# Pepsi-SANS version 2.4 from 31 July 2019 # Run at 1d203b844e1c on Mon Jun 13 12:50:37 2022 # Command-line arguments: executables/Pepsi-SANS uploads/8188474_2vb1-NoACT_EDO_NO3.pdb uploads/8188474_D-Lys-OE_SS_Merge.dat -o results/8188474_.out --json --dist --cst --neg --conc 1 --d2o 1.0 --deut 0.0 --exchange 0.9 --dro 5 # Intensities are written in cm-1 # r0: 1.58 d_rho: 0.02 Chi2: 1.48 # q I exp dI exp I fit 0.040000 0.84479040 0.05773636 0.83990045 0.046000 0.81679600 0.04962667 0.81683211 0.052000 0.86295320 0.04308666 0.79309530 0.058000 0.77246080 0.03798895 0.76801849 0.064000 0.73521200 0.03515338 0.74093960 0.068000 0.74711020 0.03309038 0.72163898 0.074000 0.75815520 0.03142121 0.69114758 0.078000 0.69742640 0.02887662 0.67001599 0.084000 0.64782120 0.02885864 0.63749495 0.090000 0.60533450 0.02637402 0.60438017 0.096000 0.56126980 0.02541330 0.57091096 0.102000 0.56894090 0.02516264 0.53728276 0.108000 0.51156810 0.02410233 0.50369147 0.114000 0.50710500 0.02284985 0.47034544 0.120000 0.45538590 0.01105981 0.43746802 0.126000 0.40587240 0.01103124 0.40528358 0.132000 0.37069320 0.00189397 0.37400821 0.138000 0.34149720 0.00203153 0.34379476 0.144000 0.31488120 0.00149983 0.31476723 0.150000 0.28742120 0.00170924 0.28704955 0.156000 0.26033420 0.00185042 0.26074611 0.162000 0.23623090 0.00184050 0.23591206 0.168000 0.21471590 0.00182155 0.21259506 0.174000 0.19252420 0.00139295 0.19084113 0.180000 0.17431540 0.00215030 0.17066177 0.186000 0.15481990 0.00187160 0.15203596 0.192000 0.13912860 0.00133385 0.13494145 0.198000 0.11661910 0.00120736 0.11935090 0.204000 0.09723467 0.00166260 0.10520839 0.210000 0.08833967 0.00130660 0.09244806 0.216000 0.07873843 0.00163545 0.08100396 0.222000 0.07259710 0.00125132 0.07080428 0.228000 0.06113901 0.00124823 0.06176601 0.234000 0.05111637 0.00141152 0.05380483 0.240000 0.04851379 0.00121677 0.04683645 0.246000 0.04210246 0.00121689 0.04077769 0.252000 0.03694230 0.00158172 0.03554626 0.258000 0.03303631 0.00122196 0.03105976 0.264000 0.02853971 0.00120260 0.02723800 0.270000 0.02713413 0.00144057 0.02401003 0.276000 0.02303135 0.00118366 0.02130730 0.282000 0.01922230 0.00123913 0.01906131 0.288000 0.01696820 0.00170799 0.01721043 0.294000 0.01711401 0.00142610 0.01570317 0.300000 0.01457225 0.00148321 0.01448888 0.306000 0.01306429 0.00110598 0.01351787 0.312000 0.01381097 0.00135083 0.01275069 0.318000 0.01092491 0.00115306 0.01215370 0.324000 0.01175300 0.00117612 0.01169326 0.330000 0.01115352 0.00117311 0.01133871 0.336000 0.01188579 0.00138405 0.01106868 0.342000 0.01131425 0.00119413 0.01086364 0.348000 0.00963768 0.00120049 0.01070420 0.354000 0.00933174 0.00124402 0.01057564 0.360000 0.01003293 0.00127475 0.01046866 0.366000 0.00845144 0.00197152 0.01037426 0.372000 0.00996791 0.00130955 0.01028404 0.378000 0.00784955 0.00187074 0.01019402 0.384000 0.01023965 0.00142279 0.01010218 0.390000 0.00980195 0.00149022 0.01000649 0.396000 0.01122286 0.00179920 0.00990586 0.402000 0.00912795 0.00200174 0.00980146 0.408000 0.00947004 0.00187563 0.00969478 0.414000 0.00734951 0.00156396 0.00958736 0.420000 0.01015205 0.00154843 0.00948098 0.426000 0.00871562 0.00156023 0.00937767 0.432000 0.00838882 0.00224702 0.00927951 0.438000 0.00518540 0.00358616 0.00918837 0.444000 0.00884644 0.00133588 0.00910528 0.450000 0.00552734 0.00430279 0.00903097 0.456000 0.01108930 0.00477479 0.00896617 0.462000 0.00979917 0.00187164 0.00891100 0.468000 -1.04001000 1.04001000 0.00886446 0.474000 -1.04001000 1.04001000 0.00882544 0.480000 0.00827318 0.00322036 0.00879281 0.486000 0.00907997 0.00190793 0.00876511 0.492000 0.01051348 0.00313302 0.00874068 0.498000 -1.04001000 1.04001000 0.00871785