01 371 77 7.023800E-02 7.204130E+01 1.505453E-01 371 78 7.084700E-02 7.059582E+01 1.545600E-01 371 79 7.145500E-02 6.920879E+01 1.513459E-01 371 80 7.206300E-02 6.792010E+01 1.437301E-01 371 81 7.267100E-02 6.647368E+01 1.399143E-01 371 82 7.327900E-02 6.509552E+01 1.414041E-01 371 83 7.388700E-02 6.365480E+01 1.462311E-01 371 84 7.449500E-02 6.224879E+01 1.456839E-01 371 85 7.510300E-02 6.082168E+01 1.428720E-01 371 86 7.571200E-02 5.950513E+01 1.493093E-01 371 87 7.632000E-02 5.848682E+01 1.429147E-01 371 88 7.692800E-02 5.722822E+01 1.622371E-01 371 89 7.753600E-02 5.598065E+01 1.559169E-01 371 90 7.814400E-02 5.484331E+01 1.279053E-01 371 91 7.875200E-02 5.366246E+01 1.324066E-01 371 92 7.936000E-02 5.235856E+01 1.303245E-01 371 93 7.996800E-02 5.115449E+01 1.367802E-01 371 94 8.057600E-02 4.993824E+01 1.358046E-01 371 95 8.118500E-02 4.887177E+01 1.355728E-01 371 96 8.179300E-02 4.774289E+01 1.372330E-01 371 97 8.240100E-02 4.665147E+01 1.332751E-01 371 98 8.300900E-02 4.545391E+01 1.261435E-01 371 99 8.361700E-02 4.444182E+01 1.250289E-01 371 100 8.422500E-02 4.343537E+01 1.219787E-01 371 101 8.483300E-02 4.246305E+01 1.172357E-01 371 102 8.544100E-02 4.144121E+01 1.155333E-01 371 103 8.604900E-02 4.049911E+01 1.185488E-01 371 104 8.665800E-02 3.943904E+01 1.134946E-01 371 105 8.726600E-02 3.838378E+01 1.192209E-01 371 106 8.787400E-02 3.738009E+01 1.241204E-01 371 107 8.848200E-02 3.662965E+01 1.226255E-01 371 108 8.909000E-02 3.565910E+01 1.323830E-01 371 109 8.969800E-02 3.478276E+01 1.396334E-01 371 110 9.030600E-02 3.381049E+01 1.494828E-01 371 111 9.091400E-02 3.284594E+01 1.308491E-01 371 112 9.152200E-02 3.193981E+01 1.189032E-01 371 113 9.213100E-02 3.112494E+01 1.147385E-01 371 114 9.273900E-02 3.038346E+01 1.129954E-01 371 115 9.334700E-02 2.964530E+01 1.111560E-01 371 116 9.395500E-02 2.909426E+01 1.076378E-01 371 117 9.456300E-02 2.823845E+01 1.083030E-01 371 118 9.517100E-02 2.758339E+01 1.058625E-01 371 119 9.577900E-02 2.680727E+01 1.025327E-01 371 120 9.638700E-02 2.604938E+01 1.035344E-01 371 121 9.699500E-02 2.522865E+01 1.003805E-01 371 122 9.760400E-02 2.458521E+01 9.982847E-02 371 123 9.821200E-02 2.376316E+01 9.875537E-02 371 124 9.882000E-02 2.321250E+01 1.042543E-01 371 125 9.942800E-02 2.282814E+01 9.794903E-02 371 126 1.000360E-01 2.229968E+01 9.907662E-02 371 127 1.006440E-01 2.175974E+01 9.475340E-02 371 128 1.012520E-01 2.108340E+01 9.313472E-02 371 129 1.018600E-01 2.043749E+01 9.343883E-02 371 130 1.024680E-01 1.989610E+01 9.438300E-02 371 131 1.030770E-01 1.939179E+01 9.417479E-02 371 132 1.036850E-01 1.886412E+01 9.281936E-02 371 133 1.042930E-01 1.832261E+01 9.767051E-02 371 134 1.049010E-01 1.779552E+01 9.334334E-02 371 135 1.055090E-01 1.736576E+01 8.921668E-02 371 136 1.061170E-01 1.682585E+01 8.896917E-02 371 137 1.067250E-01 1.624497E+01 9.016192E-02 371 138 1.073330E-01 1.587451E+01 9.086649E-02 371 139 1.079410E-01 1.537664E+01 8.931697E-02 371 140 1.085500E-01 1.488376E+01 8.896066E-02 371 141 1.091580E-01 1.437403E+01 9.044018E-02 371 142 1.097660E-01 1.409495E+01 8.791292E-02 371 143 1.103740E-01 1.376796E+01 8.746247E-02 371 144 1.109820E-01 1.340623E+01 8.704257E-02 371 145 1.115900E-01 1.288172E+01 8.911055E-02 371 146 1.121980E-01 1.236323E+01 1.189742E-01 371 147 1.128060E-01 1.194306E+01 2.105295E-01 371 148 1.134140E-01 1.163819E+01 1.216268E-01 371 149 1.140220E-01 1.134630E+01 1.050054E-01 371 150 1.146310E-01 1.103257E+01 8.665417E-02 371 151 1.152390E-01 1.069579E+01 8.460953E-02 371 152 1.158470E-01 1.035739E+01 8.114382E-02 371 153 1.164550E-01 1.007971E+01 8.260697E-02 371 154 1.170630E-01 9.758895E+00 8.139714E-02 371 155 1.176710E-01 9.533455E+00 8.289627E-02 371 156 1.182790E-01 9.266148E+00 8.859682E-02 371 157 1.188870E-01 8.946024E+00 9.232221E-02 371 158 1.194950E-01 8.705044E+00 1.249704E-01 371 159 1.201030E-01 8.515811E+00 9.554718E-02 371 160 1.207120E-01 8.306134E+00 1.030859E-01 371 161 1.213200E-01 8.012712E+00 8.260748E-02 371 162 1.219280E-01 7.802185E+00 7.755891E-02 371 163 1.225360E-01 7.554025E+00 7.656227E-02 371 164 1.231440E-01 7.358437E+00 7.859426E-02 371 165 1.237520E-01 7.050836E+00 7.947207E-02 371 166 1.243600E-01 6.947074E+00 7.960748E-02 371 167 1.249680E-01 6.763748E+00 7.686886E-02 371 168 1.255760E-01 6.572807E+00 7.613664E-02 371 169 1.261840E-01 6.410864E+00 7.472485E-02 371 170 1.267930E-01 6.085290E+00 7.791838E-02 371 171 1.274010E-01 5.946956E+00 7.875419E-02 371 172 1.280090E-01 5.789264E+00 7.791521E-02 371 173 1.286170E-01 5.596743E+00 7.781827E-02 371 174 1.292250E-01 5.406267E+00 7.476283E-02 371 175 1.298330E-01 5.296691E+00 7.437175E-02 371 176 1.304410E-01 5.151889E+00 7.544075E-02 371 177 1.310490E-01 5.060766E+00 7.544518E-02 371 178 1.316570E-01 4.947001E+00 7.550061E-02 371 179 1.322650E-01 4.716739E+00 7.313218E-02 371 180 1.328730E-01 4.591311E+00 7.069788E-02 371 181 1.334820E-01 4.426285E+00 7.370938E-02 371 182 1.340900E-01 4.349270E+00 7.484894E-02 371 183 1.346980E-01 4.211841E+00 7.003017E-02 371 184 1.353060E-01 4.125262E+00 6.801109E-02 371 185 1.359140E-01 4.006349E+00 6.691285E-02 371 186 1.365220E-01 3.880340E+00 6.641004E-02 371 187 1.371300E-01 3.808997E+00 7.041384E-02 371 188 1.377380E-01 3.690211E+00 6.844340E-02 371 189 1.383460E-01 3.578256E+00 6.754462E-02 371 190 1.389540E-01 3.535303E+00 6.946905E-02 371 191 1.395620E-01 3.478632E+00 7.065046E-02 371 192 1.401710E-01 3.371848E+00 6.807438E-02 371 193 1.407790E-01 3.352293E+00 6.829407E-02 371 194 1.413870E-01 3.362482E+00 7.067268E-02 371 195 1.419950E-01 3.316686E+00 7.447811E-02 371 196 1.426030E-01 3.145916E+00 7.339179E-02 371 197 1.432110E-01 3.129333E+00 7.719260E-02 371 198 1.438190E-01 3.017898E+00 7.189504E-02 371 199 1.444270E-01 2.858260E+00 6.971531E-02 371 200 1.450350E-01 2.765717E+00 6.764204E-02 371 201 1.456430E-01 2.792439E+00 7.084318E-02 371 202 1.462510E-01 2.679396E+00 6.763744E-02 371 203 1.468600E-01 2.574694E+00 6.574278E-02 371 204 1.474680E-01 2.588156E+00 6.332020E-02 371 205 1.480760E-01 2.555745E+00 6.434826E-02 371 206 1.486840E-01 2.487379E+00 6.577508E-02 371 207 1.492920E-01 2.393588E+00 6.262045E-02 371 208 1.499000E-01 2.333125E+00 6.364559E-02 371 209 1.505080E-01 2.351339E+00 6.188249E-02 371 210 1.511160E-01 2.322348E+00 6.106500E-02 371 211 1.517240E-01 2.254793E+00 6.327296E-02 371 212 1.523320E-01 2.285697E+00 6.353135E-02 371 213 1.529400E-01 2.285589E+00 5.966111E-02 371 214 1.535480E-01 2.232982E+00 6.412839E-02 371 215 1.541560E-01 2.246960E+00 6.318793E-02 371 216 1.547650E-01 2.173395E+00 6.191630E-02 371 217 1.553730E-01 2.169533E+00 6.242168E-02 371 218 1.559810E-01 2.140523E+00 6.351309E-02 371 219 1.565890E-01 2.074465E+00 6.683378E-02 371 220 1.571970E-01 2.011874E+00 6.410977E-02 371 221 1.578050E-01 1.966124E+00 6.100871E-02 371 222 1.584130E-01 1.912834E+00 6.202977E-02 371 223 1.590210E-01 1.935567E+00 6.394570E-02 371 224 1.596290E-01 1.851232E+00 6.156456E-02 371 225 1.602370E-01 1.820424E+00 7.176145E-02 371 226 1.608450E-01 1.812599E+00 9.882134E-02 371 227 1.614530E-01 1.791304E+00 6.879794E-02 371 228 1.620610E-01 1.762793E+00 6.123546E-02 371 229 1.626700E-01 1.728406E+00 6.298376E-02 371 230 1.632780E-01 1.689180E+00 6.204257E-02 371 231 1.638860E-01 1.696027E+00 5.890746E-02 371 232 1.644940E-01 1.693952E+00 5.819961E-02 371 233 1.651020E-01 1.692161E+00 6.080798E-02 371 234 1.657100E-01 1.711946E+00 6.688134E-02 371 235 1.663180E-01 1.643178E+00 7.399935E-02 371 236 1.669260E-01 1.601059E+00 7.824439E-02 371 237 1.675340E-01 1.560314E+00 7.119982E-02 371 238 1.681420E-01 1.566186E+00 6.103996E-02 371 239 1.687500E-01 1.597075E+00 5.047227E-02 371 240 1.693580E-01 1.557523E+00 4.976577E-02 371 241 1.699660E-01 1.596098E+00 4.773335E-02 371 242 1.705740E-01 1.526873E+00 5.184492E-02 371 243 1.711830E-01 1.456667E+00 4.973555E-02 371 244 1.717910E-01 1.456080E+00 5.028738E-02 371 245 1.723990E-01 1.455235E+00 4.909381E-02 371 246 1.730070E-01 1.484399E+00 5.073123E-02 371 247 1.736150E-01 1.431057E+00 4.866723E-02 371 248 1.742230E-01 1.418913E+00 4.885389E-02 371 249 1.748310E-01 1.301656E+00 4.935880E-02 371 250 1.754390E-01 1.359761E+00 4.981461E-02 371 251 1.760470E-01 1.307397E+00 4.918948E-02 371 252 1.766550E-01 1.334503E+00 4.858190E-02 371 253 1.772630E-01 1.372500E+00 4.943329E-02 371 254 1.778710E-01 1.290489E+00 4.872571E-02 371 255 1.784790E-01 1.264609E+00 4.967143E-02 371 256 1.790870E-01 1.210133E+00 4.790055E-02 371 257 1.796950E-01 1.268500E+00 4.844533E-02 371 258 1.803040E-01 1.248985E+00 4.868884E-02 371 259 1.809120E-01 1.258299E+00 4.853345E-02 371 260 1.815200E-01 1.216396E+00 4.566381E-02 371 261 1.821280E-01 1.236098E+00 4.771541E-02 371 262 1.827360E-01 1.211596E+00 4.530660E-02 371 263 1.833440E-01 1.243124E+00 4.680889E-02 371 264 1.839520E-01 1.171948E+00 4.765848E-02 371 265 1.845600E-01 1.140832E+00 4.860037E-02 371 266 1.851680E-01 1.140639E+00 4.817731E-02 371 267 1.857760E-01 1.186372E+00 4.646185E-02 371 268 1.863840E-01 1.073476E+00 4.512990E-02 371 269 1.869920E-01 1.073667E+00 4.670899E-02 371 270 1.876000E-01 1.007058E+00 4.763242E-02 371 271 1.882080E-01 9.674927E-01 4.583897E-02 371 272 1.888160E-01 9.870470E-01 4.598620E-02 371 273 1.894240E-01 1.024014E+00 4.599112E-02 371 274 1.900320E-01 1.031111E+00 4.654883E-02 371 275 1.906410E-01 1.012125E+00 4.504757E-02 371 276 1.912490E-01 1.014286E+00 4.622999E-02 371 277 1.918570E-01 9.674572E-01 4.540119E-02 371 278 1.924650E-01 9.708172E-01 4.490797E-02 371 279 1.930730E-01 9.070876E-01 4.519882E-02 371 280 1.936810E-01 8.928092E-01 4.562355E-02 371 281 1.942890E-01 9.145106E-01 4.379046E-02 371 282 1.948970E-01 9.001994E-01 4.705412E-02 371 283 1.955050E-01 8.920698E-01 4.422481E-02 371 284 1.961130E-01 8.432214E-01 4.683551E-02 371 285 1.967210E-01 8.614672E-01 4.500530E-02 371 286 1.973290E-01 8.434179E-01 4.464040E-02 371 287 1.979370E-01 8.907930E-01 4.282363E-02 371 288 1.985450E-01 8.189911E-01 4.375385E-02 371 289 1.991530E-01 8.258337E-01 4.475514E-02 371 290 1.997610E-01 8.150207E-01 4.648622E-02 371 291 2.003690E-01 7.940042E-01 4.536617E-02 371 292 2.009770E-01 8.011006E-01 4.414884E-02 371 293 2.015850E-01 8.208804E-01 4.449591E-02 371 294 2.021930E-01 8.204091E-01 4.443140E-02 371 295 2.028020E-01 8.441825E-01 4.305242E-02 371 296 2.034100E-01 7.782840E-01 4.227840E-02 371 297 2.040180E-01 7.436297E-01 4.295783E-02 371 298 2.046260E-01 7.455743E-01 4.331323E-02 371 299 2.052340E-01 7.777810E-01 4.473594E-02 371 300 2.058420E-01 7.487476E-01 4.416816E-02 371 301 2.064500E-01 7.675189E-01 4.396638E-02 371 302 2.070580E-01 7.550259E-01 4.364578E-02 371 303 2.076660E-01 7.132173E-01 4.192539E-02 371 304 2.082740E-01 6.825764E-01 4.119235E-02 371 305 2.088820E-01 6.575545E-01 4.496024E-02 371 306 2.094900E-01 6.471139E-01 1.123571E-01 371 307 2.100980E-01 6.877759E-01 3.357367E-02 371 308 2.107060E-01 6.670033E-01 3.373324E-02 371 309 2.113140E-01 6.507685E-01 3.370742E-02 371 310 2.119220E-01 6.436823E-01 3.337182E-02 371 311 2.125300E-01 6.465505E-01 3.289777E-02 371 312 2.131380E-01 6.534732E-01 3.255256E-02 371 313 2.137460E-01 6.568179E-01 3.242946E-02 371 314 2.143540E-01 6.553607E-01 3.241677E-02 371 315 2.149620E-01 6.535069E-01 3.234406E-02 371 316 2.155700E-01 6.521864E-01 3.215948E-02 371 317 2.161780E-01 6.469819E-01 3.193577E-02 371 318 2.167860E-01 6.386297E-01 3.181425E-02 371 319 2.173940E-01 6.324299E-01 3.189442E-02 371 320 2.180020E-01 6.315218E-01 3.205752E-02 371 321 2.186100E-01 6.328304E-01 3.197022E-02 371 322 2.192190E-01 6.297020E-01 3.187605E-02 371 323 2.198270E-01 6.195192E-01 3.160264E-02 371 324 2.204350E-01 6.061221E-01 3.141223E-02 371 325 2.210430E-01 5.945685E-01 3.133096E-02 371 326 2.216510E-01 5.839284E-01 3.129191E-02 371 327 2.222590E-01 5.765332E-01 3.127721E-02 371 328 2.228670E-01 5.753325E-01 3.130084E-02 371 329 2.234750E-01 5.780831E-01 3.134765E-02 371 330 2.240830E-01 5.803689E-01 3.135562E-02 371 331 2.246910E-01 5.793329E-01 3.129957E-02 371 332 2.252990E-01 5.739843E-01 3.121492E-02 371 333 2.259070E-01 5.687919E-01 3.115668E-02 371 334 2.265150E-01 5.688459E-01 3.120342E-02 371 335 2.271230E-01 5.733877E-01 3.135280E-02 371 336 2.277310E-01 5.763665E-01 3.141867E-02 371 337 2.283390E-01 5.715493E-01 3.136637E-02 371 338 2.289470E-01 5.596350E-01 3.132966E-02 371 339 2.295550E-01 5.485320E-01 3.130304E-02 371 340 2.301630E-01 5.458456E-01 3.119828E-02 371 341 2.307710E-01 5.523566E-01 3.104367E-02 371 342 2.313790E-01 5.647577E-01 3.090411E-02 371 343 2.319870E-01 5.775718E-01 3.084856E-02 371 344 2.325950E-01 5.807003E-01 3.084839E-02 371 345 2.332030E-01 5.703455E-01 3.079723E-02 371 346 2.338110E-01 5.567521E-01 3.072150E-02 371 347 2.344190E-01 5.511445E-01 3.074939E-02 371 348 2.350270E-01 5.527563E-01 3.086174E-02 371 349 2.356350E-01 5.549018E-01 3.090106E-02 371 350 2.362430E-01 5.537584E-01 3.078214E-02 371 351 2.368510E-01 5.499348E-01 3.064643E-02 371 352 2.374590E-01 5.462284E-01 3.088339E-02 371 353 2.380670E-01 5.436586E-01 3.187907E-02 371 354 2.386750E-01 5.427603E-01 3.371764E-02 371 355 2.392830E-01 5.417032E-01 3.577835E-02 371 356 2.398910E-01 5.414238E-01 3.665397E-02 371 357 2.404990E-01 5.449776E-01 3.546393E-02 371 358 2.411070E-01 5.485588E-01 3.328108E-02 371 359 2.417150E-01 5.450455E-01 3.151883E-02 371 360 2.423230E-01 5.331465E-01 3.052700E-02 371 361 2.429310E-01 5.169331E-01 3.004802E-02 371 362 2.435390E-01 5.052329E-01 2.985643E-02 371 363 2.441470E-01 5.041944E-01 2.980451E-02 371 364 2.447550E-01 5.115506E-01 2.977719E-02 371 365 2.453630E-01 5.202279E-01 2.973028E-02 371 366 2.459710E-01 5.247855E-01 2.966475E-02 371 367 2.465790E-01 5.217211E-01 2.959728E-02 371 368 2.471870E-01 5.109916E-01 2.957575E-02 371 369 2.477950E-01 4.963447E-01 2.958071E-02 371 370 2.484030E-01 4.823991E-01 2.957307E-02 371 371 2.490110E-01 4.762035E-01 2.951251E-02 371 372 2.496190E-01 4.828423E-01 2.942641E-02 371 373 2.502270E-01 4.985396E-01 2.934145E-02 371 374 2.508350E-01 5.157932E-01 2.937809E-02 371 375 2.514430E-01 5.277509E-01 2.970916E-02 371 376 2.520510E-01 5.310215E-01 3.023851E-02 371 377 2.526590E-01 5.266646E-01 3.050767E-02 371 378 2.532670E-01 5.193976E-01 3.017219E-02 371 379 2.538750E-01 5.130423E-01 2.954643E-02 371 380 2.544830E-01 5.079785E-01 2.905603E-02 371 381 2.550910E-01 5.041181E-01 2.876312E-02 371 382 2.556990E-01 4.986478E-01 2.861631E-02 371 383 2.563070E-01 4.895183E-01 2.862457E-02 371 384 2.569150E-01 4.814481E-01 2.874345E-02 371 385 2.575230E-01 4.772673E-01 2.881976E-02 371 386 2.581310E-01 4.744379E-01 2.872361E-02 371 387 2.587390E-01 4.716574E-01 2.848020E-02 371 388 2.593470E-01 4.700906E-01 2.818457E-02 371 389 2.599550E-01 4.728040E-01 2.789840E-02 371 390 2.605630E-01 4.807440E-01 2.768966E-02 371 391 2.611710E-01 4.913281E-01 2.761228E-02 371 392 2.617790E-01 5.012696E-01 2.760880E-02 371 393 2.623870E-01 5.095935E-01 2.761086E-02 371 394 2.629950E-01 5.162550E-01 2.760800E-02 371 395 2.636030E-01 5.212197E-01 2.763181E-02 371 396 2.642110E-01 5.234267E-01 2.766728E-02 371 397 2.648190E-01 5.220451E-01 2.760985E-02 371 398 2.654270E-01 5.177834E-01 2.745113E-02 371 399 2.660350E-01 5.118368E-01 2.733514E-02 371 400 2.666430E-01 5.049247E-01 2.741184E-02 371 401 2.672510E-01 4.954853E-01 2.761005E-02 371 402 2.678590E-01 4.837440E-01 2.771447E-02 371 403 2.684670E-01 4.740596E-01 2.756821E-02 371 404 2.690750E-01 4.683867E-01 2.723244E-02 371 405 2.696830E-01 4.626764E-01 2.691517E-02 371 406 2.702910E-01 4.553053E-01 2.678437E-02 371 407 2.708990E-01 4.490637E-01 2.685011E-02 371 408 2.715070E-01 4.457776E-01 2.698499E-02 371 409 2.721150E-01 4.462437E-01 2.703588E-02 371 410 2.727230E-01 4.511808E-01 2.697829E-02 371 411 2.733310E-01 4.607756E-01 2.692277E-02 371 412 2.739390E-01 4.732236E-01 2.695833E-02 371 413 2.745470E-01 4.835236E-01 2.701323E-02 371 414 2.751550E-01 4.885924E-01 2.697502E-02 371 415 2.757630E-01 4.901614E-01 2.682937E-02 371 416 2.763710E-01 4.906741E-01 2.662889E-02 371 417 2.769790E-01 4.906138E-01 2.645643E-02 371 418 2.775870E-01 4.906435E-01 2.635807E-02 371 419 2.781950E-01 4.898861E-01 2.634259E-02 371 420 2.788030E-01 4.837698E-01 2.636766E-02 371 421 2.794110E-01 4.718954E-01 2.638871E-02 371 422 2.800190E-01 4.620879E-01 2.650411E-02 371 423 2.806260E-01 4.601501E-01 2.639064E-02 371 424 2.812340E-01 4.653471E-01 2.627463E-02 371 425 2.818420E-01 4.726555E-01 2.614512E-02 371 426 2.824500E-01 4.783400E-01 2.602832E-02 371 427 2.830580E-01 4.831961E-01 2.599443E-02 371 428 2.836660E-01 4.858848E-01 2.612057E-02 371 429 2.842740E-01 4.838542E-01 2.619634E-02 371 430 2.848820E-01 4.782250E-01 2.597352E-02 371 431 2.854900E-01 4.704212E-01 2.570898E-02 371 432 2.860980E-01 4.584500E-01 2.587736E-02 371 433 2.867060E-01 4.433828E-01 2.670247E-02 371 434 2.873140E-01 4.314148E-01 2.784603E-02 371 435 2.879220E-01 4.265202E-01 2.842881E-02 371 436 2.885300E-01 4.250645E-01 2.787060E-02 371 437 2.891380E-01 4.234007E-01 2.675004E-02 371 438 2.897460E-01 4.213759E-01 2.584060E-02 371 439 2.903540E-01 4.189171E-01 2.529939E-02 371 440 2.909620E-01 4.166535E-01 2.494896E-02 371 441 2.915700E-01 4.156763E-01 2.469861E-02 371 442 2.921780E-01 4.154078E-01 2.455145E-02 371 443 2.927860E-01 4.149036E-01 2.453903E-02 371 444 2.933940E-01 4.164050E-01 2.462801E-02 371 445 2.940020E-01 4.212954E-01 2.474170E-02 371 446 2.946100E-01 4.284290E-01 2.492073E-02 371 447 2.952170E-01 4.357112E-01 2.481259E-02 371 448 2.958250E-01 4.418387E-01 2.460836E-02 371 449 2.964330E-01 4.485534E-01 2.432497E-02 371 450 2.970410E-01 4.560996E-01 2.409305E-02 371 451 2.976490E-01 4.627255E-01 2.395825E-02 371 452 2.982570E-01 4.679792E-01 2.385483E-02 371 453 2.988650E-01 4.718392E-01 2.370513E-02 371 454 2.994730E-01 4.717005E-01 2.351577E-02 371 455 3.000810E-01 4.646286E-01 2.337763E-02 371 456 3.006890E-01 4.505253E-01 2.336425E-02 371 457 3.012970E-01 4.329184E-01 2.358441E-02 371 458 3.019050E-01 4.167746E-01 2.436773E-02 371 459 3.025130E-01 4.068882E-01 2.607959E-02 371 460 3.031210E-01 4.050867E-01 2.822567E-02 371 461 3.037290E-01 4.080524E-01 2.934743E-02 371 462 3.043370E-01 4.116583E-01 2.859675E-02 371 463 3.049450E-01 4.126564E-01 2.701740E-02 371 464 3.055530E-01 4.098179E-01 2.608533E-02 371 465 3.061600E-01 4.042628E-01 2.584388E-02 371 466 3.067680E-01 3.964908E-01 2.613589E-02 371 467 3.073760E-01 3.877105E-01 2.652775E-02 371 468 3.079840E-01 3.820772E-01 2.694499E-02 371 469 3.085920E-01 3.832764E-01 2.745609E-02 371 470 3.092000E-01 3.924854E-01 2.801671E-02 371 471 3.098080E-01 4.076035E-01 2.853216E-02 371 472 3.104160E-01 4.216001E-01 2.895074E-02 371 473 3.110240E-01 4.269893E-01 2.931940E-02 371 474 3.116320E-01 4.236110E-01 2.969093E-02 371 475 3.122400E-01 4.154468E-01 3.003535E-02 371 476 3.128480E-01 4.060223E-01 3.035410E-02 371 477 3.134560E-01 3.986327E-01 3.075675E-02 371 478 3.140640E-01 3.947661E-01 3.153333E-02 371 479 3.146710E-01 3.918578E-01 3.243405E-02 371 480 3.152790E-01 3.893577E-01 3.378344E-02 371 481 3.158870E-01 3.910901E-01 3.540893E-02 371 482 3.164950E-01 3.999748E-01 3.717340E-02 371 483 3.171030E-01 4.125163E-01 3.889441E-02 371 484 3.177110E-01 4.189096E-01 4.032567E-02 371 485 3.183190E-01 4.130933E-01 4.141591E-02 371 486 3.189270E-01 3.978659E-01 4.260453E-02 371 487 3.195350E-01 3.822771E-01 4.453812E-02 371 488 3.201430E-01 3.776088E-01 4.797465E-02 371 489 3.207510E-01 3.841349E-01 5.457836E-02 371 490 3.213590E-01 3.889706E-01 6.746990E-02 371 491 3.219670E-01 3.825562E-01 9.032204E-02 371 492 3.225740E-01 3.736892E-01 1.257111E-01 371 # _sas_p_of_R_details.id 371 _sas_p_of_R_details.intensity_id 371 _sas_p_of_R_details.software_p_of_R "GNOM 4.6" _sas_p_of_R_details.number_of_points 490 _sas_p_of_R_details.qmin 0.02524 _sas_p_of_R_details.qmax 0.3226 _sas_p_of_R_details.p_of_R_point_min 3 _sas_p_of_R_details.p_of_R_point_max 492 _sas_p_of_R_details.Rmin 0.0 _sas_p_of_R_details.Rmax 84.0 # 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 371 1 0.000000E+00 0.000000E+00 0.000000E+00 371 2 4.941000E-01 1.878000E-03 2.786000E-05 371 3 9.882000E-01 4.290000E-03 4.972000E-05 371 4 1.482000E+00 7.234000E-03 6.574000E-05 371 5 1.976000E+00 1.071000E-02 7.617000E-05 371 6 2.471000E+00 1.471000E-02 8.134000E-05 371 7 2.965000E+00 1.923000E-02 8.168000E-05 371 8 3.459000E+00 2.426000E-02 7.771000E-05 371 9 3.953000E+00 2.980000E-02 7.004000E-05 371 10 4.447000E+00 3.584000E-02 5.942000E-05 371 11 4.941000E+00 4.237000E-02 4.686000E-05 371 12 5.435000E+00 4.938000E-02 3.408000E-05 371 13 5.929000E+00 5.685000E-02 2.525000E-05 371 14 6.424000E+00 6.477000E-02 2.750000E-05 371 15 6.918000E+00 7.312000E-02 3.949000E-05 371 16 7.412000E+00 8.190000E-02 5.478000E-05 371 17 7.906000E+00 9.107000E-02 7.036000E-05 371 18 8.400000E+00 1.006000E-01 8.497000E-05 371 19 8.894000E+00 1.105000E-01 9.788000E-05 371 20 9.388000E+00 1.208000E-01 1.086000E-04 371 21 9.882000E+00 1.314000E-01 1.168000E-04 371 22 1.038000E+01 1.422000E-01 1.222000E-04 371 23 1.087000E+01 1.533000E-01 1.248000E-04 371 24 1.136000E+01 1.646000E-01 1.245000E-04 371 25 1.186000E+01 1.762000E-01 1.214000E-04 371 26 1.235000E+01 1.879000E-01 1.159000E-04 371 27 1.285000E+01 1.998000E-01 1.082000E-04 371 28 1.334000E+01 2.117000E-01 9.910000E-05 371 29 1.384000E+01 2.238000E-01 8.931000E-05 371 30 1.433000E+01 2.358000E-01 8.008000E-05 371 31 1.482000E+01 2.479000E-01 7.302000E-05 371 32 1.532000E+01 2.600000E-01 6.991000E-05 371 33 1.581000E+01 2.720000E-01 7.190000E-05 371 34 1.631000E+01 2.839000E-01 7.872000E-05 371 35 1.680000E+01 2.957000E-01 8.895000E-05 371 36 1.729000E+01 3.073000E-01 1.010000E-04 371 37 1.779000E+01 3.187000E-01 1.134000E-04 371 38 1.828000E+01 3.299000E-01 1.253000E-04 371 39 1.878000E+01 3.409000E-01 1.359000E-04 371 40 1.927000E+01 3.516000E-01 1.448000E-04 371 41 1.976000E+01 3.619000E-01 1.516000E-04 371 42 2.026000E+01 3.720000E-01 1.561000E-04 371 43 2.075000E+01 3.816000E-01 1.583000E-04 371 44 2.125000E+01 3.909000E-01 1.582000E-04 371 45 2.174000E+01 3.998000E-01 1.561000E-04 371 46 2.224000E+01 4.083000E-01 1.522000E-04 371 47 2.273000E+01 4.163000E-01 1.471000E-04 371 48 2.322000E+01 4.239000E-01 1.413000E-04 371 49 2.372000E+01 4.310000E-01 1.357000E-04 371 50 2.421000E+01 4.377000E-01 1.311000E-04 371 51 2.471000E+01 4.438000E-01 1.283000E-04 371 52 2.520000E+01 4.495000E-01 1.280000E-04 371 53 2.569000E+01 4.547000E-01 1.306000E-04 371 54 2.619000E+01 4.594000E-01 1.360000E-04 371 55 2.668000E+01 4.636000E-01 1.436000E-04 371 56 2.718000E+01 4.673000E-01 1.528000E-04 371 57 2.767000E+01 4.704000E-01 1.628000E-04 371 58 2.816000E+01 4.731000E-01 1.728000E-04 371 59 2.866000E+01 4.754000E-01 1.824000E-04 371 60 2.915000E+01 4.771000E-01 1.909000E-04 371 61 2.965000E+01 4.783000E-01 1.981000E-04 371 62 3.014000E+01 4.791000E-01 2.037000E-04 371 63 3.064000E+01 4.795000E-01 2.077000E-04 371 64 3.113000E+01 4.794000E-01 2.102000E-04 371 65 3.162000E+01 4.788000E-01 2.111000E-04 371 66 3.212000E+01 4.778000E-01 2.109000E-04 371 67 3.261000E+01 4.764000E-01 2.097000E-04 371 68 3.311000E+01 4.746000E-01 2.080000E-04 371 69 3.360000E+01 4.724000E-01 2.062000E-04 371 70 3.409000E+01 4.698000E-01 2.046000E-04 371 71 3.459000E+01 4.669000E-01 2.036000E-04 371 72 3.508000E+01 4.636000E-01 2.034000E-04 371 73 3.558000E+01 4.599000E-01 2.042000E-04 371 74 3.607000E+01 4.559000E-01 2.059000E-04 371 75 3.656000E+01 4.515000E-01 2.083000E-04 371 76 3.706000E+01 4.469000E-01 2.111000E-04 371 77 3.755000E+01 4.419000E-01 2.140000E-04 371 78 3.805000E+01 4.367000E-01 2.166000E-04 371 79 3.854000E+01 4.312000E-01 2.186000E-04 371 80 3.904000E+01 4.254000E-01 2.197000E-04 371 81 3.953000E+01 4.193000E-01 2.196000E-04 371 82 4.002000E+01 4.130000E-01 2.182000E-04 371 83 4.052000E+01 4.065000E-01 2.156000E-04 371 84 4.101000E+01 3.997000E-01 2.119000E-04 371 85 4.151000E+01 3.927000E-01 2.073000E-04 371 86 4.200000E+01 3.855000E-01 2.022000E-04 371 87 4.249000E+01 3.782000E-01 1.971000E-04 371 88 4.299000E+01 3.706000E-01 1.927000E-04 371 89 4.348000E+01 3.629000E-01 1.894000E-04 371 90 4.398000E+01 3.551000E-01 1.878000E-04 371 91 4.447000E+01 3.471000E-01 1.885000E-04 371 92 4.496000E+01 3.390000E-01 1.915000E-04 371 93 4.546000E+01 3.308000E-01 1.967000E-04 371 94 4.595000E+01 3.225000E-01 2.038000E-04 371 95 4.645000E+01 3.141000E-01 2.123000E-04 371 96 4.694000E+01 3.057000E-01 2.216000E-04 371 97 4.744000E+01 2.972000E-01 2.310000E-04 371 98 4.793000E+01 2.887000E-01 2.401000E-04 371 99 4.842000E+01 2.801000E-01 2.482000E-04 371 100 4.892000E+01 2.716000E-01 2.550000E-04 371 101 4.941000E+01 2.631000E-01 2.603000E-04 371 102 4.991000E+01 2.546000E-01 2.639000E-04 371 103 5.040000E+01 2.461000E-01 2.658000E-04 371 104 5.089000E+01 2.377000E-01 2.661000E-04 371 105 5.139000E+01 2.293000E-01 2.650000E-04 371 106 5.188000E+01 2.211000E-01 2.627000E-04 371 107 5.238000E+01 2.129000E-01 2.598000E-04 371 108 5.287000E+01 2.049000E-01 2.566000E-04 371 109 5.336000E+01 1.969000E-01 2.537000E-04 371 110 5.386000E+01 1.891000E-01 2.516000E-04 371 111 5.435000E+01 1.814000E-01 2.506000E-04 371 112 5.485000E+01 1.739000E-01 2.512000E-04 371 113 5.534000E+01 1.665000E-01 2.533000E-04 371 114 5.584000E+01 1.592000E-01 2.569000E-04 371 115 5.633000E+01 1.521000E-01 2.617000E-04 371 116 5.682000E+01 1.452000E-01 2.674000E-04 371 117 5.732000E+01 1.385000E-01 2.735000E-04 371 118 5.781000E+01 1.320000E-01 2.795000E-04 371 119 5.831000E+01 1.256000E-01 2.849000E-04 371 120 5.880000E+01 1.194000E-01 2.894000E-04 371 121 5.929000E+01 1.134000E-01 2.926000E-04 371 122 5.979000E+01 1.076000E-01 2.944000E-04 371 123 6.028000E+01 1.020000E-01 2.948000E-04 371 124 6.078000E+01 9.651000E-02 2.937000E-04 371 125 6.127000E+01 9.126000E-02 2.915000E-04 371 126 6.176000E+01 8.620000E-02 2.884000E-04 371 127 6.226000E+01 8.132000E-02 2.851000E-04 371 128 6.275000E+01 7.664000E-02 2.820000E-04 371 129 6.325000E+01 7.213000E-02 2.797000E-04 371 130 6.374000E+01 6.782000E-02 2.791000E-04 371 131 6.424000E+01 6.368000E-02 2.805000E-04 371 132 6.473000E+01 5.973000E-02 2.843000E-04 371 133 6.522000E+01 5.595000E-02 2.908000E-04 371 134 6.572000E+01 5.236000E-02 2.997000E-04 371 135 6.621000E+01 4.893000E-02 3.107000E-04 371 136 6.671000E+01 4.569000E-02 3.233000E-04 371 137 6.720000E+01 4.261000E-02 3.369000E-04 371 138 6.769000E+01 3.971000E-02 3.508000E-04 371 139 6.819000E+01 3.697000E-02 3.644000E-04 371 140 6.868000E+01 3.439000E-02 3.772000E-04 371 141 6.918000E+01 3.197000E-02 3.888000E-04 371 142 6.967000E+01 2.971000E-02 3.988000E-04 371 143 7.016000E+01 2.760000E-02 4.071000E-04 371 144 7.066000E+01 2.564000E-02 4.136000E-04 371 145 7.115000E+01 2.382000E-02 4.184000E-04 371 146 7.165000E+01 2.214000E-02 4.217000E-04 371 147 7.214000E+01 2.060000E-02 4.239000E-04 371 148 7.264000E+01 1.917000E-02 4.254000E-04 371 149 7.313000E+01 1.787000E-02 4.268000E-04 371 150 7.362000E+01 1.668000E-02 4.287000E-04 371 151 7.412000E+01 1.559000E-02 4.316000E-04 371 152 7.461000E+01 1.459000E-02 4.359000E-04 371 153 7.511000E+01 1.368000E-02 4.420000E-04 371 154 7.560000E+01 1.285000E-02 4.500000E-04 371 155 7.609000E+01 1.208000E-02 4.595000E-04 371 156 7.659000E+01 1.136000E-02 4.700000E-04 371 157 7.708000E+01 1.069000E-02 4.810000E-04 371 158 7.758000E+01 1.005000E-02 4.913000E-04 371 159 7.807000E+01 9.434000E-03 5.000000E-04 371 160 7.856000E+01 8.828000E-03 5.057000E-04 371 161 7.906000E+01 8.222000E-03 5.071000E-04 371 162 7.955000E+01 7.605000E-03 5.030000E-04 371 163 8.005000E+01 6.965000E-03 4.920000E-04 371 164 8.054000E+01 6.294000E-03 4.727000E-04 371 165 8.104000E+01 5.581000E-03 4.438000E-04 371 166 8.153000E+01 4.818000E-03 4.040000E-04 371 167 8.202000E+01 3.996000E-03 3.521000E-04 371 168 8.252000E+01 3.109000E-03 2.869000E-04 371 169 8.301000E+01 2.150000E-03 2.071000E-04 371 170 8.351000E+01 1.115000E-03 1.118000E-04 371 171 8.400000E+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 371 1 0.000000E+00 2.247000E+02 371 2 9.013000E-04 2.246000E+02 371 3 1.803000E-03 2.245000E+02 371 4 2.704000E-03 2.243000E+02 371 5 3.605000E-03 2.240000E+02 371 6 4.507000E-03 2.237000E+02 371 7 5.408000E-03 2.232000E+02 371 8 6.309000E-03 2.227000E+02 371 9 7.211000E-03 2.220000E+02 371 10 8.112000E-03 2.214000E+02 371 11 9.013000E-03 2.206000E+02 371 12 9.915000E-03 2.197000E+02 371 13 1.082000E-02 2.188000E+02 371 14 1.172000E-02 2.178000E+02 371 15 1.262000E-02 2.167000E+02 371 16 1.352000E-02 2.155000E+02 371 17 1.442000E-02 2.143000E+02 371 18 1.532000E-02 2.130000E+02 371 19 1.622000E-02 2.116000E+02 371 20 1.713000E-02 2.102000E+02 371 21 1.803000E-02 2.087000E+02 371 22 1.893000E-02 2.071000E+02 371 23 1.983000E-02 2.054000E+02 371 24 2.073000E-02 2.037000E+02 371 25 2.163000E-02 2.020000E+02 371 26 2.253000E-02 2.001000E+02 371 27 2.343000E-02 1.983000E+02 371 28 2.434000E-02 1.963000E+02 371 29 2.524000E-02 1.943000E+02 371 30 2.584000E-02 1.930000E+02 371 31 2.645000E-02 1.916000E+02 371 32 2.706000E-02 1.901000E+02 371 33 2.767000E-02 1.887000E+02 371 34 2.828000E-02 1.872000E+02 371 35 2.889000E-02 1.857000E+02 371 36 2.949000E-02 1.842000E+02 371 37 3.010000E-02 1.827000E+02 371 38 3.071000E-02 1.812000E+02 371 39 3.132000E-02 1.796000E+02 371 40 3.193000E-02 1.780000E+02 371 41 3.254000E-02 1.765000E+02 371 42 3.314000E-02 1.749000E+02 371 43 3.375000E-02 1.732000E+02 371 44 3.436000E-02 1.716000E+02 371 45 3.497000E-02 1.699000E+02 371 46 3.558000E-02 1.683000E+02 371 47 3.618000E-02 1.666000E+02 371 48 3.679000E-02 1.649000E+02 371 49 3.740000E-02 1.632000E+02 371 50 3.801000E-02 1.615000E+02 371 51 3.862000E-02 1.598000E+02 371 52 3.922000E-02 1.581000E+02 371 53 3.983000E-02 1.563000E+02 371 54 4.044000E-02 1.546000E+02 371 55 4.105000E-02 1.528000E+02 371 56 4.166000E-02 1.511000E+02 371 57 4.226000E-02 1.493000E+02 371 58 4.287000E-02 1.475000E+02 371 59 4.348000E-02 1.458000E+02 371 60 4.409000E-02 1.440000E+02 371 61 4.470000E-02 1.422000E+02 371 62 4.530000E-02 1.404000E+02 371 63 4.591000E-02 1.386000E+02 371 64 4.652000E-02 1.368000E+02 371 65 4.713000E-02 1.351000E+02 371 66 4.774000E-02 1.333000E+02 371 67 4.835000E-02 1.315000E+02 371 68 4.895000E-02 1.297000E+02 371 69 4.956000E-02 1.279000E+02 371 70 5.017000E-02 1.261000E+02 371 71 5.078000E-02 1.244000E+02 371 72 5.139000E-02 1.226000E+02 371 73 5.199000E-02 1.208000E+02 371 74 5.260000E-02 1.190000E+02 371 75 5.321000E-02 1.173000E+02 371 76 5.382000E-02 1.155000E+02 371 77 5.443000E-02 1.138000E+02 371 78 5.504000E-02 1.120000E+02 371 79 5.564000E-02 1.103000E+02 371 80 5.625000E-02 1.086000E+02 371 81 5.686000E-02 1.069000E+02 371 82 5.747000E-02 1.051000E+02 371 83 5.808000E-02 1.034000E+02 371 84 5.868000E-02 1.018000E+02 371 85 5.929000E-02 1.001000E+02 371 86 5.990000E-02 9.840000E+01 371 87 6.051000E-02 9.674000E+01 371 88 6.112000E-02 9.509000E+01 371 89 6.172000E-02 9.345000E+01 371 90 6.233000E-02 9.183000E+01 371 91 6.294000E-02 9.022000E+01 371 92 6.355000E-02 8.862000E+01 371 93 6.416000E-02 8.703000E+01 371 94 6.477000E-02 8.545000E+01 371 95 6.537000E-02 8.389000E+01 371 96 6.598000E-02 8.234000E+01 371 97 6.659000E-02 8.081000E+01 371 98 6.720000E-02 7.929000E+01 371 99 6.781000E-02 7.779000E+01 371 100 6.841000E-02 7.630000E+01 371 101 6.902000E-02 7.483000E+01 371 102 6.963000E-02 7.337000E+01 371 103 7.024000E-02 7.193000E+01 371 104 7.085000E-02 7.050000E+01 371 105 7.145000E-02 6.909000E+01 371 106 7.206000E-02 6.770000E+01 371 107 7.267000E-02 6.632000E+01 371 108 7.328000E-02 6.496000E+01 371 109 7.389000E-02 6.362000E+01 371 110 7.450000E-02 6.229000E+01 371 111 7.510000E-02 6.098000E+01 371 112 7.571000E-02 5.969000E+01 371 113 7.632000E-02 5.841000E+01 371 114 7.693000E-02 5.716000E+01 371 115 7.754000E-02 5.592000E+01 371 116 7.814000E-02 5.469000E+01 371 117 7.875000E-02 5.349000E+01 371 118 7.936000E-02 5.230000E+01 371 119 7.997000E-02 5.113000E+01 371 120 8.058000E-02 4.998000E+01 371 121 8.118000E-02 4.884000E+01 371 122 8.179000E-02 4.772000E+01 371 123 8.240000E-02 4.662000E+01 371 124 8.301000E-02 4.554000E+01 371 125 8.362000E-02 4.448000E+01 371 126 8.423000E-02 4.343000E+01 371 127 8.483000E-02 4.240000E+01 371 128 8.544000E-02 4.139000E+01 371 129 8.605000E-02 4.040000E+01 371 130 8.666000E-02 3.942000E+01 371 131 8.727000E-02 3.846000E+01 371 132 8.787000E-02 3.752000E+01 371 133 8.848000E-02 3.660000E+01 371 134 8.909000E-02 3.569000E+01 371 135 8.970000E-02 3.480000E+01 371 136 9.031000E-02 3.393000E+01 371 137 9.091000E-02 3.307000E+01 371 138 9.152000E-02 3.223000E+01 371 139 9.213000E-02 3.140000E+01 371 140 9.274000E-02 3.060000E+01 371 141 9.335000E-02 2.981000E+01 371 142 9.396000E-02 2.903000E+01 371 143 9.456000E-02 2.828000E+01 371 144 9.517000E-02 2.753000E+01 371 145 9.578000E-02 2.681000E+01 371 146 9.639000E-02 2.610000E+01 371 147 9.700000E-02 2.540000E+01 371 148 9.760000E-02 2.472000E+01 371 149 9.821000E-02 2.405000E+01 371 150 9.882000E-02 2.340000E+01 371 151 9.943000E-02 2.277000E+01 371 152 1.000000E-01 2.215000E+01 371 153 1.006000E-01 2.154000E+01 371 154 1.013000E-01 2.095000E+01 371 155 1.019000E-01 2.037000E+01 371 156 1.025000E-01 1.980000E+01 371 157 1.031000E-01 1.925000E+01 371 158 1.037000E-01 1.871000E+01 371 159 1.043000E-01 1.819000E+01 371 160 1.049000E-01 1.768000E+01 371 161 1.055000E-01 1.718000E+01 371 162 1.061000E-01 1.669000E+01 371 163 1.067000E-01 1.622000E+01 371 164 1.073000E-01 1.576000E+01 371 165 1.079000E-01 1.531000E+01 371 166 1.085000E-01 1.487000E+01 371 167 1.092000E-01 1.444000E+01 371 168 1.098000E-01 1.402000E+01 371 169 1.104000E-01 1.362000E+01 371 170 1.110000E-01 1.323000E+01 371 171 1.116000E-01 1.284000E+01 371 172 1.122000E-01 1.247000E+01 371 173 1.128000E-01 1.211000E+01 371 174 1.134000E-01 1.176000E+01 371 175 1.140000E-01 1.142000E+01 371 176 1.146000E-01 1.109000E+01 371 177 1.152000E-01 1.076000E+01 371 178 1.158000E-01 1.045000E+01 371 179 1.165000E-01 1.015000E+01 371 180 1.171000E-01 9.851000E+00 371 181 1.177000E-01 9.564000E+00 371 182 1.183000E-01 9.286000E+00 371 183 1.189000E-01 9.017000E+00 371 184 1.195000E-01 8.755000E+00 371 185 1.201000E-01 8.502000E+00 371 186 1.207000E-01 8.255000E+00 371 187 1.213000E-01 8.017000E+00 371 188 1.219000E-01 7.786000E+00 371 189 1.225000E-01 7.563000E+00 371 190 1.231000E-01 7.346000E+00 371 191 1.238000E-01 7.136000E+00 371 192 1.244000E-01 6.933000E+00 371 193 1.250000E-01 6.736000E+00 371 194 1.256000E-01 6.546000E+00 371 195 1.262000E-01 6.361000E+00 371 196 1.268000E-01 6.183000E+00 371 197 1.274000E-01 6.010000E+00 371 198 1.280000E-01 5.843000E+00 371 199 1.286000E-01 5.682000E+00 371 200 1.292000E-01 5.526000E+00 371 201 1.298000E-01 5.375000E+00 371 202 1.304000E-01 5.229000E+00 371 203 1.310000E-01 5.088000E+00 371 204 1.317000E-01 4.952000E+00 371 205 1.323000E-01 4.821000E+00 371 206 1.329000E-01 4.694000E+00 371 207 1.335000E-01 4.571000E+00 371 208 1.341000E-01 4.452000E+00 371 209 1.347000E-01 4.337000E+00 371 210 1.353000E-01 4.227000E+00 371 211 1.359000E-01 4.120000E+00 371 212 1.365000E-01 4.017000E+00 371 213 1.371000E-01 3.918000E+00 371 214 1.377000E-01 3.822000E+00 371 215 1.383000E-01 3.729000E+00 371 216 1.390000E-01 3.639000E+00 371 217 1.396000E-01 3.553000E+00 371 218 1.402000E-01 3.470000E+00 371 219 1.408000E-01 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9.379000E-01 371 308 1.949000E-01 9.272000E-01 371 309 1.955000E-01 9.167000E-01 371 310 1.961000E-01 9.063000E-01 371 311 1.967000E-01 8.960000E-01 371 312 1.973000E-01 8.859000E-01 371 313 1.979000E-01 8.759000E-01 371 314 1.985000E-01 8.661000E-01 371 315 1.992000E-01 8.564000E-01 371 316 1.998000E-01 8.468000E-01 371 317 2.004000E-01 8.374000E-01 371 318 2.010000E-01 8.282000E-01 371 319 2.016000E-01 8.190000E-01 371 320 2.022000E-01 8.100000E-01 371 321 2.028000E-01 8.012000E-01 371 322 2.034000E-01 7.925000E-01 371 323 2.040000E-01 7.839000E-01 371 324 2.046000E-01 7.755000E-01 371 325 2.052000E-01 7.672000E-01 371 326 2.058000E-01 7.591000E-01 371 327 2.065000E-01 7.511000E-01 371 328 2.071000E-01 7.433000E-01 371 329 2.077000E-01 7.356000E-01 371 330 2.083000E-01 7.281000E-01 371 331 2.089000E-01 7.207000E-01 371 332 2.095000E-01 7.134000E-01 371 333 2.101000E-01 7.063000E-01 371 334 2.107000E-01 6.994000E-01 371 335 2.113000E-01 6.926000E-01 371 336 2.119000E-01 6.859000E-01 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5.120000E-01 371 396 2.484000E-01 5.114000E-01 371 397 2.490000E-01 5.108000E-01 371 398 2.496000E-01 5.102000E-01 371 399 2.502000E-01 5.096000E-01 371 400 2.508000E-01 5.091000E-01 371 401 2.514000E-01 5.085000E-01 371 402 2.521000E-01 5.080000E-01 371 403 2.527000E-01 5.074000E-01 371 404 2.533000E-01 5.069000E-01 371 405 2.539000E-01 5.064000E-01 371 406 2.545000E-01 5.059000E-01 371 407 2.551000E-01 5.053000E-01 371 408 2.557000E-01 5.048000E-01 371 409 2.563000E-01 5.043000E-01 371 410 2.569000E-01 5.037000E-01 371 411 2.575000E-01 5.031000E-01 371 412 2.581000E-01 5.026000E-01 371 413 2.587000E-01 5.020000E-01 371 414 2.593000E-01 5.014000E-01 371 415 2.600000E-01 5.008000E-01 371 416 2.606000E-01 5.002000E-01 371 417 2.612000E-01 4.995000E-01 371 418 2.618000E-01 4.988000E-01 371 419 2.624000E-01 4.982000E-01 371 420 2.630000E-01 4.975000E-01 371 421 2.636000E-01 4.967000E-01 371 422 2.642000E-01 4.960000E-01 371 423 2.648000E-01 4.952000E-01 371 424 2.654000E-01 4.944000E-01 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2.837000E-01 4.600000E-01 371 455 2.843000E-01 4.586000E-01 371 456 2.849000E-01 4.573000E-01 371 457 2.855000E-01 4.558000E-01 371 458 2.861000E-01 4.544000E-01 371 459 2.867000E-01 4.530000E-01 371 460 2.873000E-01 4.515000E-01 371 461 2.879000E-01 4.501000E-01 371 462 2.885000E-01 4.487000E-01 371 463 2.891000E-01 4.473000E-01 371 464 2.897000E-01 4.459000E-01 371 465 2.904000E-01 4.445000E-01 371 466 2.910000E-01 4.431000E-01 371 467 2.916000E-01 4.417000E-01 371 468 2.922000E-01 4.403000E-01 371 469 2.928000E-01 4.389000E-01 371 470 2.934000E-01 4.376000E-01 371 471 2.940000E-01 4.362000E-01 371 472 2.946000E-01 4.348000E-01 371 473 2.952000E-01 4.335000E-01 371 474 2.958000E-01 4.322000E-01 371 475 2.964000E-01 4.309000E-01 371 476 2.970000E-01 4.296000E-01 371 477 2.976000E-01 4.283000E-01 371 478 2.983000E-01 4.270000E-01 371 479 2.989000E-01 4.258000E-01 371 480 2.995000E-01 4.245000E-01 371 481 3.001000E-01 4.233000E-01 371 482 3.007000E-01 4.221000E-01 371 483 3.013000E-01 4.209000E-01 371 484 3.019000E-01 4.197000E-01 371 485 3.025000E-01 4.186000E-01 371 486 3.031000E-01 4.174000E-01 371 487 3.037000E-01 4.163000E-01 371 488 3.043000E-01 4.152000E-01 371 489 3.049000E-01 4.141000E-01 371 490 3.056000E-01 4.130000E-01 371 491 3.062000E-01 4.120000E-01 371 492 3.068000E-01 4.110000E-01 371 493 3.074000E-01 4.099000E-01 371 494 3.080000E-01 4.090000E-01 371 495 3.086000E-01 4.080000E-01 371 496 3.092000E-01 4.070000E-01 371 497 3.098000E-01 4.061000E-01 371 498 3.104000E-01 4.051000E-01 371 499 3.110000E-01 4.042000E-01 371 500 3.116000E-01 4.033000E-01 371 501 3.122000E-01 4.024000E-01 371 502 3.128000E-01 4.015000E-01 371 503 3.135000E-01 4.007000E-01 371 504 3.141000E-01 3.998000E-01 371 505 3.147000E-01 3.990000E-01 371 506 3.153000E-01 3.982000E-01 371 507 3.159000E-01 3.973000E-01 371 508 3.165000E-01 3.965000E-01 371 509 3.171000E-01 3.957000E-01 371 510 3.177000E-01 3.949000E-01 371 511 3.183000E-01 3.941000E-01 371 512 3.189000E-01 3.934000E-01 371 513 3.195000E-01 3.926000E-01 371 514 3.201000E-01 3.918000E-01 371 515 3.208000E-01 3.910000E-01 371 516 3.214000E-01 3.903000E-01 371 517 3.220000E-01 3.895000E-01 371 518 3.226000E-01 3.887000E-01 #