*HEADER    LIGASE                                  27-OCT-15   2N8S              
*TITLE     SOLUTION STRUCTURE OF THE RNEDD4 WW1 DOMAIN BY NMR                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE NEDD4;                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: WW1 DOMAIN;                                                
*COMPND   5 EC: 6.3.2.-;                                                         
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS;                              
*SOURCE   3 ORGANISM_COMMON: BROWN RAT,RAT,RATS;                                 
*SOURCE   4 ORGANISM_TAXID: 10116;                                               
*SOURCE   5 GENE: NEDD4, NEDD4A;                                                 
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PGEX-KT                                    
*KEYWDS    RNEDD4 WW1, LIGASE                                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    G.SPAGNOL, F.KIEKEN, P.L.SORGEN                                       
*REVDAT   1   24-FEB-16 2N8S    0                                                


          ============================================================
          |                                                          |
          |            Crystallography & NMR System (CNS)            |
          |                         CNSsolve                         |
          |                                                          |
          ============================================================
           Version: 1.1
           Status: Developmental version
          ============================================================
           Written by: A.T.Brunger, P.D.Adams, G.M.Clore, W.L.DeLano,
                       P.Gros, R.W.Grosse-Kunstleve, J.-S.Jiang,
                       J.Kuszewski, M.Nilges, N.S.Pannu, R.J.Read,
                       L.M.Rice, T.Simonson, G.L.Warren.
           Copyright (c) 1997-1999 Yale University
          ============================================================
           Running on machine: adama (Unix-g77,32-bit)
           Program started by: fkieken
           Program started at: 14:13:52 on 02-Mar-2010
          ============================================================

 FFT3C: Using FFTPACK4.1

 CNSsolve>!$Revision: 1.3 $ 
 CNSsolve>!$Date: 2016/02/17 13:34:52 $ 
 CNSsolve>!$RCSfile: rcsb104565.mr,v $ 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>! merge.inp 
 CNSsolve>! reads in several data lists and merges them 
 CNSsolve>! outputs "ambig.tbl" and "unambig.tbl" 
 CNSsolve>!     ************************************ 
 CNSsolve>!     * Authors and copyright:           * 
 CNSsolve>!     * Michael Nilges, Jens Linge, EMBL * 
 CNSsolve>!     * No warranty implied or expressed * 
 CNSsolve>!     * All rights reserved              * 
 CNSsolve>!     ************************************ 
 CNSsolve> 
 CNSsolve>! set abort off end  ! for testing only 
 CNSsolve>set abort normal end 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>@RUN:protocols/initialize.cns 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/protocols/initialize.cns opened.
 CNSsolve>!$Revision: 1.3 $ 
 CNSsolve>!$Date: 2016/02/17 13:34:52 $ 
 CNSsolve>!$RCSfile: rcsb104565.mr,v $ 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>module (spectrum;iteration;) 
 MODULE-INVOCATION>(spectrum=$spectrum;iteration=$iteration;) 
 &_2_SPECTRUM set to $_1_SPECTRUM 
 &_2_ITERATION set to $_1_ITERATION 
 CNSsolve>evaluate (&spectrum = "") 
 EVALUATE: symbol $_1_SPECTRUM set to "" (string)
 CNSsolve>evaluate (&iteration = "") 
 EVALUATE: symbol $_1_ITERATION set to "" (string)
 CNSsolve> 
 CNSsolve> 
 CNSsolve>@NEWIT:iteration.cns(iteration=$iteration;) 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/finaldata/iteration.cns opened.
 CNSsolve>module ( iteration ) 
 &_2_ITERATION set to $_1_ITERATION 
 CNSsolve>evaluate (&iteration=8) 
 EVALUATE: symbol $_1_ITERATION set to    8.00000     (real)
 CNSsolve> 
 CNSsolve>!!! @SPECTRUM:spectrum.cns(spectrum=$spectrum;) 
 CNSsolve> 
 CNSsolve>@RUN:run.cns( 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/run.cns opened.
 CNSsolve>!$Revision: 1.3 $ 
 CNSsolve>!$Date: 2016/02/17 13:34:52 $ 
 CNSsolve>!$RCSfile: rcsb104565.mr,v $ 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>module( 
 MODULE-DECLARATION>spectrum; 
 MODULE-DECLARATION>iteration; 
 MODULE-DECLARATION>filenames; 
 MODULE-DECLARATION>spectra; 
 MODULE-DECLARATION>data; 
 MODULE-DECLARATION>iterations; 
 MODULE-DECLARATION>saprotocol; 
 MODULE-DECLARATION>refine; 
 MODULE-DECLARATION>relax; 
 MODULE-DECLARATION>toppar; 
 MODULE-DECLARATION>analysis; 
 MODULE-DECLARATION>) 
 MODULE-INVOCATION>spectrum  =$spectrum; 
 &_2_SPECTRUM set to $_1_SPECTRUM 
 MODULE-INVOCATION>iteration =$iteration; 
 &_2_ITERATION set to $_1_ITERATION 
 MODULE-INVOCATION>filenames =$filenames; 
 &_2_FILENAMES set to $_1_FILENAMES 
 MODULE-INVOCATION>spectra   =$spectra; 
 &_2_SPECTRA set to $_1_SPECTRA 
 MODULE-INVOCATION>data      =$data; 
 &_2_DATA set to $_1_DATA 
 MODULE-INVOCATION>iterations=$iterations; 
 &_2_ITERATIONS set to $_1_ITERATIONS 
 MODULE-INVOCATION>saprotocol=$saprotocol; 
 &_2_SAPROTOCOL set to $_1_SAPROTOCOL 
 MODULE-INVOCATION>refine    =$refine; 
 &_2_REFINE set to $_1_REFINE 
 MODULE-INVOCATION>relax     =$relax; 
 &_2_RELAX set to $_1_RELAX 
 MODULE-INVOCATION>toppar    =$toppar; 
 &_2_TOPPAR set to $_1_TOPPAR 
 MODULE-INVOCATION>analysis  =$analysis; 
 &_2_ANALYSIS set to $_1_ANALYSIS 
 MODULE-INVOCATION>) 
 CNSsolve> 
 CNSsolve>{+ file: run.cns +} 
 CNSsolve>{+ description: The file run.cns contains all necessary information to run ARIA. 
 CNSsolve>ARIA automatically sets the default values. 
 CNSsolve>Please change the values for the mixing time, rotation 
 CNSsolve>correlation time and spectrometer frequency for the spin diffusion correction. 
 CNSsolve>For the large CNS log files, you should use a temporary directory. version 1.2 +} 
 CNSsolve>{+ authors: Jens Linge, Michael Nilges +} 
 CNSsolve> 
 CNSsolve>set message off echo off end 
 CNSsolve> 
 CNSsolve> 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>!set the energy flags: 
 CNSsolve>@@RUN:protocols/flags_new.cns(Iteration=$Iteration; Data=$Data; ) 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/protocols/flags_new.cns opened.
 CNSsolve>!$Revision: 1.3 $ 
 CNSsolve>!$Date: 2016/02/17 13:34:52 $ 
 CNSsolve>!$RCSfile: rcsb104565.mr,v $ 
 CNSsolve> 
 CNSsolve>module(Iteration; Data; ) 
 &_2_ITERATION set to $_1_ITERATION 
 &_2_DATA set to $_1_DATA 
 CNSsolve> 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>if (&Data.cdih.on eq true) then 
 NEXTCD: condition evaluated as true
 CNSsolve>   evaluate (&Data.flags.cdih =  true) 
 EVALUATE: symbol $_1_DATA.FLAGS.CDIH set to TRUE (logical)
 CNSsolve>end if 
 CNSsolve>if (&Data.cdihcsi.on eq true) then 
 NEXTCD: condition evaluated as false
 CNSsolve>   evaluate (&Data.flags.cdih =  true) 
 CNSsolve>end if 
 CNSsolve>if (&Data.cdihtalos.on eq true) then 
 NEXTCD: condition evaluated as true
 CNSsolve>   evaluate (&Data.flags.cdih =  true) 
 EVALUATE: symbol $_1_DATA.FLAGS.CDIH set to TRUE (logical)
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>if     (&Data.c1_on eq true) then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.coup =  true) 
 CNSsolve>elseif (&Data.c2_on eq true) then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.coup =  true) 
 CNSsolve>elseif (&Data.c3_on eq true) then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.coup =  true) 
 CNSsolve>elseif (&Data.c4_on eq true) then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.coup =  true) 
 CNSsolve>elseif (&Data.c5_on eq true) then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.coup =  true) 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve>if (&Data.relax_choice eq "DANI") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.dani = true) 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve>if (&Data.rdc1_choice eq "SANI") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.sani = true) 
 CNSsolve>elseif (&Data.rdc2_choice eq "SANI") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.sani = true) 
 CNSsolve>elseif (&Data.rdc3_choice eq "SANI") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.sani = true) 
 CNSsolve>elseif (&Data.rdc4_choice eq "SANI") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.sani = true) 
 CNSsolve>elseif (&Data.rdc5_choice eq "SANI") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.sani = true) 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve>if (&Data.flags.dani eq TRUE) then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.harm = true) 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve>if (&Data.flags.sani eq TRUE) then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.harm = true) 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve>if (&Data.rdc1_choice eq "VANGLE") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.vean = true) 
 CNSsolve>end if 
 CNSsolve>if (&Data.rdc2_choice eq "VANGLE") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.vean = true) 
 CNSsolve>end if 
 CNSsolve>if (&Data.rdc3_choice eq "VANGLE") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.vean = true) 
 CNSsolve>end if 
 CNSsolve>if (&Data.rdc4_choice eq "VANGLE") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.vean = true) 
 CNSsolve>end if 
 CNSsolve>if (&Data.rdc5_choice eq "VANGLE") then 
 NEXTCD: condition evaluated as false
 CNSsolve>  evaluate (&Data.flags.vean = true) 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve>flags exclude * end 
 CNSsolve>if (&Data.flags.bonds = TRUE) then 
 NEXTCD: condition evaluated as true
 CNSsolve>   flags include bonds end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.angle = TRUE) then 
 NEXTCD: condition evaluated as true
 CNSsolve>   flags include angle end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.impro = TRUE) then 
 NEXTCD: condition evaluated as true
 CNSsolve>   flags include improper end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.dihed = TRUE) then 
 NEXTCD: condition evaluated as true
 CNSsolve>   flags include dihedrals end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.vdw   = TRUE) then 
 NEXTCD: condition evaluated as true
 CNSsolve>   flags include vdw end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.elec  = TRUE) then 
 NEXTCD: condition evaluated as false
 CNSsolve>   flags include elec end 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve>if (&Data.flags.noe  =  TRUE) then 
 NEXTCD: condition evaluated as true
 CNSsolve>   flags include noe end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.cdih =  TRUE) then 
 NEXTCD: condition evaluated as true
 CNSsolve>   flags include cdih end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.coup =  TRUE) then 
 NEXTCD: condition evaluated as false
 CNSsolve>   flags include coup end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.vean =  TRUE) then 
 NEXTCD: condition evaluated as false
 CNSsolve>   flags include vean end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.sani =  TRUE) then 
 NEXTCD: condition evaluated as false
 CNSsolve>   flags include sani end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.dani =  TRUE) then 
 NEXTCD: condition evaluated as false
 CNSsolve>   flags include dani end 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve>if (&Data.flags.plan =  TRUE) then 
 NEXTCD: condition evaluated as false
 CNSsolve>   flags include plan end 
 CNSsolve>end if 
 CNSsolve>if (&Data.flags.ncs  =  TRUE) then 
 NEXTCD: condition evaluated as false
 CNSsolve>   flags include ncs end 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve>!read the .psf files: 
 CNSsolve>evaluate ($psfcount = 1) 
 EVALUATE: symbol $PSFCOUNT set to    1.00000     (real)
 CNSsolve>while ($psfcount le 5) loop pars 
 NEXTCD: condition evaluated as true
 CNSsolve>   if ($filenames.structure_$psfcount ne "") then 
 NEXTCD: condition evaluated as true
 CNSsolve>      evaluate ($structurefile = "RUN:begin/" + $Filenames.structure_$psfcount) 
 EVALUATE: symbol $STRUCTUREFILE set to "RUN:begin/ww1.psf" (string)
 CNSsolve>      structure @@$structurefile end 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/begin/ww1.psf opened.
 STRUcture>data_cns_mtf 
 REMARKS FILENAME="/usr/lab/people/fkieken/ww1/run12/begin/ww1.psf"
 REMARKS  TOPH19.pep -MACRO for protein sequence
 REMARKS DATE:02-Mar-2010  10:50:07       created by user: fkieken
 REMARKS VERSION:1.1
 Status of internal molecular topology database:
 -> NATOM=        622(MAXA=       40000)  NBOND=        634(MAXB=       40000)
 -> NTHETA=      1143(MAXT=       80000)  NGRP=          41(MAXGRP=     40000)
 -> NPHI=         876(MAXP=       80000)  NIMPHI=       348(MAXIMP=     40000)
 -> NNB=          108(MAXNB=      40000) 
 STRUcture> 
 STRUcture> end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($psfcount = $psfcount + 1) 
 EVALUATE: symbol $PSFCOUNT set to    2.00000     (real)
 CNSsolve>end loop pars 
 CNSsolve>while ($psfcount le 5) loop pars 
 NEXTCD: condition evaluated as true
 CNSsolve>   if ($filenames.structure_$psfcount ne "") then 
 NEXTCD: condition evaluated as false
 CNSsolve>      evaluate ($structurefile = "RUN:begin/" + $Filenames.structure_$psfcount) 
 CNSsolve>      structure @@$structurefile end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($psfcount = $psfcount + 1) 
 EVALUATE: symbol $PSFCOUNT set to    3.00000     (real)
 CNSsolve>end loop pars 
 CNSsolve>while ($psfcount le 5) loop pars 
 NEXTCD: condition evaluated as true
 CNSsolve>   if ($filenames.structure_$psfcount ne "") then 
 NEXTCD: condition evaluated as false
 CNSsolve>      evaluate ($structurefile = "RUN:begin/" + $Filenames.structure_$psfcount) 
 CNSsolve>      structure @@$structurefile end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($psfcount = $psfcount + 1) 
 EVALUATE: symbol $PSFCOUNT set to    4.00000     (real)
 CNSsolve>end loop pars 
 CNSsolve>while ($psfcount le 5) loop pars 
 NEXTCD: condition evaluated as true
 CNSsolve>   if ($filenames.structure_$psfcount ne "") then 
 NEXTCD: condition evaluated as false
 CNSsolve>      evaluate ($structurefile = "RUN:begin/" + $Filenames.structure_$psfcount) 
 CNSsolve>      structure @@$structurefile end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($psfcount = $psfcount + 1) 
 EVALUATE: symbol $PSFCOUNT set to    5.00000     (real)
 CNSsolve>end loop pars 
 CNSsolve>while ($psfcount le 5) loop pars 
 NEXTCD: condition evaluated as true
 CNSsolve>   if ($filenames.structure_$psfcount ne "") then 
 NEXTCD: condition evaluated as false
 CNSsolve>      evaluate ($structurefile = "RUN:begin/" + $Filenames.structure_$psfcount) 
 CNSsolve>      structure @@$structurefile end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($psfcount = $psfcount + 1) 
 EVALUATE: symbol $PSFCOUNT set to    6.00000     (real)
 CNSsolve>end loop pars 
 CNSsolve>while ($psfcount le 5) loop pars 
 NEXTCD: condition evaluated as false
 CNSsolve>   if ($filenames.structure_$psfcount ne "") then 
 CNSsolve>      evaluate ($structurefile = "RUN:begin/" + $Filenames.structure_$psfcount) 
 CNSsolve>      structure @@$structurefile end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($psfcount = $psfcount + 1) 
 CNSsolve>end loop pars 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>evaluate ($templatefile = "RUN:" + "begin/" + $Filenames.template) 
 EVALUATE: symbol $TEMPLATEFILE set to "RUN:begin/ww1_template.pdb" (string)
 CNSsolve>coor @@$templatefile 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/begin/ww1_template.pdb opened.
 COOR>REMARK FILENAME="/usr/lab/people/fkieken/ww1/run12/begin/ww1_template.pdb" 
 COOR>REMARK produced by nmr/generate_template.inp 
 COOR>REMARK DATE:02-Mar-2010  10:50:16       created by user: fkieken 
 COOR>REMARK VERSION:1.1 
 COOR>ATOM      1  HA1 GLY     1      10.243   1.575  -2.925  1.00  0.00 
 COOR>ATOM      2  HA2 GLY     1      10.302   0.264  -4.094  1.00  0.00 
 CNSsolve>delete selection=(not known) end 
 SELRPN:      0 atoms have been selected out of    622
 Status of internal molecular topology database:
 -> NATOM=        622(MAXA=       40000)  NBOND=        634(MAXB=       40000)
 -> NTHETA=      1143(MAXT=       80000)  NGRP=          41(MAXGRP=     40000)
 -> NPHI=         876(MAXP=       80000)  NIMPHI=       348(MAXIMP=     40000)
 -> NNB=          108(MAXNB=      40000) 
 CNSsolve>delete selection=(resname ANI) end 
 SELRPN:      0 atoms have been selected out of    622
 Status of internal molecular topology database:
 -> NATOM=        622(MAXA=       40000)  NBOND=        634(MAXB=       40000)
 -> NTHETA=      1143(MAXT=       80000)  NGRP=          41(MAXGRP=     40000)
 -> NPHI=         876(MAXP=       80000)  NIMPHI=       348(MAXIMP=     40000)
 -> NNB=          108(MAXNB=      40000) 
 CNSsolve> 
 CNSsolve>if ($Data.flags.dani = true) then 
 NEXTCD: condition evaluated as false
 CNSsolve>  structure @@RUN:toppar/tensor.psf end 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>if ($Data.flags.sani = true) then 
 NEXTCD: condition evaluated as false
 CNSsolve>  structure @@RUN:toppar/tensor.psf end 
 CNSsolve>end if 
 CNSsolve> 
 CNSsolve>!read the parameter files: 
 CNSsolve>evaluate ($par_nonbonded = $toppar.par_nonbonded) 
 EVALUATE: symbol $PAR_NONBONDED set to "PROLSQ" (string)
 CNSsolve>evaluate ($parcount = 1) 
 EVALUATE: symbol $PARCOUNT set to    1.00000     (real)
 CNSsolve>while ($parcount le 5) loop pars 
 NEXTCD: condition evaluated as true
 CNSsolve>   if ($Toppar.prot_par_$parcount ne "") then 
 NEXTCD: condition evaluated as true
 CNSsolve>      evaluate($prot_par_file= "RUN:toppar/" + $Toppar.prot_par_$parcount) 
 EVALUATE: symbol $PROT_PAR_FILE set to "RUN:toppar/parallhdg5.3.pro" (string)
 CNSsolve>      parameter @@$prot_par_file end 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/toppar/parallhdg5.3.pro opened.
 PARRDR>remark   file protein-allhdg-ucl.param  version UCL  date 07-JUL-01 
 PARRDR>remark   for file protein-allhdg-ucl.top  version UCL  date 14-MAR-00 
 PARRDR>remark   for file protein-allhdg-dih-ucl.top  version UCL  date 07-JUL-01 
 PARRDR>remark   Geometric energy function parameters for distance geometry and 
 PARRDR>remark   simulated annealing. 
 PARRDR>remark   Original author: Michael Nilges, EMBL Heidelberg 
 PARRDR>remark   Modifications: Mark A. Williams, UCL London 
 PARRDR> 
 PARRDR>set echo off message off end 
 PARRDR> end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($parcount = $parcount + 1) 
 EVALUATE: symbol $PARCOUNT set to    3.00000     (real)
 CNSsolve>end loop pars 
 CNSsolve>while ($parcount le 5) loop pars 
 NEXTCD: condition evaluated as true
 CNSsolve>   if ($Toppar.prot_par_$parcount ne "") then 
 NEXTCD: condition evaluated as false
 CNSsolve>      evaluate($prot_par_file= "RUN:toppar/" + $Toppar.prot_par_$parcount) 
 CNSsolve>      parameter @@$prot_par_file end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($parcount = $parcount + 1) 
 EVALUATE: symbol $PARCOUNT set to    4.00000     (real)
 CNSsolve>end loop pars 
 CNSsolve>while ($parcount le 5) loop pars 
 NEXTCD: condition evaluated as true
 CNSsolve>   if ($Toppar.prot_par_$parcount ne "") then 
 NEXTCD: condition evaluated as false
 CNSsolve>      evaluate($prot_par_file= "RUN:toppar/" + $Toppar.prot_par_$parcount) 
 CNSsolve>      parameter @@$prot_par_file end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($parcount = $parcount + 1) 
 EVALUATE: symbol $PARCOUNT set to    5.00000     (real)
 CNSsolve>end loop pars 
 CNSsolve>while ($parcount le 5) loop pars 
 NEXTCD: condition evaluated as true
 CNSsolve>   if ($Toppar.prot_par_$parcount ne "") then 
 NEXTCD: condition evaluated as false
 CNSsolve>      evaluate($prot_par_file= "RUN:toppar/" + $Toppar.prot_par_$parcount) 
 CNSsolve>      parameter @@$prot_par_file end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($parcount = $parcount + 1) 
 EVALUATE: symbol $PARCOUNT set to    6.00000     (real)
 CNSsolve>end loop pars 
 CNSsolve>while ($parcount le 5) loop pars 
 NEXTCD: condition evaluated as false
 CNSsolve>   if ($Toppar.prot_par_$parcount ne "") then 
 CNSsolve>      evaluate($prot_par_file= "RUN:toppar/" + $Toppar.prot_par_$parcount) 
 CNSsolve>      parameter @@$prot_par_file end 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($parcount = $parcount + 1) 
 CNSsolve>end loop pars 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>noe 
 NOE>        reset 
 NOE>        nrestraints = 100000                   ! allocate space for NOEs 
 NOE: allocating space for  100000 restraints.
 NOE>        ceiling 1000 
 NOE>  
 NOE>        class      DIST 
 NOE> 
 NOE>        evaluate ($ispectrum = 0) 
 EVALUATE: symbol $ISPECTRUM set to    0.00000     (real)
 NOE>        while ($ispectrum < $Spectra.nspectra) loop read 
 NEXTCD: condition evaluated as true
 NOE>           evaluate ($ispectrum = $ispectrum + 1) 
 EVALUATE: symbol $ISPECTRUM set to    1.00000     (real)
 NOE>           evaluate ($file = "NEWIT:" + $Spectra.namelist_$ispectrum + ".tbl") 
 EVALUATE: symbol $FILE set to "NEWIT:13c.tbl" (string)
 NOE>           class $Spectra.namelist_$ispectrum 
 NOE>           set echo off message off end 
 reading restraint     1
 restraint successfully read:     1
 reading restraint     2
 restraint successfully read:     3
 reading restraint     3
 restraint successfully read:     4
 reading restraint     4
 restraint successfully read:     5
 reading restraint     5
 restraint successfully read:     6
 reading restraint     6
 restraint successfully read:     7
 reading restraint     7
 restraint successfully read:     8
 reading restraint     8
 restraint successfully read:    11
 reading restraint     9
 restraint successfully read:    12
 reading restraint    10
 restraint successfully read:    13
 reading restraint    11
 restraint successfully read:    14
 reading restraint    12
 restraint successfully read:    15
 reading restraint    13
 restraint successfully read:    16
 reading restraint    14
 restraint successfully read:    17
 reading restraint    15
 restraint successfully read:    18
 reading restraint    16
 restraint successfully read:    21
 reading restraint    17
 restraint successfully read:    23
 reading restraint    18
 restraint successfully read:    24
 reading restraint    19
 restraint successfully read:    25
 reading restraint    20
 restraint successfully read:    26
 reading restraint    21
 restraint successfully read:    28
 reading restraint    22
 restraint successfully read:    29
 reading restraint    23
 restraint successfully read:    30
 reading restraint    24
 restraint successfully read:    31
 reading restraint    25
 restraint successfully read:    32
 reading restraint    26
 restraint successfully read:    33
 reading restraint    27
 restraint successfully read:    34
 reading restraint    28
 restraint successfully read:    35
 reading restraint    29
 restraint successfully read:    36
 reading restraint    30
 restraint successfully read:    43
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 restraint successfully read:   808
 reading restraint   612
 restraint successfully read:   813
 reading restraint   613
 restraint successfully read:   814
 reading restraint   614
 restraint successfully read:   815
 reading restraint   615
 restraint successfully read:   816
 reading restraint   616
 restraint successfully read:   817
 reading restraint   617
 restraint successfully read:   820
 reading restraint   618
 restraint successfully read:   821
 reading restraint   619
 restraint successfully read:   822
 reading restraint   620
 restraint successfully read:   823
 reading restraint   621
 restraint successfully read:   826
 reading restraint   622
 restraint successfully read:   827
 reading restraint   623
 restraint successfully read:   831
 reading restraint   624
 restraint successfully read:   832
 reading restraint   625
 restraint successfully read:   835
 reading restraint   626
 restraint successfully read:   836
 reading restraint   627
 restraint successfully read:   839
 reading restraint   628
 restraint successfully read:   840
 reading restraint   629
 restraint successfully read:   845
 reading restraint   630
 restraint successfully read:   847
 reading restraint   631
 restraint successfully read:   848
 reading restraint   632
 restraint successfully read:   849
 reading restraint   633
 restraint successfully read:   850
 reading restraint   634
 restraint successfully read:   851
 reading restraint   635
 restraint successfully read:   852
 reading restraint   636
 restraint successfully read:   853
 reading restraint   637
 restraint successfully read:   856
 reading restraint   638
 restraint successfully read:   858
 reading restraint   639
 restraint successfully read:   859
 reading restraint   640
 restraint successfully read:   860
 reading restraint   641
 restraint successfully read:   861
 reading restraint   642
 restraint successfully read:   862
 reading restraint   643
 restraint successfully read:   863
 reading restraint   644
 restraint successfully read:   865
 reading restraint   645
 restraint successfully read:   866
 reading restraint   646
 restraint successfully read:   867
 reading restraint   647
 restraint successfully read:   868
 reading restraint   648
 restraint successfully read:   869
 reading restraint   649
 restraint successfully read:   871
 reading restraint   650
 restraint successfully read:   872
 reading restraint   651
 restraint successfully read:   875
 reading restraint   652
 restraint successfully read:   876
 reading restraint   653
 restraint successfully read:   877
 reading restraint   654
 restraint successfully read:   886
 NOE>        end loop read 
 NOE>        while ($ispectrum < $Spectra.nspectra) loop read 
 NEXTCD: condition evaluated as true
 NOE>           evaluate ($ispectrum = $ispectrum + 1) 
 EVALUATE: symbol $ISPECTRUM set to    2.00000     (real)
 NOE>           evaluate ($file = "NEWIT:" + $Spectra.namelist_$ispectrum + ".tbl") 
 EVALUATE: symbol $FILE set to "NEWIT:15n.tbl" (string)
 NOE>           class $Spectra.namelist_$ispectrum 
 NOE>           set echo off message off end 
 reading restraint   655
 restraint successfully read:     1
 reading restraint   656
 restraint successfully read:     1
 reading restraint   657
 restraint successfully read:     2
 reading restraint   658
 restraint successfully read:     3
 reading restraint   659
 restraint successfully read:     4
 reading restraint   660
 restraint successfully read:     5
 reading restraint   661
 restraint successfully read:     6
 reading restraint   662
 restraint successfully read:     7
 reading restraint   663
 restraint successfully read:     8
 reading restraint   664
 restraint successfully read:     9
 reading restraint   665
 restraint successfully read:    10
 reading restraint   666
 restraint successfully read:    11
 reading restraint   667
 restraint successfully read:    13
 reading restraint   668
 restraint successfully read:    14
 reading restraint   669
 restraint successfully read:    15
 reading restraint   670
 restraint successfully read:    16
 reading restraint   671
 restraint successfully read:    17
 reading restraint   672
 restraint successfully read:    18
 reading restraint   673
 restraint successfully read:    19
 reading restraint   674
 restraint successfully read:    20
 reading restraint   675
 restraint successfully read:    21
 reading restraint   676
 restraint successfully read:    22
 reading restraint   677
 restraint successfully read:    23
 reading restraint   678
 restraint successfully read:    24
 reading restraint   679
 restraint successfully read:    25
 reading restraint   680
 restraint successfully read:    26
 reading restraint   681
 restraint successfully read:    27
 reading restraint   682
 restraint successfully read:    28
 reading restraint   683
 restraint successfully read:    29
 reading restraint   684
 restraint successfully read:    30
 reading restraint   685
 restraint successfully read:    33
 reading restraint   686
 restraint successfully read:    34
 reading restraint   687
 restraint successfully read:    35
 reading restraint   688
 restraint successfully read:    36
 reading restraint   689
 restraint successfully read:    37
 reading restraint   690
 restraint successfully read:    38
 reading restraint   691
 restraint successfully read:    39
 reading restraint   692
 restraint successfully read:    40
 reading restraint   693
 restraint successfully read:    41
 reading restraint   694
 restraint successfully read:    43
 reading restraint   695
 restraint successfully read:    44
 reading restraint   696
 restraint successfully read:    45
 reading restraint   697
 restraint successfully read:    46
 reading restraint   698
 restraint successfully read:    47
 reading restraint   699
 restraint successfully read:    48
 reading restraint   700
 restraint successfully read:    49
 reading restraint   701
 restraint successfully read:    50
 reading restraint   702
 restraint successfully read:    51
 reading restraint   703
 restraint successfully read:    52
 reading restraint   704
 restraint successfully read:    53
 reading restraint   705
 restraint successfully read:    54
 reading restraint   706
 restraint successfully read:    55
 reading restraint   707
 restraint successfully read:    56
 reading restraint   708
 restraint successfully read:    57
 reading restraint   709
 restraint successfully read:    58
 reading restraint   710
 restraint successfully read:    59
 reading restraint   711
 restraint successfully read:    60
 reading restraint   712
 restraint successfully read:    61
 reading restraint   713
 restraint successfully read:    62
 reading restraint   714
 restraint successfully read:    64
 reading restraint   715
 restraint successfully read:    65
 reading restraint   716
 restraint successfully read:    67
 reading restraint   717
 restraint successfully read:    68
 reading restraint   718
 restraint successfully read:    69
 reading restraint   719
 restraint successfully read:    70
 reading restraint   720
 restraint successfully read:    71
 reading restraint   721
 restraint successfully read:    72
 reading restraint   722
 restraint successfully read:    74
 reading restraint   723
 restraint successfully read:    75
 reading restraint   724
 restraint successfully read:    76
 reading restraint   725
 restraint successfully read:    77
 reading restraint   726
 restraint successfully read:    78
 reading restraint   727
 restraint successfully read:    79
 reading restraint   728
 restraint successfully read:    80
 reading restraint   729
 restraint successfully read:    81
 reading restraint   730
 restraint successfully read:    82
 reading restraint   731
 restraint successfully read:    83
 reading restraint   732
 restraint successfully read:    84
 reading restraint   733
 restraint successfully read:    85
 reading restraint   734
 restraint successfully read:    87
 reading restraint   735
 restraint successfully read:    88
 reading restraint   736
 restraint successfully read:    89
 reading restraint   737
 restraint successfully read:    90
 reading restraint   738
 restraint successfully read:    91
 reading restraint   739
 restraint successfully read:    92
 reading restraint   740
 restraint successfully read:    93
 reading restraint   741
 restraint successfully read:    94
 reading restraint   742
 restraint successfully read:    95
 reading restraint   743
 restraint successfully read:    96
 reading restraint   744
 restraint successfully read:    97
 reading restraint   745
 restraint successfully read:    98
 reading restraint   746
 restraint successfully read:    99
 reading restraint   747
 restraint successfully read:   101
 reading restraint   748
 restraint successfully read:   103
 reading restraint   749
 restraint successfully read:   104
 reading restraint   750
 restraint successfully read:   105
 reading restraint   751
 restraint successfully read:   106
 reading restraint   752
 restraint successfully read:   107
 reading restraint   753
 restraint successfully read:   108
 reading restraint   754
 restraint successfully read:   109
 reading restraint   755
 restraint successfully read:   110
 reading restraint   756
 restraint successfully read:   111
 reading restraint   757
 restraint successfully read:   112
 reading restraint   758
 restraint successfully read:   113
 reading restraint   759
 restraint successfully read:   114
 reading restraint   760
 restraint successfully read:   115
 reading restraint   761
 restraint successfully read:   116
 reading restraint   762
 restraint successfully read:   117
 reading restraint   763
 restraint successfully read:   118
 reading restraint   764
 restraint successfully read:   119
 reading restraint   765
 restraint successfully read:   120
 reading restraint   766
 restraint successfully read:   121
 reading restraint   767
 restraint successfully read:   122
 reading restraint   768
 restraint successfully read:   123
 reading restraint   769
 restraint successfully read:   124
 reading restraint   770
 restraint successfully read:   125
 reading restraint   771
 restraint successfully read:   126
 reading restraint   772
 restraint successfully read:   127
 reading restraint   773
 restraint successfully read:   128
 reading restraint   774
 restraint successfully read:   130
 reading restraint   775
 restraint successfully read:   131
 reading restraint   776
 restraint successfully read:   132
 reading restraint   777
 restraint successfully read:   133
 reading restraint   778
 restraint successfully read:   134
 reading restraint   779
 restraint successfully read:   135
 reading restraint   780
 restraint successfully read:   136
 reading restraint   781
 restraint successfully read:   137
 reading restraint   782
 restraint successfully read:   138
 reading restraint   783
 restraint successfully read:   139
 reading restraint   784
 restraint successfully read:   140
 reading restraint   785
 restraint successfully read:   141
 reading restraint   786
 restraint successfully read:   142
 reading restraint   787
 restraint successfully read:   143
 reading restraint   788
 restraint successfully read:   144
 reading restraint   789
 restraint successfully read:   145
 reading restraint   790
 restraint successfully read:   146
 reading restraint   791
 restraint successfully read:   147
 reading restraint   792
 restraint successfully read:   148
 reading restraint   793
 restraint successfully read:   149
 reading restraint   794
 restraint successfully read:   150
 reading restraint   795
 restraint successfully read:   151
 reading restraint   796
 restraint successfully read:   152
 reading restraint   797
 restraint successfully read:   153
 reading restraint   798
 restraint successfully read:   154
 reading restraint   799
 restraint successfully read:   155
 reading restraint   800
 restraint successfully read:   156
 reading restraint   801
 restraint successfully read:   157
 reading restraint   802
 restraint successfully read:   158
 reading restraint   803
 restraint successfully read:   159
 reading restraint   804
 restraint successfully read:   160
 reading restraint   805
 restraint successfully read:   161
 reading restraint   806
 restraint successfully read:   162
 reading restraint   807
 restraint successfully read:   163
 reading restraint   808
 restraint successfully read:   166
 reading restraint   809
 restraint successfully read:   167
 reading restraint   810
 restraint successfully read:   168
 reading restraint   811
 restraint successfully read:   169
 reading restraint   812
 restraint successfully read:   170
 reading restraint   813
 restraint successfully read:   171
 reading restraint   814
 restraint successfully read:   172
 reading restraint   815
 restraint successfully read:   173
 reading restraint   816
 restraint successfully read:   175
 reading restraint   817
 restraint successfully read:   176
 reading restraint   818
 restraint successfully read:   177
 reading restraint   819
 restraint successfully read:   178
 reading restraint   820
 restraint successfully read:   179
 reading restraint   821
 restraint successfully read:   180
 reading restraint   822
 restraint successfully read:   181
 reading restraint   823
 restraint successfully read:   182
 reading restraint   824
 restraint successfully read:   183
 reading restraint   825
 restraint successfully read:   184
 reading restraint   826
 restraint successfully read:   185
 reading restraint   827
 restraint successfully read:   186
 reading restraint   828
 restraint successfully read:   187
 reading restraint   829
 restraint successfully read:   188
 reading restraint   830
 restraint successfully read:   189
 reading restraint   831
 restraint successfully read:   190
 reading restraint   832
 restraint successfully read:   191
 reading restraint   833
 restraint successfully read:   192
 reading restraint   834
 restraint successfully read:   193
 reading restraint   835
 restraint successfully read:   196
 reading restraint   836
 restraint successfully read:   197
 reading restraint   837
 restraint successfully read:   198
 reading restraint   838
 restraint successfully read:   199
 reading restraint   839
 restraint successfully read:   200
 reading restraint   840
 restraint successfully read:   201
 reading restraint   841
 restraint successfully read:   202
 reading restraint   842
 restraint successfully read:   203
 reading restraint   843
 restraint successfully read:   204
 reading restraint   844
 restraint successfully read:   205
 reading restraint   845
 restraint successfully read:   206
 reading restraint   846
 restraint successfully read:   207
 reading restraint   847
 restraint successfully read:   208
 reading restraint   848
 restraint successfully read:   209
 reading restraint   849
 restraint successfully read:   211
 reading restraint   850
 restraint successfully read:   212
 reading restraint   851
 restraint successfully read:   213
 reading restraint   852
 restraint successfully read:   214
 reading restraint   853
 restraint successfully read:   215
 reading restraint   854
 restraint successfully read:   216
 reading restraint   855
 restraint successfully read:   217
 reading restraint   856
 restraint successfully read:   218
 reading restraint   857
 restraint successfully read:   219
 reading restraint   858
 restraint successfully read:   220
 reading restraint   859
 restraint successfully read:   221
 reading restraint   860
 restraint successfully read:   222
 reading restraint   861
 restraint successfully read:   224
 reading restraint   862
 restraint successfully read:   225
 reading restraint   863
 restraint successfully read:   226
 reading restraint   864
 restraint successfully read:   227
 reading restraint   865
 restraint successfully read:   228
 reading restraint   866
 restraint successfully read:   230
 reading restraint   867
 restraint successfully read:   231
 reading restraint   868
 restraint successfully read:   232
 reading restraint   869
 restraint successfully read:   233
 reading restraint   870
 restraint successfully read:   234
 reading restraint   871
 restraint successfully read:   236
 reading restraint   872
 restraint successfully read:   237
 reading restraint   873
 restraint successfully read:   238
 reading restraint   874
 restraint successfully read:   239
 reading restraint   875
 restraint successfully read:   240
 reading restraint   876
 restraint successfully read:   241
 reading restraint   877
 restraint successfully read:   242
 reading restraint   878
 restraint successfully read:   243
 reading restraint   879
 restraint successfully read:   245
 reading restraint   880
 restraint successfully read:   246
 reading restraint   881
 restraint successfully read:   247
 reading restraint   882
 restraint successfully read:   248
 reading restraint   883
 restraint successfully read:   249
 reading restraint   884
 restraint successfully read:   250
 reading restraint   885
 restraint successfully read:   251
 reading restraint   886
 restraint successfully read:   252
 reading restraint   887
 restraint successfully read:   253
 reading restraint   888
 restraint successfully read:   254
 reading restraint   889
 restraint successfully read:   255
 reading restraint   890
 restraint successfully read:   256
 reading restraint   891
 restraint successfully read:   257
 reading restraint   892
 restraint successfully read:   258
 reading restraint   893
 restraint successfully read:   259
 reading restraint   894
 restraint successfully read:   260
 reading restraint   895
 restraint successfully read:   262
 reading restraint   896
 restraint successfully read:   263
 reading restraint   897
 restraint successfully read:   264
 reading restraint   898
 restraint successfully read:   265
 reading restraint   899
 restraint successfully read:   266
 NOE>        end loop read 
 NOE>        while ($ispectrum < $Spectra.nspectra) loop read 
 NEXTCD: condition evaluated as true
 NOE>           evaluate ($ispectrum = $ispectrum + 1) 
 EVALUATE: symbol $ISPECTRUM set to    3.00000     (real)
 NOE>           evaluate ($file = "NEWIT:" + $Spectra.namelist_$ispectrum + ".tbl") 
 EVALUATE: symbol $FILE set to "NEWIT:aro.tbl" (string)
 NOE>           class $Spectra.namelist_$ispectrum 
 NOE>           set echo off message off end 
 reading restraint   900
 restraint successfully read:     1
 reading restraint   901
 restraint successfully read:     2
 reading restraint   902
 restraint successfully read:     3
 reading restraint   903
 restraint successfully read:     4
 reading restraint   904
 restraint successfully read:     5
 reading restraint   905
 restraint successfully read:     6
 reading restraint   906
 restraint successfully read:     7
 reading restraint   907
 restraint successfully read:     8
 reading restraint   908
 restraint successfully read:     9
 reading restraint   909
 restraint successfully read:    11
 reading restraint   910
 restraint successfully read:    12
 reading restraint   911
 restraint successfully read:    13
 reading restraint   912
 restraint successfully read:    14
 reading restraint   913
 restraint successfully read:    15
 reading restraint   914
 restraint successfully read:    16
 reading restraint   915
 restraint successfully read:    17
 reading restraint   916
 restraint successfully read:    18
 reading restraint   917
 restraint successfully read:    19
 reading restraint   918
 restraint successfully read:    20
 reading restraint   919
 restraint successfully read:    21
 reading restraint   920
 restraint successfully read:    22
 reading restraint   921
 restraint successfully read:    23
 reading restraint   922
 restraint successfully read:    24
 reading restraint   923
 restraint successfully read:    25
 reading restraint   924
 restraint successfully read:    26
 reading restraint   925
 restraint successfully read:    29
 reading restraint   926
 restraint successfully read:    32
 reading restraint   927
 restraint successfully read:    34
 reading restraint   928
 restraint successfully read:    35
 reading restraint   929
 restraint successfully read:    38
 reading restraint   930
 restraint successfully read:    39
 reading restraint   931
 restraint successfully read:    40
 reading restraint   932
 restraint successfully read:    42
 reading restraint   933
 restraint successfully read:    45
 reading restraint   934
 restraint successfully read:    50
 reading restraint   935
 restraint successfully read:    51
 reading restraint   936
 restraint successfully read:    52
 reading restraint   937
 restraint successfully read:    53
 reading restraint   938
 restraint successfully read:    54
 reading restraint   939
 restraint successfully read:    56
 reading restraint   940
 restraint successfully read:    58
 reading restraint   941
 restraint successfully read:    59
 reading restraint   942
 restraint successfully read:    60
 reading restraint   943
 restraint successfully read:    61
 reading restraint   944
 restraint successfully read:    66
 reading restraint   945
 restraint successfully read:    67
 reading restraint   946
 restraint successfully read:    68
 reading restraint   947
 restraint successfully read:    69
 reading restraint   948
 restraint successfully read:    70
 reading restraint   949
 restraint successfully read:    71
 reading restraint   950
 restraint successfully read:    72
 reading restraint   951
 restraint successfully read:    73
 reading restraint   952
 restraint successfully read:    74
 reading restraint   953
 restraint successfully read:    75
 reading restraint   954
 restraint successfully read:    77
 reading restraint   955
 restraint successfully read:    78
 reading restraint   956
 restraint successfully read:    79
 reading restraint   957
 restraint successfully read:    80
 reading restraint   958
 restraint successfully read:    81
 reading restraint   959
 restraint successfully read:    82
 reading restraint   960
 restraint successfully read:    83
 reading restraint   961
 restraint successfully read:    84
 reading restraint   962
 restraint successfully read:    85
 reading restraint   963
 restraint successfully read:    86
 reading restraint   964
 restraint successfully read:    89
 reading restraint   965
 restraint successfully read:    90
 reading restraint   966
 restraint successfully read:    91
 reading restraint   967
 restraint successfully read:    92
 reading restraint   968
 restraint successfully read:    93
 reading restraint   969
 restraint successfully read:    95
 reading restraint   970
 restraint successfully read:    96
 reading restraint   971
 restraint successfully read:    97
 reading restraint   972
 restraint successfully read:    98
 reading restraint   973
 restraint successfully read:    99
 reading restraint   974
 restraint successfully read:   100
 reading restraint   975
 restraint successfully read:   101
 reading restraint   976
 restraint successfully read:   102
 reading restraint   977
 restraint successfully read:   103
 reading restraint   978
 restraint successfully read:   104
 reading restraint   979
 restraint successfully read:   105
 reading restraint   980
 restraint successfully read:   106
 reading restraint   981
 restraint successfully read:   107
 reading restraint   982
 restraint successfully read:   109
 reading restraint   983
 restraint successfully read:   111
 reading restraint   984
 restraint successfully read:   112
 reading restraint   985
 restraint successfully read:   113
 reading restraint   986
 restraint successfully read:   114
 reading restraint   987
 restraint successfully read:   115
 reading restraint   988
 restraint successfully read:   116
 reading restraint   989
 restraint successfully read:   117
 NOE>        end loop read 
 NOE>        while ($ispectrum < $Spectra.nspectra) loop read 
 NEXTCD: condition evaluated as false
 NOE>           evaluate ($ispectrum = $ispectrum + 1) 
 NOE>           evaluate ($file = "NEWIT:" + $Spectra.namelist_$ispectrum + ".tbl") 
 NOE>           class $Spectra.namelist_$ispectrum 
 NOE>           set echo off message off end 
 NOE>           @@$file 
 NOE>           set echo on message on end 
 NOE>        end loop read 
 NOE> 
 NOE>        set echo on message on end 
 NOE> 
 NOE>        averaging  DIST sum 
 NOE>        potential  DIST soft 
 NOE>        scale      DIST 1.0 
 NOE>        sqconstant DIST 1.0 
 NOE>        sqexponent DIST 2 
 NOE>        soexponent DIST 1 
 NOE>        rswitch    DIST 1.0 
 NOE>        sqoffset   DIST 0.0 
 NOE>        asymptote  DIST 2.0 
 NOE> 
 NOE>        msoexponent DIST 1 
 NOE>        masymptote  DIST 2.0 
 NOE>        mrswitch    DIST 1.0 
 NOE>end 
 CNSsolve> 
 CNSsolve>! define methyle groups and other equivalent groups - store in store9 
 CNSsolve>!   since store2 is used by calibrate.cns 
 CNSsolve>! we cannot do this before the data are read because the .tbl uses 
 CNSsolve>! store1 and store2 
 CNSsolve>@RUN:protocols/define_methyls_all.cns 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/protocols/define_methyls_all.cns opened.
 CNSsolve>!$Revision: 1.3 $ 
 CNSsolve>!$Date: 2016/02/17 13:34:52 $ 
 CNSsolve>!$RCSfile: rcsb104565.mr,v $ 
 CNSsolve> 
 CNSsolve>! define_methyls_all.cns 
 CNSsolve>! script to define methyle and other equivalent groups 
 CNSsolve>! called by calib.inp, merge.inp, refine.inp 
 CNSsolve>! by default, all methyle groups and all aromatics are 
 CNSsolve>!   defined 
 CNSsolve>! methyl.tbl is written by define_methyls_ini.cns 
 CNSsolve>!     ************************************ 
 CNSsolve>!     * Authors and copyright:           * 
 CNSsolve>!     * Michael Nilges, Jens Linge, EMBL * 
 CNSsolve>!     * No warranty implied or expressed * 
 CNSsolve>!     * All rights reserved              * 
 CNSsolve>!     ************************************ 
 CNSsolve> 
 CNSsolve>! first, define methyl groups into store1 
 CNSsolve>@@RUN:begin/methyls.tbl 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/begin/methyls.tbl opened.
 CNSsolve>do (store1 = 0) (all) 
 SELRPN:    622 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 5) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 69) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 73) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 227) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 231) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 246) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 250) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 295) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 349) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 353) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 449) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 463) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 526) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve> 
 CNSsolve>aria 
 ARIA arrays initialized
 ARIA>   analyse_restraints 
 ANALyse_restraints>      equivalent 
 EQUIvalent>         initialize 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 SELRPN:     13 atoms have been selected out of    622
 FOR ID LOOP: symbol LOOPID set to    5.00000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    69.0000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    73.0000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    227.000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    231.000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    246.000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    250.000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    295.000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    349.000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    353.000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    449.000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    463.000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 FOR ID LOOP: symbol LOOPID set to    526.000     (real)
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 SELRPN:      3 atoms have been selected out of    622
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id (store1) loop meth 
 EQUIvalent>            select (bondedt(id $loopid) and name h*) 
 EQUIvalent>         end loop meth 
 EQUIvalent>         for $loopid in id ((resn phe or resn tyr) and name cd1) loop arom 
 SELRPN:      2 atoms have been selected out of    622
 FOR ID LOOP: symbol LOOPID set to    309.000     (real)
 EQUIvalent>            select (byres(id $loopid) and (name hd#)) ! and not ( resid 26) 
 SELRPN:      2 atoms have been selected out of    622
 EQUIvalent>            select (byres(id $loopid) and (name he#)) 
 SELRPN:      2 atoms have been selected out of    622
 EQUIvalent>         end loop arom 
 EQUIvalent>         for $loopid in id ((resn phe or resn tyr) and name cd1) loop arom 
 FOR ID LOOP: symbol LOOPID set to    330.000     (real)
 EQUIvalent>            select (byres(id $loopid) and (name hd#)) ! and not ( resid 26) 
 SELRPN:      2 atoms have been selected out of    622
 EQUIvalent>            select (byres(id $loopid) and (name he#)) 
 SELRPN:      2 atoms have been selected out of    622
 EQUIvalent>         end loop arom 
 EQUIvalent>         for $loopid in id ((resn phe or resn tyr) and name cd1) loop arom 
 EQUIvalent>            select (byres(id $loopid) and (name hd#)) ! and not ( resid 26) 
 EQUIvalent>            select (byres(id $loopid) and (name he#)) 
 EQUIvalent>         end loop arom 
 EQUIvalent>      end 
 CNTGRP: NHG2, NHY2   269  299
 ALLDSP: making space for   990 distances
 ALLDSP: maximum number of selections     2
 ARIASS: initializing distance list
 ARIASS: setting up population array
 ANALyse_restraints>   end 
 ARIA>end 
 CNSsolve> 
 CNSsolve>@RUN:begin/setup_swap_list.tbl 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/begin/setup_swap_list.tbl opened.
 CNSsolve>do (q = 0) (all) 
 SELRPN:    622 atoms have been selected out of    622
 CNSsolve>do (store1 = 0) (all) 
 SELRPN:    622 atoms have been selected out of    622
 CNSsolve>  do (store1 = 2) (resn leu and name cd1) 
 SELRPN:      2 atoms have been selected out of    622
 CNSsolve>  do (store1 = 2) (resn val and name cg1) 
 SELRPN:      2 atoms have been selected out of    622
 CNSsolve>  do (store1 = 3) (resn arg and name nh1) 
 SELRPN:      4 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 2) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 16) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 26) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 29) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 32) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 41) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 51) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 54) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 57) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 66) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 84) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 87) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 90) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 98) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 101) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 104) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 111) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 120) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 144) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 147) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 159) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 162) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 174) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 177) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 180) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 198) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 201) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 215) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 243) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 260) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 269) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 272) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 275) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 307) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 328) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 365) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 379) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 397) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 400) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 412) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 423) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 426) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 429) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 475) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 478) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 492) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 516) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 519) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 522) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 525) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 538) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 541) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 544) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 561) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 564) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 567) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 576) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 586) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 589) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 592) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 601) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 604) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 615) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 206) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 483) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 370) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 186) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 189) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 281) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 284) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 435) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 438) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 550) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do (store1 = 1) (id 553) 
 SELRPN:      1 atoms have been selected out of    622
 CNSsolve>do    (store9 = store1) (all) 
 SELRPN:    622 atoms have been selected out of    622
 CNSsolve> 
 CNSsolve>! accumulate the structures 
 CNSsolve> 
 CNSsolve>@PREVIT:file.cns(filenames=$filenames) 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/file.cns opened.
 CNSsolve>module(filenames;) 
 &_2_FILENAMES set to $_1_FILENAMES 
 CNSsolve>set message off echo off end 
 CNSsolve>evaluate (&filenames.bestfile_1="PREVIT:ww1_5.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_1 set to "PREVIT:ww1_5.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_2="PREVIT:ww1_4.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_2 set to "PREVIT:ww1_4.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_3="PREVIT:ww1_11.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_3 set to "PREVIT:ww1_11.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_4="PREVIT:ww1_1.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_4 set to "PREVIT:ww1_1.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_5="PREVIT:ww1_10.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_5 set to "PREVIT:ww1_10.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_6="PREVIT:ww1_6.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_6 set to "PREVIT:ww1_6.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_7="PREVIT:ww1_7.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_7 set to "PREVIT:ww1_7.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_8="PREVIT:ww1_17.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_8 set to "PREVIT:ww1_17.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_9="PREVIT:ww1_9.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_9 set to "PREVIT:ww1_9.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_10="PREVIT:ww1_3.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_10 set to "PREVIT:ww1_3.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_11="PREVIT:ww1_14.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_11 set to "PREVIT:ww1_14.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_12="PREVIT:ww1_2.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_12 set to "PREVIT:ww1_2.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_13="PREVIT:ww1_8.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_13 set to "PREVIT:ww1_8.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_14="PREVIT:ww1_13.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_14 set to "PREVIT:ww1_13.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_15="PREVIT:ww1_20.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_15 set to "PREVIT:ww1_20.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_16="PREVIT:ww1_18.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_16 set to "PREVIT:ww1_18.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_17="PREVIT:ww1_12.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_17 set to "PREVIT:ww1_12.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_18="PREVIT:ww1_19.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_18 set to "PREVIT:ww1_19.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_19="PREVIT:ww1_15.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_19 set to "PREVIT:ww1_15.pdb" (string)
 CNSsolve>evaluate (&filenames.bestfile_20="PREVIT:ww1_16.pdb") 
 EVALUATE: symbol $_1_FILENAMES.BESTFILE_20 set to "PREVIT:ww1_16.pdb" (string)
 CNSsolve> 
 CNSsolve> 
 CNSsolve> 
 CNSsolve> 
 CNSsolve> 
 CNSsolve> 
 CNSsolve>aria analyse_restraints reset end end 
 CNSsolve>aria countvio reset end end 
 ARIVIO: database initialized
 CNSsolve>evaluate ($count = 1) 
 EVALUATE: symbol $COUNT set to    1.00000     (real)
 CNSsolve>while ($count le $Iterations.Assignstruct) loop main 
 NEXTCD: condition evaluated as true
 CNSsolve>   evaluate ($file = $filenames.bestfile_$count) 
 EVALUATE: symbol $FILE set to "PREVIT:ww1_5.pdb" (string)
 CNSsolve>   display $file 
PREVIT:ww1_5.pdb
 CNSsolve>   coor init end 
 COOR: selected main coordinates initialized
 CNSsolve>   if ($file ne "") then 
 NEXTCD: condition evaluated as true
 CNSsolve>      coor @@$file 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_5.pdb opened.
 COOR>REMARK FILENAME="/usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_5.pdb" 
 COOR>REMARK =============================================================== 
 COOR>REMARK            overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK energies: 222.249, 1.83217, 15.8792, 1.49497, 173.227, 23.7479, 0, 5.38948, 0.678397, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK            bonds,angles,impropers,dihe,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK rms-dev.: 1.69996E-03,0.302015,0.167944,41.1509,1.096393E-02,0.445919,0,0,0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK               noe,cdih,coup,sani,dani,vean 
 COOR>REMARK               >0.3,>5,>1,>0,>5 
 COOR>REMARK violations.: 0, 0, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK DATE:02-Mar-2010  13:58:05       created by user: fkieken 
 COOR>REMARK VERSION:1.1 
 COOR>ATOM      1  HA1 GLY     1      -6.654 -17.086  -5.742  1.00  0.00 
 COOR>ATOM      2  HA2 GLY     1      -6.873 -15.437  -6.308  1.00  0.00 
 CNSsolve>      eval ($floatfile = $file - ".pdb" + ".float") 
 EVALUATE: symbol $FLOATFILE set to "PREVIT:ww1_5.float" (string)
 CNSsolve>      fileexist $floatfile end  eval ($qfloatfile = $result) 
 MISCOM: file exists
 EVALUATE: symbol $QFLOATFILE set to TRUE (logical)
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_5.float opened.
 ARIA> REVE ((segid "    " and resid 2    and name HB1 ) OR   ( segid "    " and resid 2    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HB1 ) OR   ( segid "    " and resid 3    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HG1 ) OR   ( segid "    " and resid 3    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 4    and name HB1 ) OR   ( segid "    " and resid 4    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HG1 ) OR   ( segid "    " and resid 5    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HD11) OR   ( segid "    " and resid 6    and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HG1 ) OR   ( segid "    " and resid 8    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HG1 ) OR   ( segid "    " and resid 12   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HG1 ) OR   ( segid "    " and resid 13   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH11) OR   ( segid "    " and resid 13   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 14   and name HB1 ) OR   ( segid "    " and resid 14   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 14   and name HG1 ) OR   ( segid "    " and resid 14   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 14   and name HE21) OR   ( segid "    " and resid 14   and name HE22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 15   and name HB1 ) OR   ( segid "    " and resid 15   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 16   and name HG11) OR   ( segid "    " and resid 16   and name HG21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HG1 ) OR   ( segid "    " and resid 19   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HH11) OR   ( segid "    " and resid 19   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HG1 ) OR   ( segid "    " and resid 26   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 27   and name HB1 ) OR   ( segid "    " and resid 27   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HG1 ) OR   ( segid "    " and resid 28   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 32   and name HB1 ) OR   ( segid "    " and resid 32   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HB1 ) OR   ( segid "    " and resid 33   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HG1 ) OR   ( segid "    " and resid 33   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HD1 ) OR   ( segid "    " and resid 33   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 36   and name HB1 ) OR   ( segid "    " and resid 36   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HG1 ) OR   ( segid "    " and resid 38   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>      aria 
 ARIA>         analyse_restraints aver end 
DISACC: accumulating distance matrix with dimension  269
 AMBVAC: read in   990 distances in mode ACCU
 ARIA>         countvio threshold $Iterations.violtoler end 
 ARIEXC: peak, lower, upper, distance    1    0.18000E+01    0.36000E+01    0.87988E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.48000E+01    0.86166E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.45000E+01    0.83973E+00
 ARIEXC: peak, lower, upper, distance    5    0.19000E+01    0.47000E+01    0.83157E+00
 ARIEXC: peak, lower, upper, distance    6    0.18000E+01    0.36000E+01    0.86362E+00
 ARIEXC: peak, lower, upper, distance    7    0.19000E+01    0.53000E+01    0.80955E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.43000E+01    0.83209E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.54000E+01    0.75454E+00
 ARIEXC: peak, lower, upper, distance   13    0.20000E+01    0.58000E+01    0.84071E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.86782E+00
 ARIEXC: peak, lower, upper, distance   15    0.18000E+01    0.36000E+01    0.85932E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.45000E+01    0.86353E+00
 ARIEXC: peak, lower, upper, distance   17    0.19000E+01    0.60000E+01    0.84960E+00
 ARIEXC: peak, lower, upper, distance   21    0.13000E+01    0.22000E+01    0.91035E+00
 ARIEXC: peak, lower, upper, distance   23    0.13000E+01    0.60000E+01    0.89365E+00
 ARIEXC: peak, lower, upper, distance   24    0.20000E+01    0.60000E+01    0.80360E+00
 ARIEXC: peak, lower, upper, distance   26    0.15000E+01    0.27000E+01    0.87885E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.43000E+01    0.83210E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.85520E+00
 ARIEXC: peak, lower, upper, distance   30    0.18000E+01    0.38000E+01    0.80645E+00
 ARIEXC: peak, lower, upper, distance   31    0.18000E+01    0.36000E+01    0.86885E+00
 ARIEXC: peak, lower, upper, distance   33    0.18000E+01    0.60000E+01    0.75783E+00
 ARIEXC: peak, lower, upper, distance   34    0.19000E+01    0.49000E+01    0.80473E+00
 ARIEXC: peak, lower, upper, distance   35    0.19000E+01    0.60000E+01    0.78979E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.41000E+01    0.83740E+00
 ARIEXC: peak, lower, upper, distance   43    0.13000E+01    0.22000E+01    0.91016E+00
 ARIEXC: peak, lower, upper, distance   44    0.16000E+01    0.30000E+01    0.86701E+00
 ARIEXC: peak, lower, upper, distance   45    0.17000E+01    0.33000E+01    0.83241E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.43000E+01    0.79397E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.74606E+00
 ARIEXC: peak, lower, upper, distance   52    0.18000E+01    0.34000E+01    0.86146E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.41000E+01    0.86250E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.46000E+01    0.80585E+00
 ARIEXC: peak, lower, upper, distance   57    0.19000E+01    0.51000E+01    0.79565E+00
 ARIEXC: peak, lower, upper, distance   59    0.17000E+01    0.31000E+01    0.86139E+00
 ARIEXC: peak, lower, upper, distance   60    0.18000E+01    0.40000E+01    0.80199E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.83484E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.60000E+01    0.76677E+00
 ARIEXC: peak, lower, upper, distance   63    0.20000E+01    0.58000E+01    0.74916E+00
 ARIEXC: peak, lower, upper, distance   64    0.19000E+01    0.53000E+01    0.83596E+00
 ARIEXC: peak, lower, upper, distance   65    0.16000E+01    0.28000E+01    0.84167E+00
 ARIEXC: peak, lower, upper, distance   66    0.16000E+01    0.28000E+01    0.89378E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.41000E+01    0.83188E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.31000E+01    0.85928E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.60000E+01    0.86010E+00
 ARIEXC: peak, lower, upper, distance   71    0.19000E+01    0.45000E+01    0.86008E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.80563E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.41000E+01    0.82734E+00
 ARIEXC: peak, lower, upper, distance   76    0.20000E+01    0.52000E+01    0.82253E+00
 ARIEXC: peak, lower, upper, distance   77    0.13000E+01    0.22000E+01    0.91069E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.48000E+01    0.84272E+00
 ARIEXC: peak, lower, upper, distance   82    0.19000E+01    0.60000E+01    0.79450E+00
 ARIEXC: peak, lower, upper, distance   86    0.19000E+01    0.60000E+01    0.75002E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.79786E+00
 ARIEXC: peak, lower, upper, distance   91    0.19000E+01    0.60000E+01    0.83469E+00
 ARIEXC: peak, lower, upper, distance   93    0.16000E+01    0.26000E+01    0.86949E+00
 ARIEXC: peak, lower, upper, distance   95    0.11000E+01    0.60000E+01    0.81155E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.60000E+01    0.77802E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.41000E+01    0.85927E+00
 ARIEXC: peak, lower, upper, distance  100    0.20000E+01    0.56000E+01    0.80819E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.41000E+01    0.86363E+00
 ARIEXC: peak, lower, upper, distance  102    0.15000E+01    0.25000E+01    0.86942E+00
 ARIEXC: peak, lower, upper, distance  103    0.20000E+01    0.60000E+01    0.79743E+00
 ARIEXC: peak, lower, upper, distance  104    0.18000E+01    0.42000E+01    0.86286E+00
 ARIEXC: peak, lower, upper, distance  105    0.19000E+01    0.53000E+01    0.80246E+00
 ARIEXC: peak, lower, upper, distance  108    0.18000E+01    0.36000E+01    0.85890E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.81692E+00
 ARIEXC: peak, lower, upper, distance  110    0.17000E+01    0.29000E+01    0.85479E+00
 ARIEXC: peak, lower, upper, distance  112    0.20000E+01    0.60000E+01    0.79438E+00
 ARIEXC: peak, lower, upper, distance  113    0.19000E+01    0.43000E+01    0.85789E+00
 ARIEXC: peak, lower, upper, distance  114    0.20000E+01    0.58000E+01    0.77875E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.85484E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.81393E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.60000E+01    0.74091E+00
 ARIEXC: peak, lower, upper, distance  120    0.17000E+01    0.31000E+01    0.85481E+00
 ARIEXC: peak, lower, upper, distance  121    0.20000E+01    0.60000E+01    0.78791E+00
 ARIEXC: peak, lower, upper, distance  122    0.19000E+01    0.60000E+01    0.84132E+00
 ARIEXC: peak, lower, upper, distance  123    0.20000E+01    0.50000E+01    0.81695E+00
 ARIEXC: peak, lower, upper, distance  124    0.17000E+01    0.33000E+01    0.86006E+00
 ARIEXC: peak, lower, upper, distance  126    0.19000E+01    0.49000E+01    0.80419E+00
 ARIEXC: peak, lower, upper, distance  127    0.19000E+01    0.43000E+01    0.85679E+00
 ARIEXC: peak, lower, upper, distance  128    0.19000E+01    0.51000E+01    0.76133E+00
 ARIEXC: peak, lower, upper, distance  129    0.19000E+01    0.43000E+01    0.79509E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.74856E+00
 ARIEXC: peak, lower, upper, distance  132    0.19000E+01    0.45000E+01    0.80841E+00
 ARIEXC: peak, lower, upper, distance  133    0.19000E+01    0.60000E+01    0.85721E+00
 ARIEXC: peak, lower, upper, distance  134    0.20000E+01    0.48000E+01    0.82038E+00
 ARIEXC: peak, lower, upper, distance  135    0.17000E+01    0.60000E+01    0.78309E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.39000E+01    0.83675E+00
 ARIEXC: peak, lower, upper, distance  137    0.17000E+01    0.31000E+01    0.87258E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.52000E+01    0.82904E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.54000E+01    0.81412E+00
 ARIEXC: peak, lower, upper, distance  143    0.13000E+01    0.22000E+01    0.91034E+00
 ARIEXC: peak, lower, upper, distance  146    0.18000E+01    0.36000E+01    0.83452E+00
 ARIEXC: peak, lower, upper, distance  148    0.14000E+01    0.60000E+01    0.77422E+00
 ARIEXC: peak, lower, upper, distance  149    0.18000E+01    0.38000E+01    0.85904E+00
 ARIEXC: peak, lower, upper, distance  150    0.20000E+01    0.50000E+01    0.81471E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.60000E+01    0.74945E+00
 ARIEXC: peak, lower, upper, distance  153    0.19000E+01    0.60000E+01    0.75695E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.60000E+01    0.77358E+00
 ARIEXC: peak, lower, upper, distance  155    0.15000E+01    0.25000E+01    0.87762E+00
 ARIEXC: peak, lower, upper, distance  156    0.18000E+01    0.36000E+01    0.83741E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.43000E+01    0.83318E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.85062E+00
 ARIEXC: peak, lower, upper, distance  160    0.20000E+01    0.58000E+01    0.81486E+00
 ARIEXC: peak, lower, upper, distance  162    0.17000E+01    0.60000E+01    0.76980E+00
 ARIEXC: peak, lower, upper, distance  164    0.19000E+01    0.60000E+01    0.78533E+00
 ARIEXC: peak, lower, upper, distance  165    0.20000E+01    0.46000E+01    0.82655E+00
 ARIEXC: peak, lower, upper, distance  166    0.20000E+01    0.50000E+01    0.81065E+00
 ARIEXC: peak, lower, upper, distance  167    0.17000E+01    0.33000E+01    0.87428E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.39000E+01    0.84770E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.60000E+01    0.79935E+00
 ARIEXC: peak, lower, upper, distance  170    0.18000E+01    0.60000E+01    0.76706E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.46000E+01    0.78187E+00
 ARIEXC: peak, lower, upper, distance  174    0.20000E+01    0.52000E+01    0.77734E+00
 ARIEXC: peak, lower, upper, distance  175    0.19000E+01    0.43000E+01    0.82990E+00
 ARIEXC: peak, lower, upper, distance  177    0.20000E+01    0.52000E+01    0.75980E+00
 ARIEXC: peak, lower, upper, distance  178    0.20000E+01    0.60000E+01    0.75658E+00
 ARIEXC: peak, lower, upper, distance  180    0.19000E+01    0.45000E+01    0.86907E+00
 ARIEXC: peak, lower, upper, distance  181    0.14000E+01    0.60000E+01    0.82257E+00
 ARIEXC: peak, lower, upper, distance  183    0.20000E+01    0.60000E+01    0.79701E+00
 ARIEXC: peak, lower, upper, distance  184    0.20000E+01    0.48000E+01    0.82770E+00
 ARIEXC: peak, lower, upper, distance  185    0.18000E+01    0.60000E+01    0.79332E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.58000E+01    0.84611E+00
 ARIEXC: peak, lower, upper, distance  188    0.20000E+01    0.60000E+01    0.76970E+00
 ARIEXC: peak, lower, upper, distance  189    0.20000E+01    0.60000E+01    0.80725E+00
 ARIEXC: peak, lower, upper, distance  190    0.19000E+01    0.60000E+01    0.77867E+00
 ARIEXC: peak, lower, upper, distance  191    0.18000E+01    0.60000E+01    0.80773E+00
 ARIEXC: peak, lower, upper, distance  193    0.17000E+01    0.33000E+01    0.83718E+00
 ARIEXC: peak, lower, upper, distance  194    0.19000E+01    0.60000E+01    0.78559E+00
 ARIEXC: peak, lower, upper, distance  195    0.17000E+01    0.60000E+01    0.81322E+00
 ARIEXC: peak, lower, upper, distance  196    0.17000E+01    0.31000E+01    0.83162E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.74012E+00
 ARIEXC: peak, lower, upper, distance  198    0.18000E+01    0.36000E+01    0.83748E+00
 ARIEXC: peak, lower, upper, distance  199    0.15000E+01    0.23000E+01    0.87986E+00
 ARIEXC: peak, lower, upper, distance  200    0.17000E+01    0.31000E+01    0.85605E+00
 ARIEXC: peak, lower, upper, distance  201    0.19000E+01    0.60000E+01    0.78551E+00
 ARIEXC: peak, lower, upper, distance  203    0.19000E+01    0.41000E+01    0.87114E+00
 ARIEXC: peak, lower, upper, distance  205    0.20000E+01    0.52000E+01    0.79290E+00
 ARIEXC: peak, lower, upper, distance  206    0.20000E+01    0.56000E+01    0.73018E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.60000E+01    0.77963E+00
 ARIEXC: peak, lower, upper, distance  209    0.18000E+01    0.40000E+01    0.82049E+00
 ARIEXC: peak, lower, upper, distance  212    0.19000E+01    0.41000E+01    0.83307E+00
 ARIEXC: peak, lower, upper, distance  213    0.17000E+01    0.33000E+01    0.80098E+00
 ARIEXC: peak, lower, upper, distance  214    0.18000E+01    0.40000E+01    0.83622E+00
 ARIEXC: peak, lower, upper, distance  215    0.19000E+01    0.43000E+01    0.89129E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.47000E+01    0.82721E+00
 ARIEXC: peak, lower, upper, distance  217    0.15000E+01    0.60000E+01    0.74023E+00
 ARIEXC: peak, lower, upper, distance  219    0.17000E+01    0.31000E+01    0.85564E+00
 ARIEXC: peak, lower, upper, distance  220    0.18000E+01    0.36000E+01    0.83188E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.49000E+01    0.80003E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.51000E+01    0.87027E+00
 ARIEXC: peak, lower, upper, distance  223    0.19000E+01    0.49000E+01    0.80686E+00
 ARIEXC: peak, lower, upper, distance  224    0.20000E+01    0.58000E+01    0.84632E+00
 ARIEXC: peak, lower, upper, distance  226    0.20000E+01    0.52000E+01    0.79453E+00
 ARIEXC: peak, lower, upper, distance  227    0.20000E+01    0.60000E+01    0.82311E+00
 ARIEXC: peak, lower, upper, distance  230    0.20000E+01    0.56000E+01    0.83421E+00
 ARIEXC: peak, lower, upper, distance  231    0.20000E+01    0.56000E+01    0.85944E+00
 ARIEXC: peak, lower, upper, distance  232    0.13000E+01    0.22000E+01    0.91004E+00
 ARIEXC: peak, lower, upper, distance  236    0.20000E+01    0.56000E+01    0.77834E+00
 ARIEXC: peak, lower, upper, distance  237    0.19000E+01    0.60000E+01    0.81616E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.77389E+00
 ARIEXC: peak, lower, upper, distance  239    0.19000E+01    0.60000E+01    0.77528E+00
 ARIEXC: peak, lower, upper, distance  241    0.17000E+01    0.60000E+01    0.74579E+00
 ARIEXC: peak, lower, upper, distance  242    0.20000E+01    0.60000E+01    0.83795E+00
 ARIEXC: peak, lower, upper, distance  243    0.19000E+01    0.51000E+01    0.80341E+00
 ARIEXC: peak, lower, upper, distance  244    0.18000E+01    0.34000E+01    0.86064E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.41000E+01    0.85136E+00
 ARIEXC: peak, lower, upper, distance  249    0.19000E+01    0.39000E+01    0.82137E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.38000E+01    0.86516E+00
 ARIEXC: peak, lower, upper, distance  251    0.18000E+01    0.38000E+01    0.85929E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.81072E+00
 ARIEXC: peak, lower, upper, distance  253    0.19000E+01    0.60000E+01    0.81114E+00
 ARIEXC: peak, lower, upper, distance  258    0.17000E+01    0.33000E+01    0.86222E+00
 ARIEXC: peak, lower, upper, distance  259    0.17000E+01    0.31000E+01    0.83192E+00
 ARIEXC: peak, lower, upper, distance  260    0.20000E+01    0.60000E+01    0.75416E+00
 ARIEXC: peak, lower, upper, distance  261    0.20000E+01    0.60000E+01    0.76540E+00
 ARIEXC: peak, lower, upper, distance  262    0.19000E+01    0.45000E+01    0.80452E+00
 ARIEXC: peak, lower, upper, distance  263    0.20000E+01    0.52000E+01    0.80316E+00
 ARIEXC: peak, lower, upper, distance  264    0.15000E+01    0.25000E+01    0.88006E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.43000E+01    0.86039E+00
 ARIEXC: peak, lower, upper, distance  266    0.19000E+01    0.43000E+01    0.83524E+00
 ARIEXC: peak, lower, upper, distance  269    0.20000E+01    0.52000E+01    0.82381E+00
 ARIEXC: peak, lower, upper, distance  270    0.16000E+01    0.30000E+01    0.85241E+00
 ARIEXC: peak, lower, upper, distance  271    0.20000E+01    0.60000E+01    0.81524E+00
 ARIEXC: peak, lower, upper, distance  272    0.19000E+01    0.43000E+01    0.87629E+00
 ARIEXC: peak, lower, upper, distance  273    0.20000E+01    0.60000E+01    0.79451E+00
 ARIEXC: peak, lower, upper, distance  274    0.19000E+01    0.60000E+01    0.78196E+00
 ARIEXC: peak, lower, upper, distance  275    0.19000E+01    0.47000E+01    0.84222E+00
 ARIEXC: peak, lower, upper, distance  276    0.20000E+01    0.56000E+01    0.83901E+00
 ARIEXC: peak, lower, upper, distance  277    0.18000E+01    0.36000E+01    0.83277E+00
 ARIEXC: peak, lower, upper, distance  279    0.20000E+01    0.54000E+01    0.75464E+00
 ARIEXC: peak, lower, upper, distance  280    0.20000E+01    0.60000E+01    0.74190E+00
 ARIEXC: peak, lower, upper, distance  282    0.18000E+01    0.60000E+01    0.77051E+00
 ARIEXC: peak, lower, upper, distance  283    0.20000E+01    0.60000E+01    0.77774E+00
 ARIEXC: peak, lower, upper, distance  284    0.17000E+01    0.60000E+01    0.80178E+00
 ARIEXC: peak, lower, upper, distance  288    0.19000E+01    0.47000E+01    0.83841E+00
 ARIEXC: peak, lower, upper, distance  289    0.19000E+01    0.51000E+01    0.86619E+00
 ARIEXC: peak, lower, upper, distance  291    0.17000E+01    0.31000E+01    0.83475E+00
 ARIEXC: peak, lower, upper, distance  292    0.17000E+01    0.35000E+01    0.84963E+00
 ARIEXC: peak, lower, upper, distance  293    0.17000E+01    0.60000E+01    0.74553E+00
 ARIEXC: peak, lower, upper, distance  294    0.17000E+01    0.60000E+01    0.75087E+00
 ARIEXC: peak, lower, upper, distance  296    0.19000E+01    0.49000E+01    0.83861E+00
 ARIEXC: peak, lower, upper, distance  297    0.18000E+01    0.40000E+01    0.86939E+00
 ARIEXC: peak, lower, upper, distance  298    0.19000E+01    0.60000E+01    0.79356E+00
 ARIEXC: peak, lower, upper, distance  299    0.20000E+01    0.60000E+01    0.82317E+00
 ARIEXC: peak, lower, upper, distance  300    0.19000E+01    0.60000E+01    0.87553E+00
 ARIEXC: peak, lower, upper, distance  307    0.13000E+01    0.22000E+01    0.91028E+00
 ARIEXC: peak, lower, upper, distance  310    0.20000E+01    0.60000E+01    0.77057E+00
 ARIEXC: peak, lower, upper, distance  311    0.18000E+01    0.60000E+01    0.74317E+00
 ARIEXC: peak, lower, upper, distance  312    0.20000E+01    0.60000E+01    0.80988E+00
 ARIEXC: peak, lower, upper, distance  313    0.20000E+01    0.60000E+01    0.80744E+00
 ARIEXC: peak, lower, upper, distance  314    0.19000E+01    0.60000E+01    0.74175E+00
 ARIEXC: peak, lower, upper, distance  316    0.16000E+01    0.28000E+01    0.85522E+00
 ARIEXC: peak, lower, upper, distance  318    0.19000E+01    0.43000E+01    0.83722E+00
 ARIEXC: peak, lower, upper, distance  319    0.20000E+01    0.60000E+01    0.81134E+00
 ARIEXC: peak, lower, upper, distance  320    0.19000E+01    0.60000E+01    0.77558E+00
 ARIEXC: peak, lower, upper, distance  322    0.15000E+01    0.27000E+01    0.85969E+00
 ARIEXC: peak, lower, upper, distance  324    0.20000E+01    0.48000E+01    0.85954E+00
 ARIEXC: peak, lower, upper, distance  325    0.19000E+01    0.60000E+01    0.80802E+00
 ARIEXC: peak, lower, upper, distance  326    0.20000E+01    0.56000E+01    0.80687E+00
 ARIEXC: peak, lower, upper, distance  327    0.17000E+01    0.33000E+01    0.86101E+00
 ARIEXC: peak, lower, upper, distance  328    0.20000E+01    0.56000E+01    0.84621E+00
 ARIEXC: peak, lower, upper, distance  329    0.20000E+01    0.60000E+01    0.83177E+00
 ARIEXC: peak, lower, upper, distance  331    0.20000E+01    0.58000E+01    0.80791E+00
 ARIEXC: peak, lower, upper, distance  332    0.20000E+01    0.60000E+01    0.80586E+00
 ARIEXC: peak, lower, upper, distance  333    0.19000E+01    0.43000E+01    0.84479E+00
 ARIEXC: peak, lower, upper, distance  337    0.19000E+01    0.55000E+01    0.76999E+00
 ARIEXC: peak, lower, upper, distance  340    0.20000E+01    0.60000E+01    0.85319E+00
 ARIEXC: peak, lower, upper, distance  344    0.20000E+01    0.60000E+01    0.82514E+00
 ARIEXC: peak, lower, upper, distance  345    0.17000E+01    0.31000E+01    0.87490E+00
 ARIEXC: peak, lower, upper, distance  346    0.20000E+01    0.54000E+01    0.82819E+00
 ARIEXC: peak, lower, upper, distance  347    0.18000E+01    0.42000E+01    0.81933E+00
 ARIEXC: peak, lower, upper, distance  348    0.16000E+01    0.60000E+01    0.77333E+00
 ARIEXC: peak, lower, upper, distance  351    0.17000E+01    0.29000E+01    0.85311E+00
 ARIEXC: peak, lower, upper, distance  352    0.20000E+01    0.60000E+01    0.73670E+00
 ARIEXC: peak, lower, upper, distance  353    0.18000E+01    0.36000E+01    0.83209E+00
 ARIEXC: peak, lower, upper, distance  354    0.19000E+01    0.60000E+01    0.78726E+00
 ARIEXC: peak, lower, upper, distance  355    0.20000E+01    0.54000E+01    0.86065E+00
 ARIEXC: peak, lower, upper, distance  356    0.20000E+01    0.60000E+01    0.81941E+00
 ARIEXC: peak, lower, upper, distance  357    0.20000E+01    0.60000E+01    0.80479E+00
 ARIEXC: peak, lower, upper, distance  360    0.18000E+01    0.34000E+01    0.84104E+00
 ARIEXC: peak, lower, upper, distance  363    0.20000E+01    0.50000E+01    0.86824E+00
 ARIEXC: peak, lower, upper, distance  365    0.19000E+01    0.60000E+01    0.75694E+00
 ARIEXC: peak, lower, upper, distance  367    0.16000E+01    0.30000E+01    0.87280E+00
 ARIEXC: peak, lower, upper, distance  368    0.18000E+01    0.38000E+01    0.83545E+00
 ARIEXC: peak, lower, upper, distance  369    0.20000E+01    0.60000E+01    0.78122E+00
 ARIEXC: peak, lower, upper, distance  370    0.20000E+01    0.56000E+01    0.77700E+00
 ARIEXC: peak, lower, upper, distance  372    0.18000E+01    0.34000E+01    0.86341E+00
 ARIEXC: peak, lower, upper, distance  373    0.17000E+01    0.33000E+01    0.83180E+00
 ARIEXC: peak, lower, upper, distance  377    0.20000E+01    0.60000E+01    0.79662E+00
 ARIEXC: peak, lower, upper, distance  378    0.18000E+01    0.60000E+01    0.80589E+00
 ARIEXC: peak, lower, upper, distance  379    0.20000E+01    0.52000E+01    0.79980E+00
 ARIEXC: peak, lower, upper, distance  380    0.17000E+01    0.60000E+01    0.76354E+00
 ARIEXC: peak, lower, upper, distance  381    0.20000E+01    0.54000E+01    0.83876E+00
 ARIEXC: peak, lower, upper, distance  382    0.18000E+01    0.38000E+01    0.80326E+00
 ARIEXC: peak, lower, upper, distance  383    0.20000E+01    0.48000E+01    0.85100E+00
 ARIEXC: peak, lower, upper, distance  384    0.17000E+01    0.33000E+01    0.85385E+00
 ARIEXC: peak, lower, upper, distance  385    0.18000E+01    0.34000E+01    0.88171E+00
 ARIEXC: peak, lower, upper, distance  387    0.16000E+01    0.26000E+01    0.83905E+00
 ARIEXC: peak, lower, upper, distance  390    0.19000E+01    0.60000E+01    0.76341E+00
 ARIEXC: peak, lower, upper, distance  391    0.20000E+01    0.60000E+01    0.74093E+00
 ARIEXC: peak, lower, upper, distance  394    0.17000E+01    0.60000E+01    0.75319E+00
 ARIEXC: peak, lower, upper, distance  395    0.19000E+01    0.60000E+01    0.75848E+00
 ARIEXC: peak, lower, upper, distance  396    0.17000E+01    0.60000E+01    0.79104E+00
 ARIEXC: peak, lower, upper, distance  397    0.19000E+01    0.43000E+01    0.83520E+00
 ARIEXC: peak, lower, upper, distance  399    0.13000E+01    0.60000E+01    0.77003E+00
 ARIEXC: peak, lower, upper, distance  400    0.19000E+01    0.49000E+01    0.78247E+00
 ARIEXC: peak, lower, upper, distance  401    0.18000E+01    0.36000E+01    0.86488E+00
 ARIEXC: peak, lower, upper, distance  402    0.17000E+01    0.33000E+01    0.86884E+00
 ARIEXC: peak, lower, upper, distance  403    0.19000E+01    0.53000E+01    0.84952E+00
 ARIEXC: peak, lower, upper, distance  404    0.18000E+01    0.38000E+01    0.83058E+00
 ARIEXC: peak, lower, upper, distance  405    0.18000E+01    0.60000E+01    0.79726E+00
 ARIEXC: peak, lower, upper, distance  406    0.16000E+01    0.60000E+01    0.74693E+00
 ARIEXC: peak, lower, upper, distance  407    0.19000E+01    0.43000E+01    0.81636E+00
 ARIEXC: peak, lower, upper, distance  408    0.18000E+01    0.60000E+01    0.79899E+00
 ARIEXC: peak, lower, upper, distance  411    0.19000E+01    0.60000E+01    0.77209E+00
 ARIEXC: peak, lower, upper, distance  414    0.19000E+01    0.41000E+01    0.86333E+00
 ARIEXC: peak, lower, upper, distance  416    0.16000E+01    0.60000E+01    0.78094E+00
 ARIEXC: peak, lower, upper, distance  417    0.19000E+01    0.43000E+01    0.86831E+00
 ARIEXC: peak, lower, upper, distance  418    0.20000E+01    0.60000E+01    0.76678E+00
 ARIEXC: peak, lower, upper, distance  422    0.20000E+01    0.60000E+01    0.80042E+00
 ARIEXC: peak, lower, upper, distance  423    0.18000E+01    0.60000E+01    0.72858E+00
 ARIEXC: peak, lower, upper, distance  427    0.20000E+01    0.60000E+01    0.86652E+00
 ARIEXC: peak, lower, upper, distance  428    0.17000E+01    0.31000E+01    0.85576E+00
 ARIEXC: peak, lower, upper, distance  429    0.20000E+01    0.60000E+01    0.76287E+00
 ARIEXC: peak, lower, upper, distance  431    0.20000E+01    0.60000E+01    0.77768E+00
 ARIEXC: peak, lower, upper, distance  432    0.20000E+01    0.50000E+01    0.84280E+00
 ARIEXC: peak, lower, upper, distance  442    0.19000E+01    0.60000E+01    0.78316E+00
 ARIEXC: peak, lower, upper, distance  444    0.18000E+01    0.36000E+01    0.85520E+00
 ARIEXC: peak, lower, upper, distance  446    0.20000E+01    0.60000E+01    0.80406E+00
 ARIEXC: peak, lower, upper, distance  447    0.18000E+01    0.36000E+01    0.83542E+00
 ARIEXC: peak, lower, upper, distance  448    0.20000E+01    0.60000E+01    0.76951E+00
 ARIEXC: peak, lower, upper, distance  449    0.16000E+01    0.60000E+01    0.74148E+00
 ARIEXC: peak, lower, upper, distance  450    0.17000E+01    0.33000E+01    0.86659E+00
 ARIEXC: peak, lower, upper, distance  452    0.19000E+01    0.41000E+01    0.86072E+00
 ARIEXC: peak, lower, upper, distance  453    0.20000E+01    0.60000E+01    0.78481E+00
 ARIEXC: peak, lower, upper, distance  454    0.18000E+01    0.40000E+01    0.83143E+00
 ARIEXC: peak, lower, upper, distance  455    0.19000E+01    0.39000E+01    0.83649E+00
 ARIEXC: peak, lower, upper, distance  457    0.20000E+01    0.60000E+01    0.79132E+00
 ARIEXC: peak, lower, upper, distance  458    0.20000E+01    0.54000E+01    0.83462E+00
 ARIEXC: peak, lower, upper, distance  459    0.16000E+01    0.60000E+01    0.81241E+00
 ARIEXC: peak, lower, upper, distance  460    0.20000E+01    0.56000E+01    0.85678E+00
 ARIEXC: peak, lower, upper, distance  462    0.20000E+01    0.60000E+01    0.79215E+00
 ARIEXC: peak, lower, upper, distance  464    0.13000E+01    0.22000E+01    0.91013E+00
 ARIEXC: peak, lower, upper, distance  465    0.19000E+01    0.60000E+01    0.74418E+00
 ARIEXC: peak, lower, upper, distance  466    0.20000E+01    0.54000E+01    0.81659E+00
 ARIEXC: peak, lower, upper, distance  467    0.20000E+01    0.60000E+01    0.76727E+00
 ARIEXC: peak, lower, upper, distance  468    0.17000E+01    0.60000E+01    0.78293E+00
 ARIEXC: peak, lower, upper, distance  469    0.16000E+01    0.30000E+01    0.85731E+00
 ARIEXC: peak, lower, upper, distance  470    0.19000E+01    0.60000E+01    0.74171E+00
 ARIEXC: peak, lower, upper, distance  471    0.20000E+01    0.60000E+01    0.78063E+00
 ARIEXC: peak, lower, upper, distance  472    0.20000E+01    0.50000E+01    0.77830E+00
 ARIEXC: peak, lower, upper, distance  473    0.20000E+01    0.56000E+01    0.81850E+00
 ARIEXC: peak, lower, upper, distance  474    0.20000E+01    0.60000E+01    0.79913E+00
 ARIEXC: peak, lower, upper, distance  477    0.19000E+01    0.43000E+01    0.83877E+00
 ARIEXC: peak, lower, upper, distance  478    0.20000E+01    0.60000E+01    0.78387E+00
 ARIEXC: peak, lower, upper, distance  479    0.19000E+01    0.60000E+01    0.77829E+00
 ARIEXC: peak, lower, upper, distance  480    0.18000E+01    0.34000E+01    0.85583E+00
 ARIEXC: peak, lower, upper, distance  481    0.18000E+01    0.38000E+01    0.83410E+00
 ARIEXC: peak, lower, upper, distance  482    0.20000E+01    0.60000E+01    0.75854E+00
 ARIEXC: peak, lower, upper, distance  483    0.17000E+01    0.33000E+01    0.86032E+00
 ARIEXC: peak, lower, upper, distance  484    0.20000E+01    0.60000E+01    0.87902E+00
 ARIEXC: peak, lower, upper, distance  487    0.19000E+01    0.60000E+01    0.74797E+00
 ARIEXC: peak, lower, upper, distance  488    0.18000E+01    0.60000E+01    0.78080E+00
 ARIEXC: peak, lower, upper, distance  489    0.18000E+01    0.60000E+01    0.77764E+00
 ARIEXC: peak, lower, upper, distance  490    0.20000E+01    0.54000E+01    0.86017E+00
 ARIEXC: peak, lower, upper, distance  492    0.19000E+01    0.41000E+01    0.83551E+00
 ARIEXC: peak, lower, upper, distance  493    0.17000E+01    0.31000E+01    0.85992E+00
 ARIEXC: peak, lower, upper, distance  494    0.18000E+01    0.38000E+01    0.83148E+00
 ARIEXC: peak, lower, upper, distance  495    0.19000E+01    0.51000E+01    0.78440E+00
 ARIEXC: peak, lower, upper, distance  496    0.20000E+01    0.60000E+01    0.76060E+00
 ARIEXC: peak, lower, upper, distance  497    0.17000E+01    0.31000E+01    0.87158E+00
 ARIEXC: peak, lower, upper, distance  498    0.19000E+01    0.45000E+01    0.83416E+00
 ARIEXC: peak, lower, upper, distance  499    0.20000E+01    0.60000E+01    0.88235E+00
 ARIEXC: peak, lower, upper, distance  501    0.17000E+01    0.31000E+01    0.86075E+00
 ARIEXC: peak, lower, upper, distance  502    0.18000E+01    0.40000E+01    0.83068E+00
 ARIEXC: peak, lower, upper, distance  503    0.19000E+01    0.53000E+01    0.79381E+00
 ARIEXC: peak, lower, upper, distance  504    0.20000E+01    0.60000E+01    0.80512E+00
 ARIEXC: peak, lower, upper, distance  505    0.20000E+01    0.52000E+01    0.83381E+00
 ARIEXC: peak, lower, upper, distance  507    0.18000E+01    0.40000E+01    0.83158E+00
 ARIEXC: peak, lower, upper, distance  509    0.18000E+01    0.36000E+01    0.83223E+00
 ARIEXC: peak, lower, upper, distance  511    0.20000E+01    0.60000E+01    0.84347E+00
 ARIEXC: peak, lower, upper, distance  519    0.19000E+01    0.39000E+01    0.83191E+00
 ARIEXC: peak, lower, upper, distance  520    0.17000E+01    0.33000E+01    0.86174E+00
 ARIEXC: peak, lower, upper, distance  521    0.17000E+01    0.31000E+01    0.86109E+00
 ARIEXC: peak, lower, upper, distance  526    0.20000E+01    0.60000E+01    0.81469E+00
 ARIEXC: peak, lower, upper, distance  529    0.20000E+01    0.56000E+01    0.82692E+00
 ARIEXC: peak, lower, upper, distance  531    0.20000E+01    0.52000E+01    0.84338E+00
 ARIEXC: peak, lower, upper, distance  532    0.20000E+01    0.60000E+01    0.77837E+00
 ARIEXC: peak, lower, upper, distance  534    0.20000E+01    0.60000E+01    0.73992E+00
 ARIEXC: peak, lower, upper, distance  535    0.18000E+01    0.60000E+01    0.78365E+00
 ARIEXC: peak, lower, upper, distance  541    0.17000E+01    0.31000E+01    0.86302E+00
 ARIEXC: peak, lower, upper, distance  542    0.20000E+01    0.46000E+01    0.83509E+00
 ARIEXC: peak, lower, upper, distance  543    0.20000E+01    0.56000E+01    0.79872E+00
 ARIEXC: peak, lower, upper, distance  548    0.18000E+01    0.36000E+01    0.84191E+00
 ARIEXC: peak, lower, upper, distance  549    0.20000E+01    0.60000E+01    0.76665E+00
 ARIEXC: peak, lower, upper, distance  550    0.20000E+01    0.60000E+01    0.78207E+00
 ARIEXC: peak, lower, upper, distance  551    0.20000E+01    0.54000E+01    0.81544E+00
 ARIEXC: peak, lower, upper, distance  558    0.19000E+01    0.47000E+01    0.83901E+00
 ARIEXC: peak, lower, upper, distance  559    0.19000E+01    0.41000E+01    0.87830E+00
 ARIEXC: peak, lower, upper, distance  560    0.16000E+01    0.60000E+01    0.79429E+00
 ARIEXC: peak, lower, upper, distance  561    0.11000E+01    0.60000E+01    0.76334E+00
 ARIEXC: peak, lower, upper, distance  562    0.17000E+01    0.31000E+01    0.85482E+00
 ARIEXC: peak, lower, upper, distance  563    0.18000E+01    0.36000E+01    0.83161E+00
 ARIEXC: peak, lower, upper, distance  566    0.19000E+01    0.60000E+01    0.77632E+00
 ARIEXC: peak, lower, upper, distance  567    0.16000E+01    0.60000E+01    0.76904E+00
 ARIEXC: peak, lower, upper, distance  568    0.20000E+01    0.58000E+01    0.81336E+00
 ARIEXC: peak, lower, upper, distance  569    0.20000E+01    0.58000E+01    0.83181E+00
 ARIEXC: peak, lower, upper, distance  570    0.20000E+01    0.56000E+01    0.84171E+00
 ARIEXC: peak, lower, upper, distance  571    0.19000E+01    0.60000E+01    0.79405E+00
 ARIEXC: peak, lower, upper, distance  572    0.16000E+01    0.60000E+01    0.77394E+00
 ARIEXC: peak, lower, upper, distance  573    0.20000E+01    0.60000E+01    0.83550E+00
 ARIEXC: peak, lower, upper, distance  574    0.17000E+01    0.33000E+01    0.90569E+00
 ARIEXC: peak, lower, upper, distance  575    0.18000E+01    0.34000E+01    0.87324E+00
 ARIEXC: peak, lower, upper, distance  576    0.20000E+01    0.52000E+01    0.81238E+00
 ARIEXC: peak, lower, upper, distance  577    0.19000E+01    0.57000E+01    0.79987E+00
 ARIEXC: peak, lower, upper, distance  578    0.20000E+01    0.56000E+01    0.81187E+00
 ARIEXC: peak, lower, upper, distance  579    0.19000E+01    0.60000E+01    0.79161E+00
 ARIEXC: peak, lower, upper, distance  580    0.20000E+01    0.60000E+01    0.78393E+00
 ARIEXC: peak, lower, upper, distance  581    0.19000E+01    0.60000E+01    0.79852E+00
 ARIEXC: peak, lower, upper, distance  582    0.18000E+01    0.60000E+01    0.74425E+00
 ARIEXC: peak, lower, upper, distance  583    0.16000E+01    0.60000E+01    0.74154E+00
 ARIEXC: peak, lower, upper, distance  584    0.20000E+01    0.60000E+01    0.80099E+00
 ARIEXC: peak, lower, upper, distance  586    0.20000E+01    0.58000E+01    0.81095E+00
 ARIEXC: peak, lower, upper, distance  587    0.20000E+01    0.50000E+01    0.78004E+00
 ARIEXC: peak, lower, upper, distance  588    0.18000E+01    0.38000E+01    0.86046E+00
 ARIEXC: peak, lower, upper, distance  589    0.18000E+01    0.40000E+01    0.83137E+00
 ARIEXC: peak, lower, upper, distance  590    0.20000E+01    0.56000E+01    0.75715E+00
 ARIEXC: peak, lower, upper, distance  591    0.15000E+01    0.60000E+01    0.80787E+00
 ARIEXC: peak, lower, upper, distance  592    0.20000E+01    0.60000E+01    0.85579E+00
 ARIEXC: peak, lower, upper, distance  593    0.20000E+01    0.60000E+01    0.78653E+00
 ARIEXC: peak, lower, upper, distance  594    0.20000E+01    0.52000E+01    0.83265E+00
 ARIEXC: peak, lower, upper, distance  595    0.19000E+01    0.53000E+01    0.80322E+00
 ARIEXC: peak, lower, upper, distance  596    0.20000E+01    0.54000E+01    0.80836E+00
 ARIEXC: peak, lower, upper, distance  597    0.19000E+01    0.47000E+01    0.85602E+00
 ARIEXC: peak, lower, upper, distance  598    0.19000E+01    0.43000E+01    0.85052E+00
 ARIEXC: peak, lower, upper, distance  599    0.13000E+01    0.22000E+01    0.91011E+00
 ARIEXC: peak, lower, upper, distance  601    0.19000E+01    0.60000E+01    0.74704E+00
 ARIEXC: peak, lower, upper, distance  603    0.18000E+01    0.36000E+01    0.86693E+00
 ARIEXC: peak, lower, upper, distance  604    0.19000E+01    0.39000E+01    0.83740E+00
 ARIEXC: peak, lower, upper, distance  605    0.20000E+01    0.60000E+01    0.76391E+00
 ARIEXC: peak, lower, upper, distance  607    0.19000E+01    0.41000E+01    0.85215E+00
 ARIEXC: peak, lower, upper, distance  609    0.18000E+01    0.34000E+01    0.86101E+00
 ARIEXC: peak, lower, upper, distance  610    0.18000E+01    0.42000E+01    0.84712E+00
 ARIEXC: peak, lower, upper, distance  615    0.19000E+01    0.47000E+01    0.83147E+00
 ARIEXC: peak, lower, upper, distance  616    0.19000E+01    0.47000E+01    0.86101E+00
 ARIEXC: peak, lower, upper, distance  617    0.17000E+01    0.33000E+01    0.83232E+00
 ARIEXC: peak, lower, upper, distance  619    0.20000E+01    0.60000E+01    0.77683E+00
 ARIEXC: peak, lower, upper, distance  620    0.20000E+01    0.60000E+01    0.78117E+00
 ARIEXC: peak, lower, upper, distance  623    0.20000E+01    0.60000E+01    0.82729E+00
 ARIEXC: peak, lower, upper, distance  625    0.20000E+01    0.60000E+01    0.83192E+00
 ARIEXC: peak, lower, upper, distance  626    0.15000E+01    0.25000E+01    0.86287E+00
 ARIEXC: peak, lower, upper, distance  628    0.19000E+01    0.45000E+01    0.83189E+00
 ARIEXC: peak, lower, upper, distance  629    0.18000E+01    0.40000E+01    0.85924E+00
 ARIEXC: peak, lower, upper, distance  630    0.20000E+01    0.60000E+01    0.84010E+00
 ARIEXC: peak, lower, upper, distance  631    0.18000E+01    0.40000E+01    0.80563E+00
 ARIEXC: peak, lower, upper, distance  633    0.19000E+01    0.41000E+01    0.80174E+00
 ARIEXC: peak, lower, upper, distance  635    0.19000E+01    0.43000E+01    0.80296E+00
 ARIEXC: peak, lower, upper, distance  638    0.17000E+01    0.33000E+01    0.87765E+00
 ARIEXC: peak, lower, upper, distance  640    0.20000E+01    0.52000E+01    0.88113E+00
 ARIEXC: peak, lower, upper, distance  641    0.20000E+01    0.60000E+01    0.81129E+00
 ARIEXC: peak, lower, upper, distance  642    0.20000E+01    0.54000E+01    0.78413E+00
 ARIEXC: peak, lower, upper, distance  644    0.20000E+01    0.60000E+01    0.79240E+00
 ARIEXC: peak, lower, upper, distance  645    0.12000E+01    0.22000E+01    0.90957E+00
 ARIEXC: peak, lower, upper, distance  647    0.15000E+01    0.27000E+01    0.86900E+00
 ARIEXC: peak, lower, upper, distance  654    0.18000E+01    0.34000E+01    0.83204E+00
 ARIEXC: peak, lower, upper, distance  657    0.20000E+01    0.60000E+01    0.74401E+00
 ARIEXC: peak, lower, upper, distance  658    0.13000E+01    0.22000E+01    0.90969E+00
 ARIEXC: peak, lower, upper, distance  665    0.15000E+01    0.25000E+01    0.86072E+00
 ARIEXC: peak, lower, upper, distance  666    0.20000E+01    0.56000E+01    0.88014E+00
 ARIEXC: peak, lower, upper, distance  667    0.20000E+01    0.60000E+01    0.80552E+00
 ARIEXC: peak, lower, upper, distance  668    0.18000E+01    0.36000E+01    0.84574E+00
 ARIEXC: peak, lower, upper, distance  669    0.20000E+01    0.54000E+01    0.79339E+00
 ARIEXC: peak, lower, upper, distance  670    0.20000E+01    0.48000E+01    0.79859E+00
 ARIEXC: peak, lower, upper, distance  671    0.19000E+01    0.45000E+01    0.85431E+00
 ARIEXC: peak, lower, upper, distance  672    0.17000E+01    0.33000E+01    0.87026E+00
 ARIEXC: peak, lower, upper, distance  673    0.20000E+01    0.56000E+01    0.80825E+00
 ARIEXC: peak, lower, upper, distance  674    0.18000E+01    0.38000E+01    0.82902E+00
 ARIEXC: peak, lower, upper, distance  676    0.20000E+01    0.58000E+01    0.79122E+00
 ARIEXC: peak, lower, upper, distance  677    0.16000E+01    0.60000E+01    0.74154E+00
 ARIEXC: peak, lower, upper, distance  678    0.12000E+01    0.60000E+01    0.74693E+00
 ARIEXC: peak, lower, upper, distance  679    0.15000E+01    0.25000E+01    0.87176E+00
 ARIEXC: peak, lower, upper, distance  680    0.20000E+01    0.60000E+01    0.79823E+00
 ARIEXC: peak, lower, upper, distance  681    0.19000E+01    0.60000E+01    0.79449E+00
 ARIEXC: peak, lower, upper, distance  684    0.18000E+01    0.42000E+01    0.81795E+00
 ARIEXC: peak, lower, upper, distance  685    0.15000E+01    0.60000E+01    0.84324E+00
 ARIEXC: peak, lower, upper, distance  686    0.20000E+01    0.60000E+01    0.78155E+00
 ARIEXC: peak, lower, upper, distance  687    0.14000E+01    0.60000E+01    0.74174E+00
 ARIEXC: peak, lower, upper, distance  688    0.16000E+01    0.28000E+01    0.85846E+00
 ARIEXC: peak, lower, upper, distance  689    0.13000E+01    0.22000E+01    0.90876E+00
 ARIEXC: peak, lower, upper, distance  690    0.17000E+01    0.29000E+01    0.87183E+00
 ARIEXC: peak, lower, upper, distance  696    0.20000E+01    0.60000E+01    0.75891E+00
 ARIEXC: peak, lower, upper, distance  697    0.19000E+01    0.49000E+01    0.83300E+00
 ARIEXC: peak, lower, upper, distance  698    0.19000E+01    0.39000E+01    0.86937E+00
 ARIEXC: peak, lower, upper, distance  699    0.20000E+01    0.54000E+01    0.79201E+00
 ARIEXC: peak, lower, upper, distance  700    0.19000E+01    0.41000E+01    0.84853E+00
 ARIEXC: peak, lower, upper, distance  701    0.18000E+01    0.38000E+01    0.86915E+00
 ARIEXC: peak, lower, upper, distance  702    0.19000E+01    0.39000E+01    0.83486E+00
 ARIEXC: peak, lower, upper, distance  703    0.19000E+01    0.43000E+01    0.83119E+00
 ARIEXC: peak, lower, upper, distance  704    0.19000E+01    0.60000E+01    0.77202E+00
 ARIEXC: peak, lower, upper, distance  706    0.11000E+01    0.60000E+01    0.77292E+00
 ARIEXC: peak, lower, upper, distance  711    0.19000E+01    0.60000E+01    0.82230E+00
 ARIEXC: peak, lower, upper, distance  712    0.14000E+01    0.24000E+01    0.86962E+00
 ARIEXC: peak, lower, upper, distance  713    0.14000E+01    0.22000E+01    0.90899E+00
 ARIEXC: peak, lower, upper, distance  718    0.19000E+01    0.60000E+01    0.81526E+00
 ARIEXC: peak, lower, upper, distance  719    0.20000E+01    0.60000E+01    0.83834E+00
 ARIEXC: peak, lower, upper, distance  722    0.20000E+01    0.60000E+01    0.74284E+00
 ARIEXC: peak, lower, upper, distance  723    0.17000E+01    0.31000E+01    0.87162E+00
 ARIEXC: peak, lower, upper, distance  725    0.20000E+01    0.60000E+01    0.82142E+00
 ARIEXC: peak, lower, upper, distance  728    0.20000E+01    0.54000E+01    0.83810E+00
 ARIEXC: peak, lower, upper, distance  730    0.17000E+01    0.31000E+01    0.86935E+00
 ARIEXC: peak, lower, upper, distance  731    0.20000E+01    0.52000E+01    0.84297E+00
 ARIEXC: peak, lower, upper, distance  732    0.18000E+01    0.60000E+01    0.75552E+00
 ARIEXC: peak, lower, upper, distance  733    0.17000E+01    0.60000E+01    0.74153E+00
 ARIEXC: peak, lower, upper, distance  736    0.15000E+01    0.25000E+01    0.87966E+00
 ARIEXC: peak, lower, upper, distance  738    0.17000E+01    0.31000E+01    0.89092E+00
 ARIEXC: peak, lower, upper, distance  740    0.20000E+01    0.60000E+01    0.77888E+00
 ARIEXC: peak, lower, upper, distance  741    0.20000E+01    0.60000E+01    0.77146E+00
 ARIEXC: peak, lower, upper, distance  743    0.20000E+01    0.56000E+01    0.84458E+00
 ARIEXC: peak, lower, upper, distance  744    0.18000E+01    0.34000E+01    0.84534E+00
 ARIEXC: peak, lower, upper, distance  745    0.16000E+01    0.30000E+01    0.87125E+00
 ARIEXC: peak, lower, upper, distance  748    0.17000E+01    0.35000E+01    0.87697E+00
 ARIEXC: peak, lower, upper, distance  749    0.20000E+01    0.60000E+01    0.83654E+00
 ARIEXC: peak, lower, upper, distance  750    0.18000E+01    0.40000E+01    0.83162E+00
 ARIEXC: peak, lower, upper, distance  752    0.19000E+01    0.39000E+01    0.83829E+00
 ARIEXC: peak, lower, upper, distance  753    0.17000E+01    0.60000E+01    0.78214E+00
 ARIEXC: peak, lower, upper, distance  754    0.19000E+01    0.60000E+01    0.79526E+00
 ARIEXC: peak, lower, upper, distance  758    0.18000E+01    0.38000E+01    0.83167E+00
 ARIEXC: peak, lower, upper, distance  759    0.20000E+01    0.60000E+01    0.79792E+00
 ARIEXC: peak, lower, upper, distance  760    0.19000E+01    0.60000E+01    0.82552E+00
 ARIEXC: peak, lower, upper, distance  761    0.19000E+01    0.43000E+01    0.89239E+00
 ARIEXC: peak, lower, upper, distance  765    0.19000E+01    0.41000E+01    0.79765E+00
 ARIEXC: peak, lower, upper, distance  768    0.19000E+01    0.51000E+01    0.79582E+00
 ARIEXC: peak, lower, upper, distance  769    0.19000E+01    0.60000E+01    0.79227E+00
 ARIEXC: peak, lower, upper, distance  770    0.20000E+01    0.58000E+01    0.82073E+00
 ARIEXC: peak, lower, upper, distance  771    0.16000E+01    0.28000E+01    0.86943E+00
 ARIEXC: peak, lower, upper, distance  772    0.15000E+01    0.27000E+01    0.84867E+00
 ARIEXC: peak, lower, upper, distance  773    0.16000E+01    0.26000E+01    0.87063E+00
 ARIEXC: peak, lower, upper, distance  774    0.19000E+01    0.45000E+01    0.83395E+00
 ARIEXC: peak, lower, upper, distance  775    0.20000E+01    0.46000E+01    0.80489E+00
 ARIEXC: peak, lower, upper, distance  776    0.18000E+01    0.60000E+01    0.77710E+00
 ARIEXC: peak, lower, upper, distance  781    0.16000E+01    0.30000E+01    0.90361E+00
 ARIEXC: peak, lower, upper, distance  783    0.19000E+01    0.41000E+01    0.84593E+00
 ARIEXC: peak, lower, upper, distance  784    0.20000E+01    0.60000E+01    0.83234E+00
 ARIEXC: peak, lower, upper, distance  788    0.18000E+01    0.38000E+01    0.86552E+00
 ARIEXC: peak, lower, upper, distance  789    0.19000E+01    0.43000E+01    0.84900E+00
 ARIEXC: peak, lower, upper, distance  792    0.17000E+01    0.31000E+01    0.86342E+00
 ARIEXC: peak, lower, upper, distance  793    0.19000E+01    0.60000E+01    0.88227E+00
 ARIEXC: peak, lower, upper, distance  794    0.18000E+01    0.60000E+01    0.80533E+00
 ARIEXC: peak, lower, upper, distance  795    0.18000E+01    0.36000E+01    0.83223E+00
 ARIEXC: peak, lower, upper, distance  798    0.13000E+01    0.22000E+01    0.87060E+00
 ARIEXC: peak, lower, upper, distance  802    0.20000E+01    0.60000E+01    0.79710E+00
 ARIEXC: peak, lower, upper, distance  803    0.16000E+01    0.60000E+01    0.76114E+00
 ARIEXC: peak, lower, upper, distance  804    0.15000E+01    0.60000E+01    0.77224E+00
 ARIEXC: peak, lower, upper, distance  805    0.19000E+01    0.41000E+01    0.83224E+00
 ARIEXC: peak, lower, upper, distance  807    0.20000E+01    0.58000E+01    0.79847E+00
 ARIEXC: peak, lower, upper, distance  813    0.19000E+01    0.37000E+01    0.85637E+00
 ARIEXC: peak, lower, upper, distance  814    0.20000E+01    0.60000E+01    0.83098E+00
 ARIEXC: peak, lower, upper, distance  817    0.17000E+01    0.31000E+01    0.85535E+00
 ARIEXC: peak, lower, upper, distance  821    0.15000E+01    0.60000E+01    0.77790E+00
 ARIEXC: peak, lower, upper, distance  826    0.16000E+01    0.28000E+01    0.85514E+00
 ARIEXC: peak, lower, upper, distance  827    0.19000E+01    0.41000E+01    0.83220E+00
 ARIEXC: peak, lower, upper, distance  831    0.19000E+01    0.49000E+01    0.82118E+00
 ARIEXC: peak, lower, upper, distance  832    0.19000E+01    0.39000E+01    0.79889E+00
 ARIEXC: peak, lower, upper, distance  835    0.16000E+01    0.60000E+01    0.78811E+00
 ARIEXC: peak, lower, upper, distance  839    0.20000E+01    0.60000E+01    0.78174E+00
 ARIEXC: peak, lower, upper, distance  845    0.19000E+01    0.60000E+01    0.78294E+00
 ARIEXC: peak, lower, upper, distance  851    0.19000E+01    0.60000E+01    0.81697E+00
 ARIEXC: peak, lower, upper, distance  852    0.18000E+01    0.60000E+01    0.77853E+00
 ARIEXC: peak, lower, upper, distance  853    0.10000E+01    0.60000E+01    0.74911E+00
 ARIEXC: peak, lower, upper, distance  858    0.19000E+01    0.39000E+01    0.78272E+00
 ARIEXC: peak, lower, upper, distance  860    0.20000E+01    0.52000E+01    0.75943E+00
 ARIEXC: peak, lower, upper, distance  861    0.20000E+01    0.54000E+01    0.74778E+00
 ARIEXC: peak, lower, upper, distance  862    0.17000E+01    0.31000E+01    0.85525E+00
 ARIEXC: peak, lower, upper, distance  863    0.18000E+01    0.38000E+01    0.83642E+00
 ARIEXC: peak, lower, upper, distance  865    0.19000E+01    0.60000E+01    0.76780E+00
 ARIEXC: peak, lower, upper, distance  868    0.18000E+01    0.60000E+01    0.78933E+00
 ARIEXC: peak, lower, upper, distance  869    0.20000E+01    0.60000E+01    0.84252E+00
 ARIEXC: peak, lower, upper, distance  872    0.12000E+01    0.22000E+01    0.90877E+00
 ARIEXC: peak, lower, upper, distance  875    0.19000E+01    0.51000E+01    0.83406E+00
 ARIEXC: peak, lower, upper, distance  876    0.19000E+01    0.43000E+01    0.87106E+00
 ARIEXC: peak, lower, upper, distance  877    0.19000E+01    0.60000E+01    0.83228E+00
 ARIEXC: peak, lower, upper, distance  886    0.19000E+01    0.60000E+01    0.88268E+00
 ARIEXC: peak, lower, upper, distance    1    0.19000E+01    0.43000E+01    0.79332E+00
 ARIEXC: peak, lower, upper, distance    1    0.17000E+01    0.29000E+01    0.84593E+00
 ARIEXC: peak, lower, upper, distance    2    0.17000E+01    0.29000E+01    0.86032E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.43000E+01    0.87027E+00
 ARIEXC: peak, lower, upper, distance    5    0.16000E+01    0.28000E+01    0.87988E+00
 ARIEXC: peak, lower, upper, distance    6    0.17000E+01    0.60000E+01    0.75958E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.60000E+01    0.80988E+00
 ARIEXC: peak, lower, upper, distance    8    0.17000E+01    0.60000E+01    0.77119E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.50000E+01    0.80563E+00
 ARIEXC: peak, lower, upper, distance   10    0.20000E+01    0.60000E+01    0.77790E+00
 ARIEXC: peak, lower, upper, distance   11    0.19000E+01    0.60000E+01    0.77853E+00
 ARIEXC: peak, lower, upper, distance   13    0.19000E+01    0.45000E+01    0.88014E+00
 ARIEXC: peak, lower, upper, distance   14    0.20000E+01    0.60000E+01    0.83565E+00
 ARIEXC: peak, lower, upper, distance   15    0.20000E+01    0.56000E+01    0.86530E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.60000E+01    0.77668E+00
 ARIEXC: peak, lower, upper, distance   17    0.20000E+01    0.48000E+01    0.85094E+00
 ARIEXC: peak, lower, upper, distance   18    0.19000E+01    0.39000E+01    0.83741E+00
 ARIEXC: peak, lower, upper, distance   19    0.20000E+01    0.58000E+01    0.80552E+00
 ARIEXC: peak, lower, upper, distance   20    0.20000E+01    0.50000E+01    0.81412E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.47000E+01    0.82904E+00
 ARIEXC: peak, lower, upper, distance   22    0.16000E+01    0.28000E+01    0.87428E+00
 ARIEXC: peak, lower, upper, distance   23    0.19000E+01    0.53000E+01    0.81065E+00
 ARIEXC: peak, lower, upper, distance   25    0.18000E+01    0.60000E+01    0.77539E+00
 ARIEXC: peak, lower, upper, distance   27    0.20000E+01    0.60000E+01    0.78071E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.60000E+01    0.76020E+00
 ARIEXC: peak, lower, upper, distance   29    0.20000E+01    0.60000E+01    0.77589E+00
 ARIEXC: peak, lower, upper, distance   30    0.20000E+01    0.60000E+01    0.76462E+00
 ARIEXC: peak, lower, upper, distance   33    0.16000E+01    0.30000E+01    0.87762E+00
 ARIEXC: peak, lower, upper, distance   34    0.20000E+01    0.50000E+01    0.83596E+00
 ARIEXC: peak, lower, upper, distance   35    0.20000E+01    0.60000E+01    0.80406E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.60000E+01    0.78533E+00
 ARIEXC: peak, lower, upper, distance   37    0.20000E+01    0.48000E+01    0.82655E+00
 ARIEXC: peak, lower, upper, distance   38    0.20000E+01    0.58000E+01    0.80725E+00
 ARIEXC: peak, lower, upper, distance   39    0.19000E+01    0.47000E+01    0.82770E+00
 ARIEXC: peak, lower, upper, distance   40    0.20000E+01    0.60000E+01    0.78094E+00
 ARIEXC: peak, lower, upper, distance   41    0.19000E+01    0.60000E+01    0.78100E+00
 ARIEXC: peak, lower, upper, distance   43    0.15000E+01    0.27000E+01    0.87072E+00
 ARIEXC: peak, lower, upper, distance   44    0.18000E+01    0.38000E+01    0.83718E+00
 ARIEXC: peak, lower, upper, distance   45    0.19000E+01    0.60000E+01    0.77867E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.60000E+01    0.81697E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.77817E+00
 ARIEXC: peak, lower, upper, distance   49    0.19000E+01    0.41000E+01    0.84948E+00
 ARIEXC: peak, lower, upper, distance   50    0.15000E+01    0.23000E+01    0.87986E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.50000E+01    0.78551E+00
 ARIEXC: peak, lower, upper, distance   53    0.20000E+01    0.50000E+01    0.76999E+00
 ARIEXC: peak, lower, upper, distance   54    0.20000E+01    0.46000E+01    0.84632E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.60000E+01    0.78304E+00
 ARIEXC: peak, lower, upper, distance   56    0.19000E+01    0.60000E+01    0.78070E+00
 ARIEXC: peak, lower, upper, distance   57    0.18000E+01    0.38000E+01    0.83524E+00
 ARIEXC: peak, lower, upper, distance   58    0.16000E+01    0.28000E+01    0.86166E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.60000E+01    0.81114E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.60000E+01    0.77051E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.48000E+01    0.77774E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.43000E+01    0.83901E+00
 ARIEXC: peak, lower, upper, distance   65    0.12000E+01    0.22000E+01    0.91299E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.60000E+01    0.90129E+00
 ARIEXC: peak, lower, upper, distance   68    0.19000E+01    0.51000E+01    0.82459E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.48000E+01    0.80178E+00
 ARIEXC: peak, lower, upper, distance   71    0.20000E+01    0.58000E+01    0.79117E+00
 ARIEXC: peak, lower, upper, distance   72    0.13000E+01    0.22000E+01    0.91303E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.60000E+01    0.80825E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.43000E+01    0.82902E+00
 ARIEXC: peak, lower, upper, distance   78    0.19000E+01    0.60000E+01    0.76181E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.60000E+01    0.76219E+00
 ARIEXC: peak, lower, upper, distance   80    0.19000E+01    0.60000E+01    0.75848E+00
 ARIEXC: peak, lower, upper, distance   81    0.20000E+01    0.54000E+01    0.78427E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.60000E+01    0.79987E+00
 ARIEXC: peak, lower, upper, distance   83    0.17000E+01    0.31000E+01    0.87324E+00
 ARIEXC: peak, lower, upper, distance   84    0.20000E+01    0.50000E+01    0.84411E+00
 ARIEXC: peak, lower, upper, distance   85    0.20000E+01    0.56000E+01    0.80562E+00
 ARIEXC: peak, lower, upper, distance   87    0.15000E+01    0.25000E+01    0.88006E+00
 ARIEXC: peak, lower, upper, distance   88    0.19000E+01    0.39000E+01    0.83841E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.46000E+01    0.83861E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.40000E+01    0.86939E+00
 ARIEXC: peak, lower, upper, distance   92    0.20000E+01    0.60000E+01    0.78196E+00
 ARIEXC: peak, lower, upper, distance   93    0.20000E+01    0.60000E+01    0.85151E+00
 ARIEXC: peak, lower, upper, distance   94    0.19000E+01    0.45000E+01    0.86619E+00
 ARIEXC: peak, lower, upper, distance   95    0.20000E+01    0.56000E+01    0.84132E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.50000E+01    0.82317E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.56000E+01    0.79356E+00
 ARIEXC: peak, lower, upper, distance   98    0.20000E+01    0.48000E+01    0.80744E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.84976E+00
 ARIEXC: peak, lower, upper, distance  101    0.20000E+01    0.60000E+01    0.79816E+00
 ARIEXC: peak, lower, upper, distance  103    0.18000E+01    0.42000E+01    0.83722E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.56000E+01    0.81695E+00
 ARIEXC: peak, lower, upper, distance  105    0.17000E+01    0.60000E+01    0.77422E+00
 ARIEXC: peak, lower, upper, distance  106    0.20000E+01    0.60000E+01    0.87553E+00
 ARIEXC: peak, lower, upper, distance  107    0.20000E+01    0.60000E+01    0.78933E+00
 ARIEXC: peak, lower, upper, distance  108    0.17000E+01    0.31000E+01    0.86101E+00
 ARIEXC: peak, lower, upper, distance  109    0.18000E+01    0.36000E+01    0.85637E+00
 ARIEXC: peak, lower, upper, distance  110    0.20000E+01    0.48000E+01    0.82118E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.78294E+00
 ARIEXC: peak, lower, upper, distance  113    0.16000E+01    0.28000E+01    0.87122E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.75555E+00
 ARIEXC: peak, lower, upper, distance  115    0.19000E+01    0.47000E+01    0.81134E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.83452E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.85904E+00
 ARIEXC: peak, lower, upper, distance  118    0.19000E+01    0.60000E+01    0.78538E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.43000E+01    0.83894E+00
 ARIEXC: peak, lower, upper, distance  120    0.20000E+01    0.60000E+01    0.79853E+00
 ARIEXC: peak, lower, upper, distance  122    0.16000E+01    0.60000E+01    0.74799E+00
 ARIEXC: peak, lower, upper, distance  123    0.14000E+01    0.24000E+01    0.91298E+00
 ARIEXC: peak, lower, upper, distance  124    0.19000E+01    0.60000E+01    0.85794E+00
 ARIEXC: peak, lower, upper, distance  125    0.20000E+01    0.50000E+01    0.83462E+00
 ARIEXC: peak, lower, upper, distance  126    0.20000E+01    0.52000E+01    0.81241E+00
 ARIEXC: peak, lower, upper, distance  127    0.20000E+01    0.56000E+01    0.78755E+00
 ARIEXC: peak, lower, upper, distance  128    0.17000E+01    0.33000E+01    0.87005E+00
 ARIEXC: peak, lower, upper, distance  130    0.18000E+01    0.40000E+01    0.83899E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.82973E+00
 ARIEXC: peak, lower, upper, distance  132    0.20000E+01    0.50000E+01    0.81471E+00
 ARIEXC: peak, lower, upper, distance  133    0.17000E+01    0.35000E+01    0.86885E+00
 ARIEXC: peak, lower, upper, distance  134    0.19000E+01    0.51000E+01    0.80894E+00
 ARIEXC: peak, lower, upper, distance  135    0.19000E+01    0.39000E+01    0.84621E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.43000E+01    0.79397E+00
 ARIEXC: peak, lower, upper, distance  137    0.19000E+01    0.41000E+01    0.84425E+00
 ARIEXC: peak, lower, upper, distance  138    0.16000E+01    0.28000E+01    0.87885E+00
 ARIEXC: peak, lower, upper, distance  139    0.18000E+01    0.34000E+01    0.81393E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.60000E+01    0.77906E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.56000E+01    0.80332E+00
 ARIEXC: peak, lower, upper, distance  142    0.19000E+01    0.60000E+01    0.78157E+00
 ARIEXC: peak, lower, upper, distance  143    0.20000E+01    0.60000E+01    0.80853E+00
 ARIEXC: peak, lower, upper, distance  144    0.19000E+01    0.45000E+01    0.78961E+00
 ARIEXC: peak, lower, upper, distance  145    0.19000E+01    0.60000E+01    0.78121E+00
 ARIEXC: peak, lower, upper, distance  146    0.19000E+01    0.41000E+01    0.86039E+00
 ARIEXC: peak, lower, upper, distance  147    0.15000E+01    0.25000E+01    0.87966E+00
 ARIEXC: peak, lower, upper, distance  148    0.18000E+01    0.38000E+01    0.83527E+00
 ARIEXC: peak, lower, upper, distance  149    0.19000E+01    0.60000E+01    0.79950E+00
 ARIEXC: peak, lower, upper, distance  150    0.19000E+01    0.60000E+01    0.80298E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.45000E+01    0.84915E+00
 ARIEXC: peak, lower, upper, distance  152    0.20000E+01    0.60000E+01    0.75873E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.56000E+01    0.78568E+00
 ARIEXC: peak, lower, upper, distance  155    0.19000E+01    0.41000E+01    0.84453E+00
 ARIEXC: peak, lower, upper, distance  156    0.19000E+01    0.41000E+01    0.83545E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.60000E+01    0.77055E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.87490E+00
 ARIEXC: peak, lower, upper, distance  159    0.18000E+01    0.40000E+01    0.80326E+00
 ARIEXC: peak, lower, upper, distance  160    0.19000E+01    0.47000E+01    0.85100E+00
 ARIEXC: peak, lower, upper, distance  161    0.20000E+01    0.48000E+01    0.78726E+00
 ARIEXC: peak, lower, upper, distance  162    0.19000E+01    0.60000E+01    0.74404E+00
 ARIEXC: peak, lower, upper, distance  163    0.19000E+01    0.43000E+01    0.83721E+00
 ARIEXC: peak, lower, upper, distance  166    0.16000E+01    0.28000E+01    0.87280E+00
 ARIEXC: peak, lower, upper, distance  167    0.19000E+01    0.45000E+01    0.83520E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.60000E+01    0.78559E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.56000E+01    0.83876E+00
 ARIEXC: peak, lower, upper, distance  170    0.20000E+01    0.52000E+01    0.79980E+00
 ARIEXC: peak, lower, upper, distance  171    0.20000E+01    0.60000E+01    0.74844E+00
 ARIEXC: peak, lower, upper, distance  172    0.19000E+01    0.45000E+01    0.81636E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.56000E+01    0.77768E+00
 ARIEXC: peak, lower, upper, distance  175    0.20000E+01    0.60000E+01    0.81176E+00
 ARIEXC: peak, lower, upper, distance  176    0.16000E+01    0.26000E+01    0.87826E+00
 ARIEXC: peak, lower, upper, distance  177    0.18000E+01    0.40000E+01    0.83542E+00
 ARIEXC: peak, lower, upper, distance  179    0.18000E+01    0.36000E+01    0.83649E+00
 ARIEXC: peak, lower, upper, distance  180    0.20000E+01    0.60000E+01    0.79899E+00
 ARIEXC: peak, lower, upper, distance  181    0.18000E+01    0.60000E+01    0.78903E+00
 ARIEXC: peak, lower, upper, distance  182    0.18000E+01    0.38000E+01    0.84280E+00
 ARIEXC: peak, lower, upper, distance  183    0.19000E+01    0.39000E+01    0.85678E+00
 ARIEXC: peak, lower, upper, distance  184    0.18000E+01    0.34000E+01    0.87841E+00
 ARIEXC: peak, lower, upper, distance  185    0.20000E+01    0.50000E+01    0.83830E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.54000E+01    0.80768E+00
 ARIEXC: peak, lower, upper, distance  187    0.18000E+01    0.34000E+01    0.84845E+00
 ARIEXC: peak, lower, upper, distance  188    0.19000E+01    0.60000E+01    0.85588E+00
 ARIEXC: peak, lower, upper, distance  189    0.19000E+01    0.60000E+01    0.80743E+00
 ARIEXC: peak, lower, upper, distance  190    0.20000E+01    0.52000E+01    0.81659E+00
 ARIEXC: peak, lower, upper, distance  191    0.19000E+01    0.39000E+01    0.83877E+00
 ARIEXC: peak, lower, upper, distance  192    0.18000E+01    0.40000E+01    0.81850E+00
 ARIEXC: peak, lower, upper, distance  196    0.19000E+01    0.43000E+01    0.83551E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.80884E+00
 ARIEXC: peak, lower, upper, distance  198    0.19000E+01    0.45000E+01    0.80419E+00
 ARIEXC: peak, lower, upper, distance  199    0.19000E+01    0.43000E+01    0.85679E+00
 ARIEXC: peak, lower, upper, distance  200    0.20000E+01    0.54000E+01    0.87902E+00
 ARIEXC: peak, lower, upper, distance  201    0.20000E+01    0.56000E+01    0.81729E+00
 ARIEXC: peak, lower, upper, distance  202    0.19000E+01    0.43000E+01    0.84915E+00
 ARIEXC: peak, lower, upper, distance  203    0.20000E+01    0.56000E+01    0.82278E+00
 ARIEXC: peak, lower, upper, distance  204    0.20000E+01    0.56000E+01    0.80786E+00
 ARIEXC: peak, lower, upper, distance  205    0.16000E+01    0.28000E+01    0.87158E+00
 ARIEXC: peak, lower, upper, distance  206    0.19000E+01    0.60000E+01    0.82565E+00
 ARIEXC: peak, lower, upper, distance  207    0.20000E+01    0.60000E+01    0.76242E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.46000E+01    0.84347E+00
 ARIEXC: peak, lower, upper, distance  209    0.19000E+01    0.47000E+01    0.81309E+00
 ARIEXC: peak, lower, upper, distance  211    0.19000E+01    0.41000E+01    0.83654E+00
 ARIEXC: peak, lower, upper, distance  212    0.18000E+01    0.34000E+01    0.83416E+00
 ARIEXC: peak, lower, upper, distance  213    0.20000E+01    0.60000E+01    0.79132E+00
 ARIEXC: peak, lower, upper, distance  214    0.20000E+01    0.60000E+01    0.77655E+00
 ARIEXC: peak, lower, upper, distance  215    0.20000E+01    0.50000E+01    0.86465E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.60000E+01    0.77798E+00
 ARIEXC: peak, lower, upper, distance  217    0.19000E+01    0.60000E+01    0.77691E+00
 ARIEXC: peak, lower, upper, distance  218    0.20000E+01    0.46000E+01    0.83509E+00
 ARIEXC: peak, lower, upper, distance  219    0.16000E+01    0.30000E+01    0.87697E+00
 ARIEXC: peak, lower, upper, distance  220    0.20000E+01    0.48000E+01    0.80246E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.43000E+01    0.84338E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.47000E+01    0.81544E+00
 ARIEXC: peak, lower, upper, distance  224    0.17000E+01    0.33000E+01    0.86302E+00
 ARIEXC: peak, lower, upper, distance  225    0.19000E+01    0.47000E+01    0.86286E+00
 ARIEXC: peak, lower, upper, distance  226    0.19000E+01    0.60000E+01    0.77632E+00
 ARIEXC: peak, lower, upper, distance  227    0.19000E+01    0.47000E+01    0.81336E+00
 ARIEXC: peak, lower, upper, distance  228    0.20000E+01    0.60000E+01    0.78207E+00
 ARIEXC: peak, lower, upper, distance  230    0.19000E+01    0.41000E+01    0.84188E+00
 ARIEXC: peak, lower, upper, distance  231    0.19000E+01    0.51000E+01    0.80787E+00
 ARIEXC: peak, lower, upper, distance  232    0.20000E+01    0.52000E+01    0.85579E+00
 ARIEXC: peak, lower, upper, distance  233    0.19000E+01    0.60000E+01    0.78982E+00
 ARIEXC: peak, lower, upper, distance  234    0.19000E+01    0.60000E+01    0.83675E+00
 ARIEXC: peak, lower, upper, distance  237    0.17000E+01    0.35000E+01    0.85046E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.76919E+00
 ARIEXC: peak, lower, upper, distance  239    0.18000E+01    0.36000E+01    0.83740E+00
 ARIEXC: peak, lower, upper, distance  240    0.20000E+01    0.50000E+01    0.80322E+00
 ARIEXC: peak, lower, upper, distance  241    0.19000E+01    0.43000E+01    0.85052E+00
 ARIEXC: peak, lower, upper, distance  242    0.17000E+01    0.33000E+01    0.90569E+00
 ARIEXC: peak, lower, upper, distance  243    0.20000E+01    0.60000E+01    0.79405E+00
 ARIEXC: peak, lower, upper, distance  245    0.19000E+01    0.49000E+01    0.78117E+00
 ARIEXC: peak, lower, upper, distance  246    0.17000E+01    0.31000E+01    0.86693E+00
 ARIEXC: peak, lower, upper, distance  247    0.18000E+01    0.60000E+01    0.78921E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.47000E+01    0.84010E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.36000E+01    0.84900E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.78289E+00
 ARIEXC: peak, lower, upper, distance  253    0.15000E+01    0.27000E+01    0.87026E+00
 ARIEXC: peak, lower, upper, distance  255    0.19000E+01    0.45000E+01    0.83834E+00
 ARIEXC: peak, lower, upper, distance  256    0.20000E+01    0.50000E+01    0.79560E+00
 ARIEXC: peak, lower, upper, distance  257    0.18000E+01    0.34000E+01    0.84071E+00
 ARIEXC: peak, lower, upper, distance  258    0.20000E+01    0.58000E+01    0.80106E+00
 ARIEXC: peak, lower, upper, distance  259    0.20000E+01    0.56000E+01    0.89365E+00
 ARIEXC: peak, lower, upper, distance  260    0.19000E+01    0.43000E+01    0.84960E+00
 ARIEXC: peak, lower, upper, distance  262    0.18000E+01    0.38000E+01    0.83973E+00
 ARIEXC: peak, lower, upper, distance  264    0.18000E+01    0.36000E+01    0.83209E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.60000E+01    0.78784E+00
 ARIEXC: peak, lower, upper, distance  266    0.17000E+01    0.60000E+01    0.77589E+00
 ARIEXC: peak, lower, upper, distance    1    0.20000E+01    0.52000E+01    0.84091E+00
 ARIEXC: peak, lower, upper, distance    2    0.16000E+01    0.30000E+01    0.86096E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.60000E+01    0.78525E+00
 ARIEXC: peak, lower, upper, distance    4    0.11000E+01    0.60000E+01    0.74132E+00
 ARIEXC: peak, lower, upper, distance    5    0.20000E+01    0.58000E+01    0.80624E+00
 ARIEXC: peak, lower, upper, distance    6    0.20000E+01    0.60000E+01    0.77837E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.50000E+01    0.78847E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.60000E+01    0.78021E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.56000E+01    0.84123E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.60000E+01    0.75870E+00
 ARIEXC: peak, lower, upper, distance   12    0.19000E+01    0.60000E+01    0.78293E+00
 ARIEXC: peak, lower, upper, distance   13    0.18000E+01    0.36000E+01    0.84519E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.74501E+00
 ARIEXC: peak, lower, upper, distance   16    0.18000E+01    0.60000E+01    0.78435E+00
 ARIEXC: peak, lower, upper, distance   17    0.17000E+01    0.35000E+01    0.87072E+00
 ARIEXC: peak, lower, upper, distance   20    0.19000E+01    0.60000E+01    0.76798E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.60000E+01    0.77286E+00
 ARIEXC: peak, lower, upper, distance   24    0.19000E+01    0.49000E+01    0.80664E+00
 ARIEXC: peak, lower, upper, distance   25    0.14000E+01    0.24000E+01    0.84467E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.83905E+00
 ARIEXC: peak, lower, upper, distance   42    0.20000E+01    0.58000E+01    0.80370E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.60000E+01    0.77346E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.43000E+01    0.79453E+00
 ARIEXC: peak, lower, upper, distance   56    0.20000E+01    0.60000E+01    0.77117E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.58000E+01    0.76665E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.58000E+01    0.76463E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.76889E+00
 ARIEXC: peak, lower, upper, distance   66    0.20000E+01    0.46000E+01    0.82181E+00
 ARIEXC: peak, lower, upper, distance   67    0.20000E+01    0.52000E+01    0.79341E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.33000E+01    0.86074E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.47000E+01    0.81579E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.60000E+01    0.79119E+00
 ARIEXC: peak, lower, upper, distance   71    0.17000E+01    0.33000E+01    0.85385E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.80866E+00
 ARIEXC: peak, lower, upper, distance   73    0.16000E+01    0.26000E+01    0.85722E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.52000E+01    0.81373E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.60000E+01    0.76033E+00
 ARIEXC: peak, lower, upper, distance   77    0.16000E+01    0.28000E+01    0.86172E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.58000E+01    0.79872E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.56000E+01    0.78247E+00
 ARIEXC: peak, lower, upper, distance   80    0.17000E+01    0.33000E+01    0.83033E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.50000E+01    0.79708E+00
 ARIEXC: peak, lower, upper, distance   83    0.19000E+01    0.60000E+01    0.73992E+00
 ARIEXC: peak, lower, upper, distance   84    0.17000E+01    0.35000E+01    0.86181E+00
 ARIEXC: peak, lower, upper, distance   85    0.19000E+01    0.41000E+01    0.83740E+00
 ARIEXC: peak, lower, upper, distance   86    0.20000E+01    0.54000E+01    0.80473E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.54000E+01    0.77875E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.77096E+00
 ARIEXC: peak, lower, upper, distance   91    0.18000E+01    0.40000E+01    0.85026E+00
 ARIEXC: peak, lower, upper, distance   93    0.19000E+01    0.39000E+01    0.85415E+00
 ARIEXC: peak, lower, upper, distance   95    0.19000E+01    0.39000E+01    0.83124E+00
 ARIEXC: peak, lower, upper, distance   96    0.18000E+01    0.60000E+01    0.74990E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.60000E+01    0.78636E+00
 ARIEXC: peak, lower, upper, distance   98    0.17000E+01    0.33000E+01    0.84770E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.79935E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.45000E+01    0.80498E+00
 ARIEXC: peak, lower, upper, distance  102    0.18000E+01    0.38000E+01    0.80489E+00
 ARIEXC: peak, lower, upper, distance  103    0.19000E+01    0.60000E+01    0.78283E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.46000E+01    0.85426E+00
 ARIEXC: peak, lower, upper, distance  105    0.20000E+01    0.60000E+01    0.82293E+00
 ARIEXC: peak, lower, upper, distance  106    0.19000E+01    0.43000E+01    0.80836E+00
 ARIEXC: peak, lower, upper, distance  107    0.18000E+01    0.40000E+01    0.85602E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.74140E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.83265E+00
 ARIEXC: peak, lower, upper, distance  112    0.19000E+01    0.60000E+01    0.78653E+00
 ARIEXC: peak, lower, upper, distance  113    0.20000E+01    0.54000E+01    0.82532E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.78512E+00
 ARIEXC: peak, lower, upper, distance  115    0.18000E+01    0.40000E+01    0.86089E+00
 ARIEXC: peak, lower, upper, distance  116    0.20000E+01    0.50000E+01    0.78979E+00
 ARIEXC: peak, lower, upper, distance  117    0.20000E+01    0.60000E+01    0.75783E+00
 COUNTV:  839 violations above         0.10000
 ARIA>      end 
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_5.float opened.
 ARIA> REVE ((segid "    " and resid 2    and name HB1 ) OR   ( segid "    " and resid 2    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HB1 ) OR   ( segid "    " and resid 3    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HG1 ) OR   ( segid "    " and resid 3    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 4    and name HB1 ) OR   ( segid "    " and resid 4    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HG1 ) OR   ( segid "    " and resid 5    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HD11) OR   ( segid "    " and resid 6    and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HG1 ) OR   ( segid "    " and resid 8    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HG1 ) OR   ( segid "    " and resid 12   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HG1 ) OR   ( segid "    " and resid 13   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH11) OR   ( segid "    " and resid 13   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 14   and name HB1 ) OR   ( segid "    " and resid 14   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 14   and name HG1 ) OR   ( segid "    " and resid 14   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 14   and name HE21) OR   ( segid "    " and resid 14   and name HE22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 15   and name HB1 ) OR   ( segid "    " and resid 15   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 16   and name HG11) OR   ( segid "    " and resid 16   and name HG21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HG1 ) OR   ( segid "    " and resid 19   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HH11) OR   ( segid "    " and resid 19   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HG1 ) OR   ( segid "    " and resid 26   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 27   and name HB1 ) OR   ( segid "    " and resid 27   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HG1 ) OR   ( segid "    " and resid 28   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 32   and name HB1 ) OR   ( segid "    " and resid 32   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HB1 ) OR   ( segid "    " and resid 33   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HG1 ) OR   ( segid "    " and resid 33   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HD1 ) OR   ( segid "    " and resid 33   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 36   and name HB1 ) OR   ( segid "    " and resid 36   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HG1 ) OR   ( segid "    " and resid 38   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($count=$count+1) 
 EVALUATE: symbol $COUNT set to    2.00000     (real)
 CNSsolve>end loop main 
 CNSsolve>while ($count le $Iterations.Assignstruct) loop main 
 NEXTCD: condition evaluated as true
 CNSsolve>   evaluate ($file = $filenames.bestfile_$count) 
 EVALUATE: symbol $FILE set to "PREVIT:ww1_4.pdb" (string)
 CNSsolve>   display $file 
PREVIT:ww1_4.pdb
 CNSsolve>   coor init end 
 COOR: selected main coordinates initialized
 CNSsolve>   if ($file ne "") then 
 NEXTCD: condition evaluated as true
 CNSsolve>      coor @@$file 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_4.pdb opened.
 COOR>REMARK FILENAME="/usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_4.pdb" 
 COOR>REMARK =============================================================== 
 COOR>REMARK            overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK energies: 222.76, 1.60685, 16.7329, 1.64528, 173.639, 24.0894, 0, 4.2395, 0.807227, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK            bonds,angles,impropers,dihe,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK rms-dev.: 1.592001E-03,0.310027,0.176184,41.9875,9.697674E-03,0.48642,0,0,0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK               noe,cdih,coup,sani,dani,vean 
 COOR>REMARK               >0.3,>5,>1,>0,>5 
 COOR>REMARK violations.: 0, 0, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK DATE:02-Mar-2010  13:58:28       created by user: fkieken 
 COOR>REMARK VERSION:1.1 
 COOR>ATOM      1  HA1 GLY     1      13.614  15.542  -7.013  1.00  0.00 
 COOR>ATOM      2  HA2 GLY     1      12.777  16.986  -6.463  1.00  0.00 
 CNSsolve>      eval ($floatfile = $file - ".pdb" + ".float") 
 EVALUATE: symbol $FLOATFILE set to "PREVIT:ww1_4.float" (string)
 CNSsolve>      fileexist $floatfile end  eval ($qfloatfile = $result) 
 MISCOM: file exists
 EVALUATE: symbol $QFLOATFILE set to TRUE (logical)
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_4.float opened.
 ARIA> REVE ((segid "    " and resid 1    and name HA1 ) OR   ( segid "    " and resid 1    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HB1 ) OR   ( segid "    " and resid 3    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HD1 ) OR   ( segid "    " and resid 3    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HB1 ) OR   ( segid "    " and resid 5    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HD1 ) OR   ( segid "    " and resid 5    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HB1 ) OR   ( segid "    " and resid 6    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HB1 ) OR   ( segid "    " and resid 7    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HG1 ) OR   ( segid "    " and resid 7    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HD1 ) OR   ( segid "    " and resid 7    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HG1 ) OR   ( segid "    " and resid 8    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 9    and name HA1 ) OR   ( segid "    " and resid 9    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HG1 ) OR   ( segid "    " and resid 11   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HB1 ) OR   ( segid "    " and resid 12   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HG1 ) OR   ( segid "    " and resid 12   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH11) OR   ( segid "    " and resid 13   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH21) OR   ( segid "    " and resid 13   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 14   and name HB1 ) OR   ( segid "    " and resid 14   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HG1 ) OR   ( segid "    " and resid 19   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HD1 ) OR   ( segid "    " and resid 19   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 24   and name HD21) OR   ( segid "    " and resid 24   and name HD22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HG1 ) OR   ( segid "    " and resid 26   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 27   and name HB1 ) OR   ( segid "    " and resid 27   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HG1 ) OR   ( segid "    " and resid 28   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH11) OR   ( segid "    " and resid 28   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 32   and name HB1 ) OR   ( segid "    " and resid 32   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HB1 ) OR   ( segid "    " and resid 34   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HD1 ) OR   ( segid "    " and resid 34   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>      aria 
 ARIA>         analyse_restraints aver end 
DISACC: accumulating distance matrix with dimension  269
 AMBVAC: read in   990 distances in mode ACCU
 ARIA>         countvio threshold $Iterations.violtoler end 
 ARIEXC: peak, lower, upper, distance    1    0.18000E+01    0.36000E+01    0.88030E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.48000E+01    0.86739E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.45000E+01    0.83874E+00
 ARIEXC: peak, lower, upper, distance    5    0.19000E+01    0.47000E+01    0.83141E+00
 ARIEXC: peak, lower, upper, distance    6    0.18000E+01    0.36000E+01    0.86026E+00
 ARIEXC: peak, lower, upper, distance    7    0.19000E+01    0.53000E+01    0.81432E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.43000E+01    0.83202E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.54000E+01    0.75458E+00
 ARIEXC: peak, lower, upper, distance   13    0.20000E+01    0.58000E+01    0.84002E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.86769E+00
 ARIEXC: peak, lower, upper, distance   15    0.18000E+01    0.36000E+01    0.85626E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.45000E+01    0.86620E+00
 ARIEXC: peak, lower, upper, distance   17    0.19000E+01    0.60000E+01    0.84302E+00
 ARIEXC: peak, lower, upper, distance   21    0.13000E+01    0.22000E+01    0.91026E+00
 ARIEXC: peak, lower, upper, distance   23    0.13000E+01    0.60000E+01    0.83880E+00
 ARIEXC: peak, lower, upper, distance   24    0.20000E+01    0.60000E+01    0.80127E+00
 ARIEXC: peak, lower, upper, distance   26    0.15000E+01    0.27000E+01    0.87738E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.43000E+01    0.83281E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.85107E+00
 ARIEXC: peak, lower, upper, distance   30    0.18000E+01    0.38000E+01    0.80728E+00
 ARIEXC: peak, lower, upper, distance   31    0.18000E+01    0.36000E+01    0.87457E+00
 ARIEXC: peak, lower, upper, distance   33    0.18000E+01    0.60000E+01    0.80544E+00
 ARIEXC: peak, lower, upper, distance   34    0.19000E+01    0.49000E+01    0.84968E+00
 ARIEXC: peak, lower, upper, distance   35    0.19000E+01    0.60000E+01    0.76447E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.41000E+01    0.78837E+00
 ARIEXC: peak, lower, upper, distance   43    0.13000E+01    0.22000E+01    0.91048E+00
 ARIEXC: peak, lower, upper, distance   44    0.16000E+01    0.30000E+01    0.86710E+00
 ARIEXC: peak, lower, upper, distance   45    0.17000E+01    0.33000E+01    0.83251E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.43000E+01    0.79170E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.80377E+00
 ARIEXC: peak, lower, upper, distance   52    0.18000E+01    0.34000E+01    0.83221E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.41000E+01    0.82985E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.46000E+01    0.80029E+00
 ARIEXC: peak, lower, upper, distance   57    0.19000E+01    0.51000E+01    0.75090E+00
 ARIEXC: peak, lower, upper, distance   59    0.17000E+01    0.31000E+01    0.83228E+00
 ARIEXC: peak, lower, upper, distance   60    0.18000E+01    0.40000E+01    0.80818E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.86864E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.60000E+01    0.75631E+00
 ARIEXC: peak, lower, upper, distance   63    0.20000E+01    0.58000E+01    0.74537E+00
 ARIEXC: peak, lower, upper, distance   64    0.19000E+01    0.53000E+01    0.83801E+00
 ARIEXC: peak, lower, upper, distance   65    0.16000E+01    0.28000E+01    0.85028E+00
 ARIEXC: peak, lower, upper, distance   66    0.16000E+01    0.28000E+01    0.87521E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.41000E+01    0.86985E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.31000E+01    0.85349E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.60000E+01    0.78196E+00
 ARIEXC: peak, lower, upper, distance   71    0.19000E+01    0.45000E+01    0.83279E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.80946E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.41000E+01    0.83044E+00
 ARIEXC: peak, lower, upper, distance   76    0.20000E+01    0.52000E+01    0.88222E+00
 ARIEXC: peak, lower, upper, distance   77    0.13000E+01    0.22000E+01    0.91088E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.48000E+01    0.84692E+00
 ARIEXC: peak, lower, upper, distance   82    0.19000E+01    0.60000E+01    0.78427E+00
 ARIEXC: peak, lower, upper, distance   86    0.19000E+01    0.60000E+01    0.77179E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.79520E+00
 ARIEXC: peak, lower, upper, distance   91    0.19000E+01    0.60000E+01    0.82956E+00
 ARIEXC: peak, lower, upper, distance   93    0.16000E+01    0.26000E+01    0.86979E+00
 ARIEXC: peak, lower, upper, distance   95    0.11000E+01    0.60000E+01    0.77613E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.60000E+01    0.77287E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.41000E+01    0.80002E+00
 ARIEXC: peak, lower, upper, distance  100    0.20000E+01    0.56000E+01    0.75309E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.41000E+01    0.80391E+00
 ARIEXC: peak, lower, upper, distance  102    0.15000E+01    0.25000E+01    0.86933E+00
 ARIEXC: peak, lower, upper, distance  103    0.20000E+01    0.60000E+01    0.79756E+00
 ARIEXC: peak, lower, upper, distance  104    0.18000E+01    0.42000E+01    0.83480E+00
 ARIEXC: peak, lower, upper, distance  105    0.19000E+01    0.53000E+01    0.80442E+00
 ARIEXC: peak, lower, upper, distance  108    0.18000E+01    0.36000E+01    0.85774E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.81091E+00
 ARIEXC: peak, lower, upper, distance  110    0.17000E+01    0.29000E+01    0.85494E+00
 ARIEXC: peak, lower, upper, distance  112    0.20000E+01    0.60000E+01    0.79127E+00
 ARIEXC: peak, lower, upper, distance  113    0.19000E+01    0.43000E+01    0.84244E+00
 ARIEXC: peak, lower, upper, distance  114    0.20000E+01    0.58000E+01    0.75466E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.85492E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.85047E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.60000E+01    0.75112E+00
 ARIEXC: peak, lower, upper, distance  120    0.17000E+01    0.31000E+01    0.85477E+00
 ARIEXC: peak, lower, upper, distance  121    0.20000E+01    0.60000E+01    0.78307E+00
 ARIEXC: peak, lower, upper, distance  122    0.19000E+01    0.60000E+01    0.84039E+00
 ARIEXC: peak, lower, upper, distance  123    0.20000E+01    0.50000E+01    0.81833E+00
 ARIEXC: peak, lower, upper, distance  124    0.17000E+01    0.33000E+01    0.85580E+00
 ARIEXC: peak, lower, upper, distance  126    0.19000E+01    0.49000E+01    0.85835E+00
 ARIEXC: peak, lower, upper, distance  127    0.19000E+01    0.43000E+01    0.85389E+00
 ARIEXC: peak, lower, upper, distance  128    0.19000E+01    0.51000E+01    0.77560E+00
 ARIEXC: peak, lower, upper, distance  129    0.19000E+01    0.43000E+01    0.79145E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.85092E+00
 ARIEXC: peak, lower, upper, distance  132    0.19000E+01    0.45000E+01    0.86081E+00
 ARIEXC: peak, lower, upper, distance  133    0.19000E+01    0.60000E+01    0.80835E+00
 ARIEXC: peak, lower, upper, distance  134    0.20000E+01    0.48000E+01    0.81978E+00
 ARIEXC: peak, lower, upper, distance  135    0.17000E+01    0.60000E+01    0.78467E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.39000E+01    0.83633E+00
 ARIEXC: peak, lower, upper, distance  137    0.17000E+01    0.31000E+01    0.87254E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.52000E+01    0.81437E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.54000E+01    0.82717E+00
 ARIEXC: peak, lower, upper, distance  143    0.13000E+01    0.22000E+01    0.91045E+00
 ARIEXC: peak, lower, upper, distance  146    0.18000E+01    0.36000E+01    0.83456E+00
 ARIEXC: peak, lower, upper, distance  148    0.14000E+01    0.60000E+01    0.78022E+00
 ARIEXC: peak, lower, upper, distance  149    0.18000E+01    0.38000E+01    0.85794E+00
 ARIEXC: peak, lower, upper, distance  150    0.20000E+01    0.50000E+01    0.81474E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.60000E+01    0.75151E+00
 ARIEXC: peak, lower, upper, distance  153    0.19000E+01    0.60000E+01    0.75869E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.60000E+01    0.77858E+00
 ARIEXC: peak, lower, upper, distance  155    0.15000E+01    0.25000E+01    0.88204E+00
 ARIEXC: peak, lower, upper, distance  156    0.18000E+01    0.36000E+01    0.83796E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.43000E+01    0.83317E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.85046E+00
 ARIEXC: peak, lower, upper, distance  160    0.20000E+01    0.58000E+01    0.79903E+00
 ARIEXC: peak, lower, upper, distance  162    0.17000E+01    0.60000E+01    0.76304E+00
 ARIEXC: peak, lower, upper, distance  164    0.19000E+01    0.60000E+01    0.77985E+00
 ARIEXC: peak, lower, upper, distance  165    0.20000E+01    0.46000E+01    0.81141E+00
 ARIEXC: peak, lower, upper, distance  166    0.20000E+01    0.50000E+01    0.81040E+00
 ARIEXC: peak, lower, upper, distance  167    0.17000E+01    0.33000E+01    0.87388E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.39000E+01    0.84770E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.60000E+01    0.79938E+00
 ARIEXC: peak, lower, upper, distance  170    0.18000E+01    0.60000E+01    0.76682E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.46000E+01    0.77176E+00
 ARIEXC: peak, lower, upper, distance  174    0.20000E+01    0.52000E+01    0.77134E+00
 ARIEXC: peak, lower, upper, distance  175    0.19000E+01    0.43000E+01    0.81384E+00
 ARIEXC: peak, lower, upper, distance  177    0.20000E+01    0.52000E+01    0.82118E+00
 ARIEXC: peak, lower, upper, distance  178    0.20000E+01    0.60000E+01    0.77607E+00
 ARIEXC: peak, lower, upper, distance  180    0.19000E+01    0.45000E+01    0.84607E+00
 ARIEXC: peak, lower, upper, distance  181    0.14000E+01    0.60000E+01    0.79977E+00
 ARIEXC: peak, lower, upper, distance  183    0.20000E+01    0.60000E+01    0.80368E+00
 ARIEXC: peak, lower, upper, distance  184    0.20000E+01    0.48000E+01    0.82652E+00
 ARIEXC: peak, lower, upper, distance  185    0.18000E+01    0.60000E+01    0.80195E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.58000E+01    0.85450E+00
 ARIEXC: peak, lower, upper, distance  188    0.20000E+01    0.60000E+01    0.75837E+00
 ARIEXC: peak, lower, upper, distance  189    0.20000E+01    0.60000E+01    0.87415E+00
 ARIEXC: peak, lower, upper, distance  190    0.19000E+01    0.60000E+01    0.79240E+00
 ARIEXC: peak, lower, upper, distance  191    0.18000E+01    0.60000E+01    0.80804E+00
 ARIEXC: peak, lower, upper, distance  193    0.17000E+01    0.33000E+01    0.83658E+00
 ARIEXC: peak, lower, upper, distance  194    0.19000E+01    0.60000E+01    0.79274E+00
 ARIEXC: peak, lower, upper, distance  195    0.17000E+01    0.60000E+01    0.81832E+00
 ARIEXC: peak, lower, upper, distance  196    0.17000E+01    0.31000E+01    0.85965E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.77537E+00
 ARIEXC: peak, lower, upper, distance  198    0.18000E+01    0.36000E+01    0.84616E+00
 ARIEXC: peak, lower, upper, distance  199    0.15000E+01    0.23000E+01    0.87646E+00
 ARIEXC: peak, lower, upper, distance  200    0.17000E+01    0.31000E+01    0.84579E+00
 ARIEXC: peak, lower, upper, distance  201    0.19000E+01    0.60000E+01    0.79326E+00
 ARIEXC: peak, lower, upper, distance  203    0.19000E+01    0.41000E+01    0.87001E+00
 ARIEXC: peak, lower, upper, distance  205    0.20000E+01    0.52000E+01    0.79243E+00
 ARIEXC: peak, lower, upper, distance  206    0.20000E+01    0.56000E+01    0.75845E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.60000E+01    0.78024E+00
 ARIEXC: peak, lower, upper, distance  209    0.18000E+01    0.40000E+01    0.83455E+00
 ARIEXC: peak, lower, upper, distance  212    0.19000E+01    0.41000E+01    0.82985E+00
 ARIEXC: peak, lower, upper, distance  213    0.17000E+01    0.33000E+01    0.83474E+00
 ARIEXC: peak, lower, upper, distance  214    0.18000E+01    0.40000E+01    0.83656E+00
 ARIEXC: peak, lower, upper, distance  215    0.19000E+01    0.43000E+01    0.81954E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.47000E+01    0.79989E+00
 ARIEXC: peak, lower, upper, distance  217    0.15000E+01    0.60000E+01    0.77008E+00
 ARIEXC: peak, lower, upper, distance  219    0.17000E+01    0.31000E+01    0.85469E+00
 ARIEXC: peak, lower, upper, distance  220    0.18000E+01    0.36000E+01    0.83209E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.49000E+01    0.79977E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.51000E+01    0.85381E+00
 ARIEXC: peak, lower, upper, distance  223    0.19000E+01    0.49000E+01    0.79842E+00
 ARIEXC: peak, lower, upper, distance  224    0.20000E+01    0.58000E+01    0.84492E+00
 ARIEXC: peak, lower, upper, distance  226    0.20000E+01    0.52000E+01    0.79040E+00
 ARIEXC: peak, lower, upper, distance  227    0.20000E+01    0.60000E+01    0.81521E+00
 ARIEXC: peak, lower, upper, distance  230    0.20000E+01    0.56000E+01    0.86879E+00
 ARIEXC: peak, lower, upper, distance  231    0.20000E+01    0.56000E+01    0.80821E+00
 ARIEXC: peak, lower, upper, distance  232    0.13000E+01    0.22000E+01    0.91003E+00
 ARIEXC: peak, lower, upper, distance  236    0.20000E+01    0.56000E+01    0.81248E+00
 ARIEXC: peak, lower, upper, distance  237    0.19000E+01    0.60000E+01    0.77969E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.76805E+00
 ARIEXC: peak, lower, upper, distance  239    0.19000E+01    0.60000E+01    0.77537E+00
 ARIEXC: peak, lower, upper, distance  241    0.17000E+01    0.60000E+01    0.76884E+00
 ARIEXC: peak, lower, upper, distance  242    0.20000E+01    0.60000E+01    0.80327E+00
 ARIEXC: peak, lower, upper, distance  243    0.19000E+01    0.51000E+01    0.84674E+00
 ARIEXC: peak, lower, upper, distance  244    0.18000E+01    0.34000E+01    0.85899E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.41000E+01    0.81939E+00
 ARIEXC: peak, lower, upper, distance  249    0.19000E+01    0.39000E+01    0.86462E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.38000E+01    0.85466E+00
 ARIEXC: peak, lower, upper, distance  251    0.18000E+01    0.38000E+01    0.86962E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.76591E+00
 ARIEXC: peak, lower, upper, distance  253    0.19000E+01    0.60000E+01    0.80693E+00
 ARIEXC: peak, lower, upper, distance  258    0.17000E+01    0.33000E+01    0.85894E+00
 ARIEXC: peak, lower, upper, distance  259    0.17000E+01    0.31000E+01    0.83204E+00
 ARIEXC: peak, lower, upper, distance  260    0.20000E+01    0.60000E+01    0.77157E+00
 ARIEXC: peak, lower, upper, distance  261    0.20000E+01    0.60000E+01    0.78452E+00
 ARIEXC: peak, lower, upper, distance  262    0.19000E+01    0.45000E+01    0.78729E+00
 ARIEXC: peak, lower, upper, distance  263    0.20000E+01    0.52000E+01    0.80894E+00
 ARIEXC: peak, lower, upper, distance  264    0.15000E+01    0.25000E+01    0.87894E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.43000E+01    0.83803E+00
 ARIEXC: peak, lower, upper, distance  266    0.19000E+01    0.43000E+01    0.83559E+00
 ARIEXC: peak, lower, upper, distance  269    0.20000E+01    0.52000E+01    0.78966E+00
 ARIEXC: peak, lower, upper, distance  270    0.16000E+01    0.30000E+01    0.85958E+00
 ARIEXC: peak, lower, upper, distance  271    0.20000E+01    0.60000E+01    0.80548E+00
 ARIEXC: peak, lower, upper, distance  272    0.19000E+01    0.43000E+01    0.80848E+00
 ARIEXC: peak, lower, upper, distance  273    0.20000E+01    0.60000E+01    0.78866E+00
 ARIEXC: peak, lower, upper, distance  274    0.19000E+01    0.60000E+01    0.82241E+00
 ARIEXC: peak, lower, upper, distance  275    0.19000E+01    0.47000E+01    0.80428E+00
 ARIEXC: peak, lower, upper, distance  276    0.20000E+01    0.56000E+01    0.83347E+00
 ARIEXC: peak, lower, upper, distance  277    0.18000E+01    0.36000E+01    0.86316E+00
 ARIEXC: peak, lower, upper, distance  279    0.20000E+01    0.54000E+01    0.75470E+00
 ARIEXC: peak, lower, upper, distance  280    0.20000E+01    0.60000E+01    0.79523E+00
 ARIEXC: peak, lower, upper, distance  282    0.18000E+01    0.60000E+01    0.82946E+00
 ARIEXC: peak, lower, upper, distance  283    0.20000E+01    0.60000E+01    0.89230E+00
 ARIEXC: peak, lower, upper, distance  284    0.17000E+01    0.60000E+01    0.83620E+00
 ARIEXC: peak, lower, upper, distance  288    0.19000E+01    0.47000E+01    0.83898E+00
 ARIEXC: peak, lower, upper, distance  289    0.19000E+01    0.51000E+01    0.86378E+00
 ARIEXC: peak, lower, upper, distance  291    0.17000E+01    0.31000E+01    0.85870E+00
 ARIEXC: peak, lower, upper, distance  292    0.17000E+01    0.35000E+01    0.83162E+00
 ARIEXC: peak, lower, upper, distance  293    0.17000E+01    0.60000E+01    0.78127E+00
 ARIEXC: peak, lower, upper, distance  294    0.17000E+01    0.60000E+01    0.74345E+00
 ARIEXC: peak, lower, upper, distance  296    0.19000E+01    0.49000E+01    0.85442E+00
 ARIEXC: peak, lower, upper, distance  297    0.18000E+01    0.40000E+01    0.85376E+00
 ARIEXC: peak, lower, upper, distance  298    0.19000E+01    0.60000E+01    0.81536E+00
 ARIEXC: peak, lower, upper, distance  299    0.20000E+01    0.60000E+01    0.80252E+00
 ARIEXC: peak, lower, upper, distance  300    0.19000E+01    0.60000E+01    0.79517E+00
 ARIEXC: peak, lower, upper, distance  307    0.13000E+01    0.22000E+01    0.91020E+00
 ARIEXC: peak, lower, upper, distance  310    0.20000E+01    0.60000E+01    0.74280E+00
 ARIEXC: peak, lower, upper, distance  311    0.18000E+01    0.60000E+01    0.75806E+00
 ARIEXC: peak, lower, upper, distance  312    0.20000E+01    0.60000E+01    0.80093E+00
 ARIEXC: peak, lower, upper, distance  313    0.20000E+01    0.60000E+01    0.86596E+00
 ARIEXC: peak, lower, upper, distance  314    0.19000E+01    0.60000E+01    0.74206E+00
 ARIEXC: peak, lower, upper, distance  316    0.16000E+01    0.28000E+01    0.85541E+00
 ARIEXC: peak, lower, upper, distance  318    0.19000E+01    0.43000E+01    0.83556E+00
 ARIEXC: peak, lower, upper, distance  319    0.20000E+01    0.60000E+01    0.81214E+00
 ARIEXC: peak, lower, upper, distance  320    0.19000E+01    0.60000E+01    0.74774E+00
 ARIEXC: peak, lower, upper, distance  322    0.15000E+01    0.27000E+01    0.86393E+00
 ARIEXC: peak, lower, upper, distance  324    0.20000E+01    0.48000E+01    0.85113E+00
 ARIEXC: peak, lower, upper, distance  325    0.19000E+01    0.60000E+01    0.79653E+00
 ARIEXC: peak, lower, upper, distance  326    0.20000E+01    0.56000E+01    0.80371E+00
 ARIEXC: peak, lower, upper, distance  327    0.17000E+01    0.33000E+01    0.85134E+00
 ARIEXC: peak, lower, upper, distance  328    0.20000E+01    0.56000E+01    0.85012E+00
 ARIEXC: peak, lower, upper, distance  329    0.20000E+01    0.60000E+01    0.83197E+00
 ARIEXC: peak, lower, upper, distance  331    0.20000E+01    0.58000E+01    0.82185E+00
 ARIEXC: peak, lower, upper, distance  332    0.20000E+01    0.60000E+01    0.85457E+00
 ARIEXC: peak, lower, upper, distance  333    0.19000E+01    0.43000E+01    0.84800E+00
 ARIEXC: peak, lower, upper, distance  337    0.19000E+01    0.55000E+01    0.81238E+00
 ARIEXC: peak, lower, upper, distance  340    0.20000E+01    0.60000E+01    0.83996E+00
 ARIEXC: peak, lower, upper, distance  344    0.20000E+01    0.60000E+01    0.72823E+00
 ARIEXC: peak, lower, upper, distance  345    0.17000E+01    0.31000E+01    0.87406E+00
 ARIEXC: peak, lower, upper, distance  346    0.20000E+01    0.54000E+01    0.83651E+00
 ARIEXC: peak, lower, upper, distance  347    0.18000E+01    0.42000E+01    0.79210E+00
 ARIEXC: peak, lower, upper, distance  348    0.16000E+01    0.60000E+01    0.74536E+00
 ARIEXC: peak, lower, upper, distance  351    0.17000E+01    0.29000E+01    0.85409E+00
 ARIEXC: peak, lower, upper, distance  352    0.20000E+01    0.60000E+01    0.77481E+00
 ARIEXC: peak, lower, upper, distance  353    0.18000E+01    0.36000E+01    0.83307E+00
 ARIEXC: peak, lower, upper, distance  354    0.19000E+01    0.60000E+01    0.78773E+00
 ARIEXC: peak, lower, upper, distance  355    0.20000E+01    0.54000E+01    0.80889E+00
 ARIEXC: peak, lower, upper, distance  356    0.20000E+01    0.60000E+01    0.79144E+00
 ARIEXC: peak, lower, upper, distance  357    0.20000E+01    0.60000E+01    0.74618E+00
 ARIEXC: peak, lower, upper, distance  360    0.18000E+01    0.34000E+01    0.84034E+00
 ARIEXC: peak, lower, upper, distance  363    0.20000E+01    0.50000E+01    0.86735E+00
 ARIEXC: peak, lower, upper, distance  365    0.19000E+01    0.60000E+01    0.75686E+00
 ARIEXC: peak, lower, upper, distance  367    0.16000E+01    0.30000E+01    0.86568E+00
 ARIEXC: peak, lower, upper, distance  368    0.18000E+01    0.38000E+01    0.83592E+00
 ARIEXC: peak, lower, upper, distance  369    0.20000E+01    0.60000E+01    0.78374E+00
 ARIEXC: peak, lower, upper, distance  370    0.20000E+01    0.56000E+01    0.77895E+00
 ARIEXC: peak, lower, upper, distance  372    0.18000E+01    0.34000E+01    0.86604E+00
 ARIEXC: peak, lower, upper, distance  373    0.17000E+01    0.33000E+01    0.83232E+00
 ARIEXC: peak, lower, upper, distance  377    0.20000E+01    0.60000E+01    0.79679E+00
 ARIEXC: peak, lower, upper, distance  378    0.18000E+01    0.60000E+01    0.81293E+00
 ARIEXC: peak, lower, upper, distance  379    0.20000E+01    0.52000E+01    0.81485E+00
 ARIEXC: peak, lower, upper, distance  380    0.17000E+01    0.60000E+01    0.76708E+00
 ARIEXC: peak, lower, upper, distance  381    0.20000E+01    0.54000E+01    0.85777E+00
 ARIEXC: peak, lower, upper, distance  382    0.18000E+01    0.38000E+01    0.80406E+00
 ARIEXC: peak, lower, upper, distance  383    0.20000E+01    0.48000E+01    0.84807E+00
 ARIEXC: peak, lower, upper, distance  384    0.17000E+01    0.33000E+01    0.86316E+00
 ARIEXC: peak, lower, upper, distance  385    0.18000E+01    0.34000E+01    0.87895E+00
 ARIEXC: peak, lower, upper, distance  387    0.16000E+01    0.26000E+01    0.84752E+00
 ARIEXC: peak, lower, upper, distance  390    0.19000E+01    0.60000E+01    0.75133E+00
 ARIEXC: peak, lower, upper, distance  391    0.20000E+01    0.60000E+01    0.74091E+00
 ARIEXC: peak, lower, upper, distance  394    0.17000E+01    0.60000E+01    0.75341E+00
 ARIEXC: peak, lower, upper, distance  395    0.19000E+01    0.60000E+01    0.74705E+00
 ARIEXC: peak, lower, upper, distance  396    0.17000E+01    0.60000E+01    0.79952E+00
 ARIEXC: peak, lower, upper, distance  397    0.19000E+01    0.43000E+01    0.83690E+00
 ARIEXC: peak, lower, upper, distance  399    0.13000E+01    0.60000E+01    0.78393E+00
 ARIEXC: peak, lower, upper, distance  400    0.19000E+01    0.49000E+01    0.80730E+00
 ARIEXC: peak, lower, upper, distance  401    0.18000E+01    0.36000E+01    0.86819E+00
 ARIEXC: peak, lower, upper, distance  402    0.17000E+01    0.33000E+01    0.86513E+00
 ARIEXC: peak, lower, upper, distance  403    0.19000E+01    0.53000E+01    0.81397E+00
 ARIEXC: peak, lower, upper, distance  404    0.18000E+01    0.38000E+01    0.83566E+00
 ARIEXC: peak, lower, upper, distance  405    0.18000E+01    0.60000E+01    0.78009E+00
 ARIEXC: peak, lower, upper, distance  406    0.16000E+01    0.60000E+01    0.74654E+00
 ARIEXC: peak, lower, upper, distance  407    0.19000E+01    0.43000E+01    0.81315E+00
 ARIEXC: peak, lower, upper, distance  408    0.18000E+01    0.60000E+01    0.79552E+00
 ARIEXC: peak, lower, upper, distance  411    0.19000E+01    0.60000E+01    0.77862E+00
 ARIEXC: peak, lower, upper, distance  414    0.19000E+01    0.41000E+01    0.87273E+00
 ARIEXC: peak, lower, upper, distance  416    0.16000E+01    0.60000E+01    0.78430E+00
 ARIEXC: peak, lower, upper, distance  417    0.19000E+01    0.43000E+01    0.84551E+00
 ARIEXC: peak, lower, upper, distance  418    0.20000E+01    0.60000E+01    0.77203E+00
 ARIEXC: peak, lower, upper, distance  422    0.20000E+01    0.60000E+01    0.79931E+00
 ARIEXC: peak, lower, upper, distance  423    0.18000E+01    0.60000E+01    0.74142E+00
 ARIEXC: peak, lower, upper, distance  427    0.20000E+01    0.60000E+01    0.86515E+00
 ARIEXC: peak, lower, upper, distance  428    0.17000E+01    0.31000E+01    0.85540E+00
 ARIEXC: peak, lower, upper, distance  429    0.20000E+01    0.60000E+01    0.76941E+00
 ARIEXC: peak, lower, upper, distance  431    0.20000E+01    0.60000E+01    0.77324E+00
 ARIEXC: peak, lower, upper, distance  432    0.20000E+01    0.50000E+01    0.84549E+00
 ARIEXC: peak, lower, upper, distance  442    0.19000E+01    0.60000E+01    0.76897E+00
 ARIEXC: peak, lower, upper, distance  444    0.18000E+01    0.36000E+01    0.85516E+00
 ARIEXC: peak, lower, upper, distance  446    0.20000E+01    0.60000E+01    0.82120E+00
 ARIEXC: peak, lower, upper, distance  447    0.18000E+01    0.36000E+01    0.83659E+00
 ARIEXC: peak, lower, upper, distance  448    0.20000E+01    0.60000E+01    0.77264E+00
 ARIEXC: peak, lower, upper, distance  449    0.16000E+01    0.60000E+01    0.74482E+00
 ARIEXC: peak, lower, upper, distance  450    0.17000E+01    0.33000E+01    0.86396E+00
 ARIEXC: peak, lower, upper, distance  452    0.19000E+01    0.41000E+01    0.85689E+00
 ARIEXC: peak, lower, upper, distance  453    0.20000E+01    0.60000E+01    0.77803E+00
 ARIEXC: peak, lower, upper, distance  454    0.18000E+01    0.40000E+01    0.83157E+00
 ARIEXC: peak, lower, upper, distance  455    0.19000E+01    0.39000E+01    0.84945E+00
 ARIEXC: peak, lower, upper, distance  457    0.20000E+01    0.60000E+01    0.82275E+00
 ARIEXC: peak, lower, upper, distance  458    0.20000E+01    0.54000E+01    0.81224E+00
 ARIEXC: peak, lower, upper, distance  459    0.16000E+01    0.60000E+01    0.79197E+00
 ARIEXC: peak, lower, upper, distance  460    0.20000E+01    0.56000E+01    0.85175E+00
 ARIEXC: peak, lower, upper, distance  462    0.20000E+01    0.60000E+01    0.76503E+00
 ARIEXC: peak, lower, upper, distance  464    0.13000E+01    0.22000E+01    0.90995E+00
 ARIEXC: peak, lower, upper, distance  465    0.19000E+01    0.60000E+01    0.83576E+00
 ARIEXC: peak, lower, upper, distance  466    0.20000E+01    0.54000E+01    0.80896E+00
 ARIEXC: peak, lower, upper, distance  467    0.20000E+01    0.60000E+01    0.75885E+00
 ARIEXC: peak, lower, upper, distance  468    0.17000E+01    0.60000E+01    0.81826E+00
 ARIEXC: peak, lower, upper, distance  469    0.16000E+01    0.30000E+01    0.83195E+00
 ARIEXC: peak, lower, upper, distance  470    0.19000E+01    0.60000E+01    0.74047E+00
 ARIEXC: peak, lower, upper, distance  471    0.20000E+01    0.60000E+01    0.79758E+00
 ARIEXC: peak, lower, upper, distance  472    0.20000E+01    0.50000E+01    0.77031E+00
 ARIEXC: peak, lower, upper, distance  473    0.20000E+01    0.56000E+01    0.81049E+00
 ARIEXC: peak, lower, upper, distance  474    0.20000E+01    0.60000E+01    0.79750E+00
 ARIEXC: peak, lower, upper, distance  477    0.19000E+01    0.43000E+01    0.83975E+00
 ARIEXC: peak, lower, upper, distance  478    0.20000E+01    0.60000E+01    0.78582E+00
 ARIEXC: peak, lower, upper, distance  479    0.19000E+01    0.60000E+01    0.75132E+00
 ARIEXC: peak, lower, upper, distance  480    0.18000E+01    0.34000E+01    0.86121E+00
 ARIEXC: peak, lower, upper, distance  481    0.18000E+01    0.38000E+01    0.82598E+00
 ARIEXC: peak, lower, upper, distance  482    0.20000E+01    0.60000E+01    0.75809E+00
 ARIEXC: peak, lower, upper, distance  483    0.17000E+01    0.33000E+01    0.85302E+00
 ARIEXC: peak, lower, upper, distance  484    0.20000E+01    0.60000E+01    0.87247E+00
 ARIEXC: peak, lower, upper, distance  487    0.19000E+01    0.60000E+01    0.74340E+00
 ARIEXC: peak, lower, upper, distance  488    0.18000E+01    0.60000E+01    0.77855E+00
 ARIEXC: peak, lower, upper, distance  489    0.18000E+01    0.60000E+01    0.78041E+00
 ARIEXC: peak, lower, upper, distance  490    0.20000E+01    0.54000E+01    0.85438E+00
 ARIEXC: peak, lower, upper, distance  492    0.19000E+01    0.41000E+01    0.84116E+00
 ARIEXC: peak, lower, upper, distance  493    0.17000E+01    0.31000E+01    0.83142E+00
 ARIEXC: peak, lower, upper, distance  494    0.18000E+01    0.38000E+01    0.86147E+00
 ARIEXC: peak, lower, upper, distance  495    0.19000E+01    0.51000E+01    0.78689E+00
 ARIEXC: peak, lower, upper, distance  496    0.20000E+01    0.60000E+01    0.77018E+00
 ARIEXC: peak, lower, upper, distance  497    0.17000E+01    0.31000E+01    0.87189E+00
 ARIEXC: peak, lower, upper, distance  498    0.19000E+01    0.45000E+01    0.83419E+00
 ARIEXC: peak, lower, upper, distance  499    0.20000E+01    0.60000E+01    0.77511E+00
 ARIEXC: peak, lower, upper, distance  501    0.17000E+01    0.31000E+01    0.85372E+00
 ARIEXC: peak, lower, upper, distance  502    0.18000E+01    0.40000E+01    0.86204E+00
 ARIEXC: peak, lower, upper, distance  503    0.19000E+01    0.53000E+01    0.82747E+00
 ARIEXC: peak, lower, upper, distance  504    0.20000E+01    0.60000E+01    0.80402E+00
 ARIEXC: peak, lower, upper, distance  505    0.20000E+01    0.52000E+01    0.83138E+00
 ARIEXC: peak, lower, upper, distance  507    0.18000E+01    0.40000E+01    0.83266E+00
 ARIEXC: peak, lower, upper, distance  509    0.18000E+01    0.36000E+01    0.86090E+00
 ARIEXC: peak, lower, upper, distance  511    0.20000E+01    0.60000E+01    0.80380E+00
 ARIEXC: peak, lower, upper, distance  519    0.19000E+01    0.39000E+01    0.86177E+00
 ARIEXC: peak, lower, upper, distance  520    0.17000E+01    0.33000E+01    0.86223E+00
 ARIEXC: peak, lower, upper, distance  521    0.17000E+01    0.31000E+01    0.83192E+00
 ARIEXC: peak, lower, upper, distance  526    0.20000E+01    0.60000E+01    0.80258E+00
 ARIEXC: peak, lower, upper, distance  529    0.20000E+01    0.56000E+01    0.77816E+00
 ARIEXC: peak, lower, upper, distance  531    0.20000E+01    0.52000E+01    0.77361E+00
 ARIEXC: peak, lower, upper, distance  532    0.20000E+01    0.60000E+01    0.83854E+00
 ARIEXC: peak, lower, upper, distance  534    0.20000E+01    0.60000E+01    0.76569E+00
 ARIEXC: peak, lower, upper, distance  535    0.18000E+01    0.60000E+01    0.76872E+00
 ARIEXC: peak, lower, upper, distance  541    0.17000E+01    0.31000E+01    0.87523E+00
 ARIEXC: peak, lower, upper, distance  542    0.20000E+01    0.46000E+01    0.83551E+00
 ARIEXC: peak, lower, upper, distance  543    0.20000E+01    0.56000E+01    0.80712E+00
 ARIEXC: peak, lower, upper, distance  548    0.18000E+01    0.36000E+01    0.84361E+00
 ARIEXC: peak, lower, upper, distance  549    0.20000E+01    0.60000E+01    0.78285E+00
 ARIEXC: peak, lower, upper, distance  550    0.20000E+01    0.60000E+01    0.77817E+00
 ARIEXC: peak, lower, upper, distance  551    0.20000E+01    0.54000E+01    0.81776E+00
 ARIEXC: peak, lower, upper, distance  558    0.19000E+01    0.47000E+01    0.83646E+00
 ARIEXC: peak, lower, upper, distance  559    0.19000E+01    0.41000E+01    0.87751E+00
 ARIEXC: peak, lower, upper, distance  560    0.16000E+01    0.60000E+01    0.79244E+00
 ARIEXC: peak, lower, upper, distance  561    0.11000E+01    0.60000E+01    0.76469E+00
 ARIEXC: peak, lower, upper, distance  562    0.17000E+01    0.31000E+01    0.85558E+00
 ARIEXC: peak, lower, upper, distance  563    0.18000E+01    0.36000E+01    0.83170E+00
 ARIEXC: peak, lower, upper, distance  566    0.19000E+01    0.60000E+01    0.77756E+00
 ARIEXC: peak, lower, upper, distance  567    0.16000E+01    0.60000E+01    0.77016E+00
 ARIEXC: peak, lower, upper, distance  568    0.20000E+01    0.58000E+01    0.82108E+00
 ARIEXC: peak, lower, upper, distance  569    0.20000E+01    0.58000E+01    0.83941E+00
 ARIEXC: peak, lower, upper, distance  570    0.20000E+01    0.56000E+01    0.84057E+00
 ARIEXC: peak, lower, upper, distance  571    0.19000E+01    0.60000E+01    0.78754E+00
 ARIEXC: peak, lower, upper, distance  572    0.16000E+01    0.60000E+01    0.77015E+00
 ARIEXC: peak, lower, upper, distance  573    0.20000E+01    0.60000E+01    0.83219E+00
 ARIEXC: peak, lower, upper, distance  574    0.17000E+01    0.33000E+01    0.89695E+00
 ARIEXC: peak, lower, upper, distance  575    0.18000E+01    0.34000E+01    0.87405E+00
 ARIEXC: peak, lower, upper, distance  576    0.20000E+01    0.52000E+01    0.81268E+00
 ARIEXC: peak, lower, upper, distance  577    0.19000E+01    0.57000E+01    0.79790E+00
 ARIEXC: peak, lower, upper, distance  578    0.20000E+01    0.56000E+01    0.81216E+00
 ARIEXC: peak, lower, upper, distance  579    0.19000E+01    0.60000E+01    0.79183E+00
 ARIEXC: peak, lower, upper, distance  580    0.20000E+01    0.60000E+01    0.78222E+00
 ARIEXC: peak, lower, upper, distance  581    0.19000E+01    0.60000E+01    0.79894E+00
 ARIEXC: peak, lower, upper, distance  582    0.18000E+01    0.60000E+01    0.79213E+00
 ARIEXC: peak, lower, upper, distance  583    0.16000E+01    0.60000E+01    0.74131E+00
 ARIEXC: peak, lower, upper, distance  584    0.20000E+01    0.60000E+01    0.80132E+00
 ARIEXC: peak, lower, upper, distance  586    0.20000E+01    0.58000E+01    0.81065E+00
 ARIEXC: peak, lower, upper, distance  587    0.20000E+01    0.50000E+01    0.77597E+00
 ARIEXC: peak, lower, upper, distance  588    0.18000E+01    0.38000E+01    0.83212E+00
 ARIEXC: peak, lower, upper, distance  589    0.18000E+01    0.40000E+01    0.86671E+00
 ARIEXC: peak, lower, upper, distance  590    0.20000E+01    0.56000E+01    0.76241E+00
 ARIEXC: peak, lower, upper, distance  591    0.15000E+01    0.60000E+01    0.87175E+00
 ARIEXC: peak, lower, upper, distance  592    0.20000E+01    0.60000E+01    0.83876E+00
 ARIEXC: peak, lower, upper, distance  593    0.20000E+01    0.60000E+01    0.82533E+00
 ARIEXC: peak, lower, upper, distance  594    0.20000E+01    0.52000E+01    0.78629E+00
 ARIEXC: peak, lower, upper, distance  595    0.19000E+01    0.53000E+01    0.84383E+00
 ARIEXC: peak, lower, upper, distance  596    0.20000E+01    0.54000E+01    0.85569E+00
 ARIEXC: peak, lower, upper, distance  597    0.19000E+01    0.47000E+01    0.81212E+00
 ARIEXC: peak, lower, upper, distance  598    0.19000E+01    0.43000E+01    0.79176E+00
 ARIEXC: peak, lower, upper, distance  599    0.13000E+01    0.22000E+01    0.91016E+00
 ARIEXC: peak, lower, upper, distance  601    0.19000E+01    0.60000E+01    0.75340E+00
 ARIEXC: peak, lower, upper, distance  603    0.18000E+01    0.36000E+01    0.85381E+00
 ARIEXC: peak, lower, upper, distance  604    0.19000E+01    0.39000E+01    0.83855E+00
 ARIEXC: peak, lower, upper, distance  605    0.20000E+01    0.60000E+01    0.74734E+00
 ARIEXC: peak, lower, upper, distance  607    0.19000E+01    0.41000E+01    0.84984E+00
 ARIEXC: peak, lower, upper, distance  609    0.18000E+01    0.34000E+01    0.85366E+00
 ARIEXC: peak, lower, upper, distance  610    0.18000E+01    0.42000E+01    0.80725E+00
 ARIEXC: peak, lower, upper, distance  615    0.19000E+01    0.47000E+01    0.83160E+00
 ARIEXC: peak, lower, upper, distance  616    0.19000E+01    0.47000E+01    0.86350E+00
 ARIEXC: peak, lower, upper, distance  617    0.17000E+01    0.33000E+01    0.83227E+00
 ARIEXC: peak, lower, upper, distance  619    0.20000E+01    0.60000E+01    0.81787E+00
 ARIEXC: peak, lower, upper, distance  620    0.20000E+01    0.60000E+01    0.88220E+00
 ARIEXC: peak, lower, upper, distance  623    0.20000E+01    0.60000E+01    0.82467E+00
 ARIEXC: peak, lower, upper, distance  625    0.20000E+01    0.60000E+01    0.85291E+00
 ARIEXC: peak, lower, upper, distance  626    0.15000E+01    0.25000E+01    0.86289E+00
 ARIEXC: peak, lower, upper, distance  628    0.19000E+01    0.45000E+01    0.85302E+00
 ARIEXC: peak, lower, upper, distance  629    0.18000E+01    0.40000E+01    0.84103E+00
 ARIEXC: peak, lower, upper, distance  630    0.20000E+01    0.60000E+01    0.83754E+00
 ARIEXC: peak, lower, upper, distance  631    0.18000E+01    0.40000E+01    0.78596E+00
 ARIEXC: peak, lower, upper, distance  633    0.19000E+01    0.41000E+01    0.85638E+00
 ARIEXC: peak, lower, upper, distance  635    0.19000E+01    0.43000E+01    0.82742E+00
 ARIEXC: peak, lower, upper, distance  638    0.17000E+01    0.33000E+01    0.81217E+00
 ARIEXC: peak, lower, upper, distance  640    0.20000E+01    0.52000E+01    0.84604E+00
 ARIEXC: peak, lower, upper, distance  641    0.20000E+01    0.60000E+01    0.79463E+00
 ARIEXC: peak, lower, upper, distance  642    0.20000E+01    0.54000E+01    0.80288E+00
 ARIEXC: peak, lower, upper, distance  644    0.20000E+01    0.60000E+01    0.79377E+00
 ARIEXC: peak, lower, upper, distance  645    0.12000E+01    0.22000E+01    0.91036E+00
 ARIEXC: peak, lower, upper, distance  647    0.15000E+01    0.27000E+01    0.87133E+00
 ARIEXC: peak, lower, upper, distance  654    0.18000E+01    0.34000E+01    0.86139E+00
 ARIEXC: peak, lower, upper, distance  657    0.20000E+01    0.60000E+01    0.77999E+00
 ARIEXC: peak, lower, upper, distance  658    0.13000E+01    0.22000E+01    0.90958E+00
 ARIEXC: peak, lower, upper, distance  665    0.15000E+01    0.25000E+01    0.86143E+00
 ARIEXC: peak, lower, upper, distance  666    0.20000E+01    0.56000E+01    0.87972E+00
 ARIEXC: peak, lower, upper, distance  667    0.20000E+01    0.60000E+01    0.80863E+00
 ARIEXC: peak, lower, upper, distance  668    0.18000E+01    0.36000E+01    0.84753E+00
 ARIEXC: peak, lower, upper, distance  669    0.20000E+01    0.54000E+01    0.79241E+00
 ARIEXC: peak, lower, upper, distance  670    0.20000E+01    0.48000E+01    0.79873E+00
 ARIEXC: peak, lower, upper, distance  671    0.19000E+01    0.45000E+01    0.86635E+00
 ARIEXC: peak, lower, upper, distance  672    0.17000E+01    0.33000E+01    0.87894E+00
 ARIEXC: peak, lower, upper, distance  673    0.20000E+01    0.56000E+01    0.81446E+00
 ARIEXC: peak, lower, upper, distance  674    0.18000E+01    0.38000E+01    0.87137E+00
 ARIEXC: peak, lower, upper, distance  676    0.20000E+01    0.58000E+01    0.79072E+00
 ARIEXC: peak, lower, upper, distance  677    0.16000E+01    0.60000E+01    0.74422E+00
 ARIEXC: peak, lower, upper, distance  678    0.12000E+01    0.60000E+01    0.76438E+00
 ARIEXC: peak, lower, upper, distance  679    0.15000E+01    0.25000E+01    0.86950E+00
 ARIEXC: peak, lower, upper, distance  680    0.20000E+01    0.60000E+01    0.79876E+00
 ARIEXC: peak, lower, upper, distance  681    0.19000E+01    0.60000E+01    0.79220E+00
 ARIEXC: peak, lower, upper, distance  684    0.18000E+01    0.42000E+01    0.78800E+00
 ARIEXC: peak, lower, upper, distance  685    0.15000E+01    0.60000E+01    0.79421E+00
 ARIEXC: peak, lower, upper, distance  686    0.20000E+01    0.60000E+01    0.77094E+00
 ARIEXC: peak, lower, upper, distance  687    0.14000E+01    0.60000E+01    0.74149E+00
 ARIEXC: peak, lower, upper, distance  688    0.16000E+01    0.28000E+01    0.87506E+00
 ARIEXC: peak, lower, upper, distance  689    0.13000E+01    0.22000E+01    0.90895E+00
 ARIEXC: peak, lower, upper, distance  690    0.17000E+01    0.29000E+01    0.86862E+00
 ARIEXC: peak, lower, upper, distance  696    0.20000E+01    0.60000E+01    0.75663E+00
 ARIEXC: peak, lower, upper, distance  697    0.19000E+01    0.49000E+01    0.83411E+00
 ARIEXC: peak, lower, upper, distance  698    0.19000E+01    0.39000E+01    0.87092E+00
 ARIEXC: peak, lower, upper, distance  699    0.20000E+01    0.54000E+01    0.79301E+00
 ARIEXC: peak, lower, upper, distance  700    0.19000E+01    0.41000E+01    0.84522E+00
 ARIEXC: peak, lower, upper, distance  701    0.18000E+01    0.38000E+01    0.87089E+00
 ARIEXC: peak, lower, upper, distance  702    0.19000E+01    0.39000E+01    0.83043E+00
 ARIEXC: peak, lower, upper, distance  703    0.19000E+01    0.43000E+01    0.85272E+00
 ARIEXC: peak, lower, upper, distance  704    0.19000E+01    0.60000E+01    0.79711E+00
 ARIEXC: peak, lower, upper, distance  706    0.11000E+01    0.60000E+01    0.78501E+00
 ARIEXC: peak, lower, upper, distance  711    0.19000E+01    0.60000E+01    0.80958E+00
 ARIEXC: peak, lower, upper, distance  712    0.14000E+01    0.24000E+01    0.86899E+00
 ARIEXC: peak, lower, upper, distance  713    0.14000E+01    0.22000E+01    0.90894E+00
 ARIEXC: peak, lower, upper, distance  718    0.19000E+01    0.60000E+01    0.79698E+00
 ARIEXC: peak, lower, upper, distance  719    0.20000E+01    0.60000E+01    0.80173E+00
 ARIEXC: peak, lower, upper, distance  722    0.20000E+01    0.60000E+01    0.75440E+00
 ARIEXC: peak, lower, upper, distance  723    0.17000E+01    0.31000E+01    0.86933E+00
 ARIEXC: peak, lower, upper, distance  725    0.20000E+01    0.60000E+01    0.82415E+00
 ARIEXC: peak, lower, upper, distance  728    0.20000E+01    0.54000E+01    0.79670E+00
 ARIEXC: peak, lower, upper, distance  730    0.17000E+01    0.31000E+01    0.86879E+00
 ARIEXC: peak, lower, upper, distance  731    0.20000E+01    0.52000E+01    0.84203E+00
 ARIEXC: peak, lower, upper, distance  732    0.18000E+01    0.60000E+01    0.75473E+00
 ARIEXC: peak, lower, upper, distance  733    0.17000E+01    0.60000E+01    0.77019E+00
 ARIEXC: peak, lower, upper, distance  736    0.15000E+01    0.25000E+01    0.88051E+00
 ARIEXC: peak, lower, upper, distance  738    0.17000E+01    0.31000E+01    0.88270E+00
 ARIEXC: peak, lower, upper, distance  740    0.20000E+01    0.60000E+01    0.77833E+00
 ARIEXC: peak, lower, upper, distance  741    0.20000E+01    0.60000E+01    0.79139E+00
 ARIEXC: peak, lower, upper, distance  743    0.20000E+01    0.56000E+01    0.83154E+00
 ARIEXC: peak, lower, upper, distance  744    0.18000E+01    0.34000E+01    0.87138E+00
 ARIEXC: peak, lower, upper, distance  745    0.16000E+01    0.30000E+01    0.83473E+00
 ARIEXC: peak, lower, upper, distance  748    0.17000E+01    0.35000E+01    0.87800E+00
 ARIEXC: peak, lower, upper, distance  749    0.20000E+01    0.60000E+01    0.83734E+00
 ARIEXC: peak, lower, upper, distance  750    0.18000E+01    0.40000E+01    0.86216E+00
 ARIEXC: peak, lower, upper, distance  752    0.19000E+01    0.39000E+01    0.79847E+00
 ARIEXC: peak, lower, upper, distance  753    0.17000E+01    0.60000E+01    0.77860E+00
 ARIEXC: peak, lower, upper, distance  754    0.19000E+01    0.60000E+01    0.79308E+00
 ARIEXC: peak, lower, upper, distance  758    0.18000E+01    0.38000E+01    0.83354E+00
 ARIEXC: peak, lower, upper, distance  759    0.20000E+01    0.60000E+01    0.79812E+00
 ARIEXC: peak, lower, upper, distance  760    0.19000E+01    0.60000E+01    0.82329E+00
 ARIEXC: peak, lower, upper, distance  761    0.19000E+01    0.43000E+01    0.88950E+00
 ARIEXC: peak, lower, upper, distance  765    0.19000E+01    0.41000E+01    0.79812E+00
 ARIEXC: peak, lower, upper, distance  768    0.19000E+01    0.51000E+01    0.79635E+00
 ARIEXC: peak, lower, upper, distance  769    0.19000E+01    0.60000E+01    0.79268E+00
 ARIEXC: peak, lower, upper, distance  770    0.20000E+01    0.58000E+01    0.82259E+00
 ARIEXC: peak, lower, upper, distance  771    0.16000E+01    0.28000E+01    0.86901E+00
 ARIEXC: peak, lower, upper, distance  772    0.15000E+01    0.27000E+01    0.84896E+00
 ARIEXC: peak, lower, upper, distance  773    0.16000E+01    0.26000E+01    0.87019E+00
 ARIEXC: peak, lower, upper, distance  774    0.19000E+01    0.45000E+01    0.83370E+00
 ARIEXC: peak, lower, upper, distance  775    0.20000E+01    0.46000E+01    0.80973E+00
 ARIEXC: peak, lower, upper, distance  776    0.18000E+01    0.60000E+01    0.77506E+00
 ARIEXC: peak, lower, upper, distance  781    0.16000E+01    0.30000E+01    0.87721E+00
 ARIEXC: peak, lower, upper, distance  783    0.19000E+01    0.41000E+01    0.91743E+00
 ARIEXC: peak, lower, upper, distance  784    0.20000E+01    0.60000E+01    0.80759E+00
 ARIEXC: peak, lower, upper, distance  788    0.18000E+01    0.38000E+01    0.86287E+00
 ARIEXC: peak, lower, upper, distance  789    0.19000E+01    0.43000E+01    0.86124E+00
 ARIEXC: peak, lower, upper, distance  792    0.17000E+01    0.31000E+01    0.83164E+00
 ARIEXC: peak, lower, upper, distance  793    0.19000E+01    0.60000E+01    0.83998E+00
 ARIEXC: peak, lower, upper, distance  794    0.18000E+01    0.60000E+01    0.79374E+00
 ARIEXC: peak, lower, upper, distance  795    0.18000E+01    0.36000E+01    0.86269E+00
 ARIEXC: peak, lower, upper, distance  798    0.13000E+01    0.22000E+01    0.87233E+00
 ARIEXC: peak, lower, upper, distance  802    0.20000E+01    0.60000E+01    0.79588E+00
 ARIEXC: peak, lower, upper, distance  803    0.16000E+01    0.60000E+01    0.74700E+00
 ARIEXC: peak, lower, upper, distance  804    0.15000E+01    0.60000E+01    0.76839E+00
 ARIEXC: peak, lower, upper, distance  805    0.19000E+01    0.41000E+01    0.84809E+00
 ARIEXC: peak, lower, upper, distance  807    0.20000E+01    0.58000E+01    0.82973E+00
 ARIEXC: peak, lower, upper, distance  813    0.19000E+01    0.37000E+01    0.85734E+00
 ARIEXC: peak, lower, upper, distance  814    0.20000E+01    0.60000E+01    0.82647E+00
 ARIEXC: peak, lower, upper, distance  817    0.17000E+01    0.31000E+01    0.85545E+00
 ARIEXC: peak, lower, upper, distance  821    0.15000E+01    0.60000E+01    0.82156E+00
 ARIEXC: peak, lower, upper, distance  826    0.16000E+01    0.28000E+01    0.85547E+00
 ARIEXC: peak, lower, upper, distance  827    0.19000E+01    0.41000E+01    0.83242E+00
 ARIEXC: peak, lower, upper, distance  831    0.19000E+01    0.49000E+01    0.81755E+00
 ARIEXC: peak, lower, upper, distance  832    0.19000E+01    0.39000E+01    0.79917E+00
 ARIEXC: peak, lower, upper, distance  835    0.16000E+01    0.60000E+01    0.79025E+00
 ARIEXC: peak, lower, upper, distance  839    0.20000E+01    0.60000E+01    0.78049E+00
 ARIEXC: peak, lower, upper, distance  845    0.19000E+01    0.60000E+01    0.78304E+00
 ARIEXC: peak, lower, upper, distance  851    0.19000E+01    0.60000E+01    0.76205E+00
 ARIEXC: peak, lower, upper, distance  852    0.18000E+01    0.60000E+01    0.79125E+00
 ARIEXC: peak, lower, upper, distance  853    0.10000E+01    0.60000E+01    0.74387E+00
 ARIEXC: peak, lower, upper, distance  858    0.19000E+01    0.39000E+01    0.79324E+00
 ARIEXC: peak, lower, upper, distance  860    0.20000E+01    0.52000E+01    0.75908E+00
 ARIEXC: peak, lower, upper, distance  861    0.20000E+01    0.54000E+01    0.73805E+00
 ARIEXC: peak, lower, upper, distance  862    0.17000E+01    0.31000E+01    0.85538E+00
 ARIEXC: peak, lower, upper, distance  863    0.18000E+01    0.38000E+01    0.83242E+00
 ARIEXC: peak, lower, upper, distance  865    0.19000E+01    0.60000E+01    0.76185E+00
 ARIEXC: peak, lower, upper, distance  868    0.18000E+01    0.60000E+01    0.78907E+00
 ARIEXC: peak, lower, upper, distance  869    0.20000E+01    0.60000E+01    0.84722E+00
 ARIEXC: peak, lower, upper, distance  872    0.12000E+01    0.22000E+01    0.90861E+00
 ARIEXC: peak, lower, upper, distance  875    0.19000E+01    0.51000E+01    0.87241E+00
 ARIEXC: peak, lower, upper, distance  876    0.19000E+01    0.43000E+01    0.84047E+00
 ARIEXC: peak, lower, upper, distance  877    0.19000E+01    0.60000E+01    0.79695E+00
 ARIEXC: peak, lower, upper, distance  886    0.19000E+01    0.60000E+01    0.85590E+00
 ARIEXC: peak, lower, upper, distance    1    0.19000E+01    0.43000E+01    0.80195E+00
 ARIEXC: peak, lower, upper, distance    1    0.17000E+01    0.29000E+01    0.91743E+00
 ARIEXC: peak, lower, upper, distance    2    0.17000E+01    0.29000E+01    0.85302E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.43000E+01    0.85381E+00
 ARIEXC: peak, lower, upper, distance    5    0.16000E+01    0.28000E+01    0.88030E+00
 ARIEXC: peak, lower, upper, distance    6    0.17000E+01    0.60000E+01    0.75619E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.60000E+01    0.80093E+00
 ARIEXC: peak, lower, upper, distance    8    0.17000E+01    0.60000E+01    0.77359E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.50000E+01    0.80946E+00
 ARIEXC: peak, lower, upper, distance   10    0.20000E+01    0.60000E+01    0.82156E+00
 ARIEXC: peak, lower, upper, distance   11    0.19000E+01    0.60000E+01    0.79125E+00
 ARIEXC: peak, lower, upper, distance   13    0.19000E+01    0.45000E+01    0.87972E+00
 ARIEXC: peak, lower, upper, distance   14    0.20000E+01    0.60000E+01    0.86488E+00
 ARIEXC: peak, lower, upper, distance   15    0.20000E+01    0.56000E+01    0.83554E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.60000E+01    0.77960E+00
 ARIEXC: peak, lower, upper, distance   17    0.20000E+01    0.48000E+01    0.85307E+00
 ARIEXC: peak, lower, upper, distance   18    0.19000E+01    0.39000E+01    0.83796E+00
 ARIEXC: peak, lower, upper, distance   19    0.20000E+01    0.58000E+01    0.80863E+00
 ARIEXC: peak, lower, upper, distance   20    0.20000E+01    0.50000E+01    0.82717E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.47000E+01    0.81437E+00
 ARIEXC: peak, lower, upper, distance   22    0.16000E+01    0.28000E+01    0.87388E+00
 ARIEXC: peak, lower, upper, distance   23    0.19000E+01    0.53000E+01    0.81040E+00
 ARIEXC: peak, lower, upper, distance   25    0.18000E+01    0.60000E+01    0.76878E+00
 ARIEXC: peak, lower, upper, distance   27    0.20000E+01    0.60000E+01    0.83261E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.60000E+01    0.80465E+00
 ARIEXC: peak, lower, upper, distance   29    0.20000E+01    0.60000E+01    0.79231E+00
 ARIEXC: peak, lower, upper, distance   30    0.20000E+01    0.60000E+01    0.79453E+00
 ARIEXC: peak, lower, upper, distance   33    0.16000E+01    0.30000E+01    0.88204E+00
 ARIEXC: peak, lower, upper, distance   34    0.20000E+01    0.50000E+01    0.83518E+00
 ARIEXC: peak, lower, upper, distance   35    0.20000E+01    0.60000E+01    0.82120E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.60000E+01    0.77985E+00
 ARIEXC: peak, lower, upper, distance   37    0.20000E+01    0.48000E+01    0.81141E+00
 ARIEXC: peak, lower, upper, distance   38    0.20000E+01    0.58000E+01    0.87415E+00
 ARIEXC: peak, lower, upper, distance   39    0.19000E+01    0.47000E+01    0.82652E+00
 ARIEXC: peak, lower, upper, distance   40    0.20000E+01    0.60000E+01    0.78430E+00
 ARIEXC: peak, lower, upper, distance   41    0.19000E+01    0.60000E+01    0.77814E+00
 ARIEXC: peak, lower, upper, distance   43    0.15000E+01    0.27000E+01    0.86839E+00
 ARIEXC: peak, lower, upper, distance   44    0.18000E+01    0.38000E+01    0.83658E+00
 ARIEXC: peak, lower, upper, distance   45    0.19000E+01    0.60000E+01    0.79240E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.60000E+01    0.76205E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.77691E+00
 ARIEXC: peak, lower, upper, distance   49    0.19000E+01    0.41000E+01    0.84625E+00
 ARIEXC: peak, lower, upper, distance   50    0.15000E+01    0.23000E+01    0.87646E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.50000E+01    0.79326E+00
 ARIEXC: peak, lower, upper, distance   53    0.20000E+01    0.50000E+01    0.81238E+00
 ARIEXC: peak, lower, upper, distance   54    0.20000E+01    0.46000E+01    0.84492E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.60000E+01    0.77947E+00
 ARIEXC: peak, lower, upper, distance   56    0.19000E+01    0.60000E+01    0.78100E+00
 ARIEXC: peak, lower, upper, distance   57    0.18000E+01    0.38000E+01    0.83559E+00
 ARIEXC: peak, lower, upper, distance   58    0.16000E+01    0.28000E+01    0.86739E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.60000E+01    0.80693E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.60000E+01    0.82946E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.48000E+01    0.89230E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.43000E+01    0.83347E+00
 ARIEXC: peak, lower, upper, distance   65    0.12000E+01    0.22000E+01    0.91290E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.60000E+01    0.77413E+00
 ARIEXC: peak, lower, upper, distance   68    0.19000E+01    0.51000E+01    0.81545E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.48000E+01    0.83620E+00
 ARIEXC: peak, lower, upper, distance   71    0.20000E+01    0.58000E+01    0.81205E+00
 ARIEXC: peak, lower, upper, distance   72    0.13000E+01    0.22000E+01    0.91295E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.60000E+01    0.81446E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.43000E+01    0.87137E+00
 ARIEXC: peak, lower, upper, distance   78    0.19000E+01    0.60000E+01    0.77883E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.60000E+01    0.81361E+00
 ARIEXC: peak, lower, upper, distance   80    0.19000E+01    0.60000E+01    0.79941E+00
 ARIEXC: peak, lower, upper, distance   81    0.20000E+01    0.54000E+01    0.79420E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.60000E+01    0.79790E+00
 ARIEXC: peak, lower, upper, distance   83    0.17000E+01    0.31000E+01    0.87405E+00
 ARIEXC: peak, lower, upper, distance   84    0.20000E+01    0.50000E+01    0.83955E+00
 ARIEXC: peak, lower, upper, distance   85    0.20000E+01    0.56000E+01    0.80841E+00
 ARIEXC: peak, lower, upper, distance   87    0.15000E+01    0.25000E+01    0.87894E+00
 ARIEXC: peak, lower, upper, distance   88    0.19000E+01    0.39000E+01    0.83898E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.46000E+01    0.85442E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.40000E+01    0.85376E+00
 ARIEXC: peak, lower, upper, distance   92    0.20000E+01    0.60000E+01    0.82241E+00
 ARIEXC: peak, lower, upper, distance   93    0.20000E+01    0.60000E+01    0.85399E+00
 ARIEXC: peak, lower, upper, distance   94    0.19000E+01    0.45000E+01    0.86378E+00
 ARIEXC: peak, lower, upper, distance   95    0.20000E+01    0.56000E+01    0.84039E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.50000E+01    0.80252E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.56000E+01    0.81536E+00
 ARIEXC: peak, lower, upper, distance   98    0.20000E+01    0.48000E+01    0.86596E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.77922E+00
 ARIEXC: peak, lower, upper, distance  101    0.20000E+01    0.60000E+01    0.80922E+00
 ARIEXC: peak, lower, upper, distance  103    0.18000E+01    0.42000E+01    0.83556E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.56000E+01    0.81833E+00
 ARIEXC: peak, lower, upper, distance  105    0.17000E+01    0.60000E+01    0.78022E+00
 ARIEXC: peak, lower, upper, distance  106    0.20000E+01    0.60000E+01    0.79517E+00
 ARIEXC: peak, lower, upper, distance  107    0.20000E+01    0.60000E+01    0.78907E+00
 ARIEXC: peak, lower, upper, distance  108    0.17000E+01    0.31000E+01    0.85134E+00
 ARIEXC: peak, lower, upper, distance  109    0.18000E+01    0.36000E+01    0.85734E+00
 ARIEXC: peak, lower, upper, distance  110    0.20000E+01    0.48000E+01    0.81755E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.78304E+00
 ARIEXC: peak, lower, upper, distance  113    0.16000E+01    0.28000E+01    0.88841E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.75501E+00
 ARIEXC: peak, lower, upper, distance  115    0.19000E+01    0.47000E+01    0.81214E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.83456E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.85794E+00
 ARIEXC: peak, lower, upper, distance  118    0.19000E+01    0.60000E+01    0.79142E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.43000E+01    0.83542E+00
 ARIEXC: peak, lower, upper, distance  120    0.20000E+01    0.60000E+01    0.79278E+00
 ARIEXC: peak, lower, upper, distance  122    0.16000E+01    0.60000E+01    0.74845E+00
 ARIEXC: peak, lower, upper, distance  123    0.14000E+01    0.24000E+01    0.91289E+00
 ARIEXC: peak, lower, upper, distance  124    0.19000E+01    0.60000E+01    0.78145E+00
 ARIEXC: peak, lower, upper, distance  125    0.20000E+01    0.50000E+01    0.81224E+00
 ARIEXC: peak, lower, upper, distance  126    0.20000E+01    0.52000E+01    0.79197E+00
 ARIEXC: peak, lower, upper, distance  127    0.20000E+01    0.56000E+01    0.78926E+00
 ARIEXC: peak, lower, upper, distance  128    0.17000E+01    0.33000E+01    0.87404E+00
 ARIEXC: peak, lower, upper, distance  130    0.18000E+01    0.40000E+01    0.83994E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.82986E+00
 ARIEXC: peak, lower, upper, distance  132    0.20000E+01    0.50000E+01    0.81474E+00
 ARIEXC: peak, lower, upper, distance  133    0.17000E+01    0.35000E+01    0.87457E+00
 ARIEXC: peak, lower, upper, distance  134    0.19000E+01    0.51000E+01    0.81070E+00
 ARIEXC: peak, lower, upper, distance  135    0.19000E+01    0.39000E+01    0.85012E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.43000E+01    0.79170E+00
 ARIEXC: peak, lower, upper, distance  137    0.19000E+01    0.41000E+01    0.84425E+00
 ARIEXC: peak, lower, upper, distance  138    0.16000E+01    0.28000E+01    0.87738E+00
 ARIEXC: peak, lower, upper, distance  139    0.18000E+01    0.34000E+01    0.85047E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.60000E+01    0.77679E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.56000E+01    0.79836E+00
 ARIEXC: peak, lower, upper, distance  142    0.19000E+01    0.60000E+01    0.78310E+00
 ARIEXC: peak, lower, upper, distance  143    0.20000E+01    0.60000E+01    0.77773E+00
 ARIEXC: peak, lower, upper, distance  144    0.19000E+01    0.45000E+01    0.79117E+00
 ARIEXC: peak, lower, upper, distance  145    0.19000E+01    0.60000E+01    0.77317E+00
 ARIEXC: peak, lower, upper, distance  146    0.19000E+01    0.41000E+01    0.83803E+00
 ARIEXC: peak, lower, upper, distance  147    0.15000E+01    0.25000E+01    0.88051E+00
 ARIEXC: peak, lower, upper, distance  148    0.18000E+01    0.38000E+01    0.83519E+00
 ARIEXC: peak, lower, upper, distance  149    0.19000E+01    0.60000E+01    0.78221E+00
 ARIEXC: peak, lower, upper, distance  150    0.19000E+01    0.60000E+01    0.80273E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.45000E+01    0.84665E+00
 ARIEXC: peak, lower, upper, distance  152    0.20000E+01    0.60000E+01    0.76215E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.56000E+01    0.78504E+00
 ARIEXC: peak, lower, upper, distance  155    0.19000E+01    0.41000E+01    0.83231E+00
 ARIEXC: peak, lower, upper, distance  156    0.19000E+01    0.41000E+01    0.83592E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.60000E+01    0.76510E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.87406E+00
 ARIEXC: peak, lower, upper, distance  159    0.18000E+01    0.40000E+01    0.80406E+00
 ARIEXC: peak, lower, upper, distance  160    0.19000E+01    0.47000E+01    0.84807E+00
 ARIEXC: peak, lower, upper, distance  161    0.20000E+01    0.48000E+01    0.78773E+00
 ARIEXC: peak, lower, upper, distance  162    0.19000E+01    0.60000E+01    0.74053E+00
 ARIEXC: peak, lower, upper, distance  163    0.19000E+01    0.43000E+01    0.83377E+00
 ARIEXC: peak, lower, upper, distance  166    0.16000E+01    0.28000E+01    0.86568E+00
 ARIEXC: peak, lower, upper, distance  167    0.19000E+01    0.45000E+01    0.83690E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.60000E+01    0.79274E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.56000E+01    0.85777E+00
 ARIEXC: peak, lower, upper, distance  170    0.20000E+01    0.52000E+01    0.81485E+00
 ARIEXC: peak, lower, upper, distance  171    0.20000E+01    0.60000E+01    0.74702E+00
 ARIEXC: peak, lower, upper, distance  172    0.19000E+01    0.45000E+01    0.81315E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.56000E+01    0.77324E+00
 ARIEXC: peak, lower, upper, distance  175    0.20000E+01    0.60000E+01    0.79548E+00
 ARIEXC: peak, lower, upper, distance  176    0.16000E+01    0.26000E+01    0.87424E+00
 ARIEXC: peak, lower, upper, distance  177    0.18000E+01    0.40000E+01    0.83659E+00
 ARIEXC: peak, lower, upper, distance  179    0.18000E+01    0.36000E+01    0.84945E+00
 ARIEXC: peak, lower, upper, distance  180    0.20000E+01    0.60000E+01    0.79552E+00
 ARIEXC: peak, lower, upper, distance  181    0.18000E+01    0.60000E+01    0.76750E+00
 ARIEXC: peak, lower, upper, distance  182    0.18000E+01    0.38000E+01    0.84549E+00
 ARIEXC: peak, lower, upper, distance  183    0.19000E+01    0.39000E+01    0.85175E+00
 ARIEXC: peak, lower, upper, distance  184    0.18000E+01    0.34000E+01    0.86503E+00
 ARIEXC: peak, lower, upper, distance  185    0.20000E+01    0.50000E+01    0.83814E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.54000E+01    0.84956E+00
 ARIEXC: peak, lower, upper, distance  187    0.18000E+01    0.34000E+01    0.84714E+00
 ARIEXC: peak, lower, upper, distance  188    0.19000E+01    0.60000E+01    0.78524E+00
 ARIEXC: peak, lower, upper, distance  189    0.19000E+01    0.60000E+01    0.76905E+00
 ARIEXC: peak, lower, upper, distance  190    0.20000E+01    0.52000E+01    0.80896E+00
 ARIEXC: peak, lower, upper, distance  191    0.19000E+01    0.39000E+01    0.83975E+00
 ARIEXC: peak, lower, upper, distance  192    0.18000E+01    0.40000E+01    0.81049E+00
 ARIEXC: peak, lower, upper, distance  196    0.19000E+01    0.43000E+01    0.84116E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.80893E+00
 ARIEXC: peak, lower, upper, distance  198    0.19000E+01    0.45000E+01    0.85835E+00
 ARIEXC: peak, lower, upper, distance  199    0.19000E+01    0.43000E+01    0.85389E+00
 ARIEXC: peak, lower, upper, distance  200    0.20000E+01    0.54000E+01    0.87247E+00
 ARIEXC: peak, lower, upper, distance  201    0.20000E+01    0.56000E+01    0.80423E+00
 ARIEXC: peak, lower, upper, distance  202    0.19000E+01    0.43000E+01    0.84698E+00
 ARIEXC: peak, lower, upper, distance  203    0.20000E+01    0.56000E+01    0.81228E+00
 ARIEXC: peak, lower, upper, distance  204    0.20000E+01    0.56000E+01    0.79172E+00
 ARIEXC: peak, lower, upper, distance  205    0.16000E+01    0.28000E+01    0.87189E+00
 ARIEXC: peak, lower, upper, distance  206    0.19000E+01    0.60000E+01    0.76332E+00
 ARIEXC: peak, lower, upper, distance  207    0.20000E+01    0.60000E+01    0.79491E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.46000E+01    0.80380E+00
 ARIEXC: peak, lower, upper, distance  209    0.19000E+01    0.47000E+01    0.83922E+00
 ARIEXC: peak, lower, upper, distance  211    0.19000E+01    0.41000E+01    0.83734E+00
 ARIEXC: peak, lower, upper, distance  212    0.18000E+01    0.34000E+01    0.83419E+00
 ARIEXC: peak, lower, upper, distance  213    0.20000E+01    0.60000E+01    0.82275E+00
 ARIEXC: peak, lower, upper, distance  214    0.20000E+01    0.60000E+01    0.86571E+00
 ARIEXC: peak, lower, upper, distance  215    0.20000E+01    0.50000E+01    0.88144E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.60000E+01    0.77791E+00
 ARIEXC: peak, lower, upper, distance  217    0.19000E+01    0.60000E+01    0.77681E+00
 ARIEXC: peak, lower, upper, distance  218    0.20000E+01    0.46000E+01    0.83551E+00
 ARIEXC: peak, lower, upper, distance  219    0.16000E+01    0.30000E+01    0.87800E+00
 ARIEXC: peak, lower, upper, distance  220    0.20000E+01    0.48000E+01    0.80442E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.43000E+01    0.77361E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.47000E+01    0.81776E+00
 ARIEXC: peak, lower, upper, distance  224    0.17000E+01    0.33000E+01    0.87523E+00
 ARIEXC: peak, lower, upper, distance  225    0.19000E+01    0.47000E+01    0.83480E+00
 ARIEXC: peak, lower, upper, distance  226    0.19000E+01    0.60000E+01    0.77756E+00
 ARIEXC: peak, lower, upper, distance  227    0.19000E+01    0.47000E+01    0.82108E+00
 ARIEXC: peak, lower, upper, distance  228    0.20000E+01    0.60000E+01    0.77817E+00
 ARIEXC: peak, lower, upper, distance  230    0.19000E+01    0.41000E+01    0.83843E+00
 ARIEXC: peak, lower, upper, distance  231    0.19000E+01    0.51000E+01    0.87175E+00
 ARIEXC: peak, lower, upper, distance  232    0.20000E+01    0.52000E+01    0.83876E+00
 ARIEXC: peak, lower, upper, distance  233    0.19000E+01    0.60000E+01    0.79458E+00
 ARIEXC: peak, lower, upper, distance  234    0.19000E+01    0.60000E+01    0.84127E+00
 ARIEXC: peak, lower, upper, distance  237    0.17000E+01    0.35000E+01    0.86293E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.77018E+00
 ARIEXC: peak, lower, upper, distance  239    0.18000E+01    0.36000E+01    0.83855E+00
 ARIEXC: peak, lower, upper, distance  240    0.20000E+01    0.50000E+01    0.84383E+00
 ARIEXC: peak, lower, upper, distance  241    0.19000E+01    0.43000E+01    0.79176E+00
 ARIEXC: peak, lower, upper, distance  242    0.17000E+01    0.33000E+01    0.89695E+00
 ARIEXC: peak, lower, upper, distance  243    0.20000E+01    0.60000E+01    0.78754E+00
 ARIEXC: peak, lower, upper, distance  245    0.19000E+01    0.49000E+01    0.88220E+00
 ARIEXC: peak, lower, upper, distance  246    0.17000E+01    0.31000E+01    0.85381E+00
 ARIEXC: peak, lower, upper, distance  247    0.18000E+01    0.60000E+01    0.78859E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.47000E+01    0.83754E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.36000E+01    0.86124E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.79918E+00
 ARIEXC: peak, lower, upper, distance  253    0.15000E+01    0.27000E+01    0.87894E+00
 ARIEXC: peak, lower, upper, distance  255    0.19000E+01    0.45000E+01    0.80173E+00
 ARIEXC: peak, lower, upper, distance  256    0.20000E+01    0.50000E+01    0.79640E+00
 ARIEXC: peak, lower, upper, distance  257    0.18000E+01    0.34000E+01    0.84002E+00
 ARIEXC: peak, lower, upper, distance  258    0.20000E+01    0.58000E+01    0.80005E+00
 ARIEXC: peak, lower, upper, distance  259    0.20000E+01    0.56000E+01    0.83880E+00
 ARIEXC: peak, lower, upper, distance  260    0.19000E+01    0.43000E+01    0.84302E+00
 ARIEXC: peak, lower, upper, distance  262    0.18000E+01    0.38000E+01    0.83874E+00
 ARIEXC: peak, lower, upper, distance  264    0.18000E+01    0.36000E+01    0.83202E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.60000E+01    0.78802E+00
 ARIEXC: peak, lower, upper, distance  266    0.17000E+01    0.60000E+01    0.77666E+00
 ARIEXC: peak, lower, upper, distance    1    0.20000E+01    0.52000E+01    0.84103E+00
 ARIEXC: peak, lower, upper, distance    2    0.16000E+01    0.30000E+01    0.86106E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.60000E+01    0.78531E+00
 ARIEXC: peak, lower, upper, distance    4    0.11000E+01    0.60000E+01    0.74123E+00
 ARIEXC: peak, lower, upper, distance    5    0.20000E+01    0.58000E+01    0.79434E+00
 ARIEXC: peak, lower, upper, distance    6    0.20000E+01    0.60000E+01    0.83854E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.50000E+01    0.80335E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.60000E+01    0.75709E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.56000E+01    0.84135E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.60000E+01    0.74150E+00
 ARIEXC: peak, lower, upper, distance   12    0.19000E+01    0.60000E+01    0.81826E+00
 ARIEXC: peak, lower, upper, distance   13    0.18000E+01    0.36000E+01    0.84278E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.75576E+00
 ARIEXC: peak, lower, upper, distance   16    0.18000E+01    0.60000E+01    0.74845E+00
 ARIEXC: peak, lower, upper, distance   17    0.17000E+01    0.35000E+01    0.85082E+00
 ARIEXC: peak, lower, upper, distance   20    0.19000E+01    0.60000E+01    0.77482E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.60000E+01    0.77583E+00
 ARIEXC: peak, lower, upper, distance   24    0.19000E+01    0.49000E+01    0.81649E+00
 ARIEXC: peak, lower, upper, distance   25    0.14000E+01    0.24000E+01    0.84470E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.84752E+00
 ARIEXC: peak, lower, upper, distance   42    0.20000E+01    0.58000E+01    0.78582E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.60000E+01    0.74081E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.43000E+01    0.79040E+00
 ARIEXC: peak, lower, upper, distance   56    0.20000E+01    0.60000E+01    0.77275E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.58000E+01    0.76578E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.58000E+01    0.76568E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.78661E+00
 ARIEXC: peak, lower, upper, distance   66    0.20000E+01    0.46000E+01    0.80570E+00
 ARIEXC: peak, lower, upper, distance   67    0.20000E+01    0.52000E+01    0.81674E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.33000E+01    0.86056E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.47000E+01    0.81758E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.60000E+01    0.79091E+00
 ARIEXC: peak, lower, upper, distance   71    0.17000E+01    0.33000E+01    0.86316E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.79936E+00
 ARIEXC: peak, lower, upper, distance   73    0.16000E+01    0.26000E+01    0.85669E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.52000E+01    0.84009E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.60000E+01    0.76944E+00
 ARIEXC: peak, lower, upper, distance   77    0.16000E+01    0.28000E+01    0.86175E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.58000E+01    0.80712E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.56000E+01    0.80730E+00
 ARIEXC: peak, lower, upper, distance   80    0.17000E+01    0.33000E+01    0.82248E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.50000E+01    0.80953E+00
 ARIEXC: peak, lower, upper, distance   83    0.19000E+01    0.60000E+01    0.76569E+00
 ARIEXC: peak, lower, upper, distance   84    0.17000E+01    0.35000E+01    0.86193E+00
 ARIEXC: peak, lower, upper, distance   85    0.19000E+01    0.41000E+01    0.78837E+00
 ARIEXC: peak, lower, upper, distance   86    0.20000E+01    0.54000E+01    0.84968E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.54000E+01    0.75466E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.77114E+00
 ARIEXC: peak, lower, upper, distance   91    0.18000E+01    0.40000E+01    0.87301E+00
 ARIEXC: peak, lower, upper, distance   93    0.19000E+01    0.39000E+01    0.85412E+00
 ARIEXC: peak, lower, upper, distance   95    0.19000E+01    0.39000E+01    0.83063E+00
 ARIEXC: peak, lower, upper, distance   96    0.18000E+01    0.60000E+01    0.77637E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.60000E+01    0.76054E+00
 ARIEXC: peak, lower, upper, distance   98    0.17000E+01    0.33000E+01    0.84770E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.79938E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.45000E+01    0.90099E+00
 ARIEXC: peak, lower, upper, distance  102    0.18000E+01    0.38000E+01    0.80973E+00
 ARIEXC: peak, lower, upper, distance  103    0.19000E+01    0.60000E+01    0.76482E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.46000E+01    0.85432E+00
 ARIEXC: peak, lower, upper, distance  105    0.20000E+01    0.60000E+01    0.77083E+00
 ARIEXC: peak, lower, upper, distance  106    0.19000E+01    0.43000E+01    0.85569E+00
 ARIEXC: peak, lower, upper, distance  107    0.18000E+01    0.40000E+01    0.81212E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.74148E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.78629E+00
 ARIEXC: peak, lower, upper, distance  112    0.19000E+01    0.60000E+01    0.82533E+00
 ARIEXC: peak, lower, upper, distance  113    0.20000E+01    0.54000E+01    0.77769E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.78510E+00
 ARIEXC: peak, lower, upper, distance  115    0.18000E+01    0.40000E+01    0.86094E+00
 ARIEXC: peak, lower, upper, distance  116    0.20000E+01    0.50000E+01    0.76447E+00
 ARIEXC: peak, lower, upper, distance  117    0.20000E+01    0.60000E+01    0.80544E+00
 COUNTV:  839 violations above         0.10000
 ARIA>      end 
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_4.float opened.
 ARIA> REVE ((segid "    " and resid 1    and name HA1 ) OR   ( segid "    " and resid 1    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HB1 ) OR   ( segid "    " and resid 3    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HD1 ) OR   ( segid "    " and resid 3    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HB1 ) OR   ( segid "    " and resid 5    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HD1 ) OR   ( segid "    " and resid 5    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HB1 ) OR   ( segid "    " and resid 6    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HB1 ) OR   ( segid "    " and resid 7    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HG1 ) OR   ( segid "    " and resid 7    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HD1 ) OR   ( segid "    " and resid 7    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HG1 ) OR   ( segid "    " and resid 8    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 9    and name HA1 ) OR   ( segid "    " and resid 9    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HG1 ) OR   ( segid "    " and resid 11   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HB1 ) OR   ( segid "    " and resid 12   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HG1 ) OR   ( segid "    " and resid 12   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH11) OR   ( segid "    " and resid 13   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH21) OR   ( segid "    " and resid 13   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 14   and name HB1 ) OR   ( segid "    " and resid 14   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HG1 ) OR   ( segid "    " and resid 19   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HD1 ) OR   ( segid "    " and resid 19   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 24   and name HD21) OR   ( segid "    " and resid 24   and name HD22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HG1 ) OR   ( segid "    " and resid 26   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 27   and name HB1 ) OR   ( segid "    " and resid 27   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HG1 ) OR   ( segid "    " and resid 28   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH11) OR   ( segid "    " and resid 28   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 32   and name HB1 ) OR   ( segid "    " and resid 32   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HB1 ) OR   ( segid "    " and resid 34   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HD1 ) OR   ( segid "    " and resid 34   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($count=$count+1) 
 EVALUATE: symbol $COUNT set to    3.00000     (real)
 CNSsolve>end loop main 
 CNSsolve>while ($count le $Iterations.Assignstruct) loop main 
 NEXTCD: condition evaluated as true
 CNSsolve>   evaluate ($file = $filenames.bestfile_$count) 
 EVALUATE: symbol $FILE set to "PREVIT:ww1_11.pdb" (string)
 CNSsolve>   display $file 
PREVIT:ww1_11.pdb
 CNSsolve>   coor init end 
 COOR: selected main coordinates initialized
 CNSsolve>   if ($file ne "") then 
 NEXTCD: condition evaluated as true
 CNSsolve>      coor @@$file 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_11.pdb opened.
 COOR>REMARK FILENAME="/usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_11.pdb" 
 COOR>REMARK =============================================================== 
 COOR>REMARK            overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK energies: 223.361, 1.88399, 18.3265, 1.76577, 168.826, 26.7313, 0, 4.99336, 0.833779, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK            bonds,angles,impropers,dihe,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK rms-dev.: 1.723829E-03,0.324455,0.182522,40.9366,1.052441E-02,0.494355,0,0,0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK               noe,cdih,coup,sani,dani,vean 
 COOR>REMARK               >0.3,>5,>1,>0,>5 
 COOR>REMARK violations.: 0, 0, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK DATE:02-Mar-2010  14:04:58       created by user: fkieken 
 COOR>REMARK VERSION:1.1 
 COOR>ATOM      1  HA1 GLY     1      15.671 -12.846   3.730  1.00  0.00 
 COOR>ATOM      2  HA2 GLY     1      15.986 -14.404   2.982  1.00  0.00 
 CNSsolve>      eval ($floatfile = $file - ".pdb" + ".float") 
 EVALUATE: symbol $FLOATFILE set to "PREVIT:ww1_11.float" (string)
 CNSsolve>      fileexist $floatfile end  eval ($qfloatfile = $result) 
 MISCOM: file exists
 EVALUATE: symbol $QFLOATFILE set to TRUE (logical)
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_11.float opened.
 ARIA> REVE ((segid "    " and resid 1    and name HA1 ) OR   ( segid "    " and resid 1    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 2    and name HB1 ) OR   ( segid "    " and resid 2    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HG1 ) OR   ( segid "    " and resid 3    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HD1 ) OR   ( segid "    " and resid 3    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 4    and name HB1 ) OR   ( segid "    " and resid 4    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HG1 ) OR   ( segid "    " and resid 5    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HD1 ) OR   ( segid "    " and resid 5    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HB1 ) OR   ( segid "    " and resid 6    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HG1 ) OR   ( segid "    " and resid 11   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HG1 ) OR   ( segid "    " and resid 13   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH21) OR   ( segid "    " and resid 13   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 14   and name HB1 ) OR   ( segid "    " and resid 14   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HG1 ) OR   ( segid "    " and resid 19   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HD1 ) OR   ( segid "    " and resid 19   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HH21) OR   ( segid "    " and resid 19   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 24   and name HD21) OR   ( segid "    " and resid 24   and name HD22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HG1 ) OR   ( segid "    " and resid 26   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH21) OR   ( segid "    " and resid 28   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HD1 ) OR   ( segid "    " and resid 33   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HE1 ) OR   ( segid "    " and resid 33   and name HE2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HB1 ) OR   ( segid "    " and resid 34   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HD1 ) OR   ( segid "    " and resid 34   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH11) OR   ( segid "    " and resid 34   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 35   and name HD1 ) OR   ( segid "    " and resid 35   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 36   and name HB1 ) OR   ( segid "    " and resid 36   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>      aria 
 ARIA>         analyse_restraints aver end 
DISACC: accumulating distance matrix with dimension  269
 AMBVAC: read in   990 distances in mode ACCU
 ARIA>         countvio threshold $Iterations.violtoler end 
 ARIEXC: peak, lower, upper, distance    1    0.18000E+01    0.36000E+01    0.87931E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.48000E+01    0.86603E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.45000E+01    0.83936E+00
 ARIEXC: peak, lower, upper, distance    5    0.19000E+01    0.47000E+01    0.83147E+00
 ARIEXC: peak, lower, upper, distance    6    0.18000E+01    0.36000E+01    0.85910E+00
 ARIEXC: peak, lower, upper, distance    7    0.19000E+01    0.53000E+01    0.81450E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.43000E+01    0.82904E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.54000E+01    0.75665E+00
 ARIEXC: peak, lower, upper, distance   13    0.20000E+01    0.58000E+01    0.83953E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.86728E+00
 ARIEXC: peak, lower, upper, distance   15    0.18000E+01    0.36000E+01    0.85593E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.45000E+01    0.86647E+00
 ARIEXC: peak, lower, upper, distance   17    0.19000E+01    0.60000E+01    0.84162E+00
 ARIEXC: peak, lower, upper, distance   21    0.13000E+01    0.22000E+01    0.91022E+00
 ARIEXC: peak, lower, upper, distance   23    0.13000E+01    0.60000E+01    0.84913E+00
 ARIEXC: peak, lower, upper, distance   24    0.20000E+01    0.60000E+01    0.80322E+00
 ARIEXC: peak, lower, upper, distance   26    0.15000E+01    0.27000E+01    0.87640E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.43000E+01    0.83201E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.85457E+00
 ARIEXC: peak, lower, upper, distance   30    0.18000E+01    0.38000E+01    0.80650E+00
 ARIEXC: peak, lower, upper, distance   31    0.18000E+01    0.36000E+01    0.86873E+00
 ARIEXC: peak, lower, upper, distance   33    0.18000E+01    0.60000E+01    0.75844E+00
 ARIEXC: peak, lower, upper, distance   34    0.19000E+01    0.49000E+01    0.80877E+00
 ARIEXC: peak, lower, upper, distance   35    0.19000E+01    0.60000E+01    0.78819E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.41000E+01    0.84412E+00
 ARIEXC: peak, lower, upper, distance   43    0.13000E+01    0.22000E+01    0.91040E+00
 ARIEXC: peak, lower, upper, distance   44    0.16000E+01    0.30000E+01    0.86761E+00
 ARIEXC: peak, lower, upper, distance   45    0.17000E+01    0.33000E+01    0.83254E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.43000E+01    0.79483E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.74899E+00
 ARIEXC: peak, lower, upper, distance   52    0.18000E+01    0.34000E+01    0.83200E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.41000E+01    0.83569E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.46000E+01    0.80200E+00
 ARIEXC: peak, lower, upper, distance   57    0.19000E+01    0.51000E+01    0.75965E+00
 ARIEXC: peak, lower, upper, distance   59    0.17000E+01    0.31000E+01    0.83193E+00
 ARIEXC: peak, lower, upper, distance   60    0.18000E+01    0.40000E+01    0.80637E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.86326E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.60000E+01    0.75167E+00
 ARIEXC: peak, lower, upper, distance   63    0.20000E+01    0.58000E+01    0.77285E+00
 ARIEXC: peak, lower, upper, distance   64    0.19000E+01    0.53000E+01    0.83617E+00
 ARIEXC: peak, lower, upper, distance   65    0.16000E+01    0.28000E+01    0.82804E+00
 ARIEXC: peak, lower, upper, distance   66    0.16000E+01    0.28000E+01    0.89186E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.41000E+01    0.86781E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.31000E+01    0.85592E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.60000E+01    0.78204E+00
 ARIEXC: peak, lower, upper, distance   71    0.19000E+01    0.45000E+01    0.83031E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.80697E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.41000E+01    0.84387E+00
 ARIEXC: peak, lower, upper, distance   76    0.20000E+01    0.52000E+01    0.83961E+00
 ARIEXC: peak, lower, upper, distance   77    0.13000E+01    0.22000E+01    0.91081E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.48000E+01    0.84761E+00
 ARIEXC: peak, lower, upper, distance   82    0.19000E+01    0.60000E+01    0.80784E+00
 ARIEXC: peak, lower, upper, distance   86    0.19000E+01    0.60000E+01    0.76777E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.79708E+00
 ARIEXC: peak, lower, upper, distance   91    0.19000E+01    0.60000E+01    0.83454E+00
 ARIEXC: peak, lower, upper, distance   93    0.16000E+01    0.26000E+01    0.86883E+00
 ARIEXC: peak, lower, upper, distance   95    0.11000E+01    0.60000E+01    0.76337E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.60000E+01    0.79109E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.41000E+01    0.85776E+00
 ARIEXC: peak, lower, upper, distance  100    0.20000E+01    0.56000E+01    0.80468E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.41000E+01    0.87425E+00
 ARIEXC: peak, lower, upper, distance  102    0.15000E+01    0.25000E+01    0.86858E+00
 ARIEXC: peak, lower, upper, distance  103    0.20000E+01    0.60000E+01    0.79810E+00
 ARIEXC: peak, lower, upper, distance  104    0.18000E+01    0.42000E+01    0.86934E+00
 ARIEXC: peak, lower, upper, distance  105    0.19000E+01    0.53000E+01    0.80161E+00
 ARIEXC: peak, lower, upper, distance  108    0.18000E+01    0.36000E+01    0.86135E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.82056E+00
 ARIEXC: peak, lower, upper, distance  110    0.17000E+01    0.29000E+01    0.85483E+00
 ARIEXC: peak, lower, upper, distance  112    0.20000E+01    0.60000E+01    0.80014E+00
 ARIEXC: peak, lower, upper, distance  113    0.19000E+01    0.43000E+01    0.85083E+00
 ARIEXC: peak, lower, upper, distance  114    0.20000E+01    0.58000E+01    0.77743E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.85473E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.84908E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.60000E+01    0.74952E+00
 ARIEXC: peak, lower, upper, distance  120    0.17000E+01    0.31000E+01    0.85481E+00
 ARIEXC: peak, lower, upper, distance  121    0.20000E+01    0.60000E+01    0.78212E+00
 ARIEXC: peak, lower, upper, distance  122    0.19000E+01    0.60000E+01    0.83910E+00
 ARIEXC: peak, lower, upper, distance  123    0.20000E+01    0.50000E+01    0.82117E+00
 ARIEXC: peak, lower, upper, distance  124    0.17000E+01    0.33000E+01    0.85564E+00
 ARIEXC: peak, lower, upper, distance  126    0.19000E+01    0.49000E+01    0.84674E+00
 ARIEXC: peak, lower, upper, distance  127    0.19000E+01    0.43000E+01    0.86132E+00
 ARIEXC: peak, lower, upper, distance  128    0.19000E+01    0.51000E+01    0.79693E+00
 ARIEXC: peak, lower, upper, distance  129    0.19000E+01    0.43000E+01    0.78368E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.72620E+00
 ARIEXC: peak, lower, upper, distance  132    0.19000E+01    0.45000E+01    0.80615E+00
 ARIEXC: peak, lower, upper, distance  133    0.19000E+01    0.60000E+01    0.86167E+00
 ARIEXC: peak, lower, upper, distance  134    0.20000E+01    0.48000E+01    0.81724E+00
 ARIEXC: peak, lower, upper, distance  135    0.17000E+01    0.60000E+01    0.78512E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.39000E+01    0.83619E+00
 ARIEXC: peak, lower, upper, distance  137    0.17000E+01    0.31000E+01    0.87233E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.52000E+01    0.82846E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.54000E+01    0.81402E+00
 ARIEXC: peak, lower, upper, distance  143    0.13000E+01    0.22000E+01    0.91035E+00
 ARIEXC: peak, lower, upper, distance  146    0.18000E+01    0.36000E+01    0.83451E+00
 ARIEXC: peak, lower, upper, distance  148    0.14000E+01    0.60000E+01    0.78249E+00
 ARIEXC: peak, lower, upper, distance  149    0.18000E+01    0.38000E+01    0.85789E+00
 ARIEXC: peak, lower, upper, distance  150    0.20000E+01    0.50000E+01    0.81452E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.60000E+01    0.75037E+00
 ARIEXC: peak, lower, upper, distance  153    0.19000E+01    0.60000E+01    0.75611E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.60000E+01    0.77617E+00
 ARIEXC: peak, lower, upper, distance  155    0.15000E+01    0.25000E+01    0.88028E+00
 ARIEXC: peak, lower, upper, distance  156    0.18000E+01    0.36000E+01    0.83789E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.43000E+01    0.83349E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.85012E+00
 ARIEXC: peak, lower, upper, distance  160    0.20000E+01    0.58000E+01    0.80773E+00
 ARIEXC: peak, lower, upper, distance  162    0.17000E+01    0.60000E+01    0.76633E+00
 ARIEXC: peak, lower, upper, distance  164    0.19000E+01    0.60000E+01    0.78215E+00
 ARIEXC: peak, lower, upper, distance  165    0.20000E+01    0.46000E+01    0.81831E+00
 ARIEXC: peak, lower, upper, distance  166    0.20000E+01    0.50000E+01    0.81078E+00
 ARIEXC: peak, lower, upper, distance  167    0.17000E+01    0.33000E+01    0.87510E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.39000E+01    0.84765E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.60000E+01    0.79933E+00
 ARIEXC: peak, lower, upper, distance  170    0.18000E+01    0.60000E+01    0.76706E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.46000E+01    0.77904E+00
 ARIEXC: peak, lower, upper, distance  174    0.20000E+01    0.52000E+01    0.78614E+00
 ARIEXC: peak, lower, upper, distance  175    0.19000E+01    0.43000E+01    0.83563E+00
 ARIEXC: peak, lower, upper, distance  177    0.20000E+01    0.52000E+01    0.83337E+00
 ARIEXC: peak, lower, upper, distance  178    0.20000E+01    0.60000E+01    0.78076E+00
 ARIEXC: peak, lower, upper, distance  180    0.19000E+01    0.45000E+01    0.85422E+00
 ARIEXC: peak, lower, upper, distance  181    0.14000E+01    0.60000E+01    0.80874E+00
 ARIEXC: peak, lower, upper, distance  183    0.20000E+01    0.60000E+01    0.80047E+00
 ARIEXC: peak, lower, upper, distance  184    0.20000E+01    0.48000E+01    0.82375E+00
 ARIEXC: peak, lower, upper, distance  185    0.18000E+01    0.60000E+01    0.80027E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.58000E+01    0.85557E+00
 ARIEXC: peak, lower, upper, distance  188    0.20000E+01    0.60000E+01    0.76031E+00
 ARIEXC: peak, lower, upper, distance  189    0.20000E+01    0.60000E+01    0.84940E+00
 ARIEXC: peak, lower, upper, distance  190    0.19000E+01    0.60000E+01    0.79479E+00
 ARIEXC: peak, lower, upper, distance  191    0.18000E+01    0.60000E+01    0.74922E+00
 ARIEXC: peak, lower, upper, distance  193    0.17000E+01    0.33000E+01    0.83724E+00
 ARIEXC: peak, lower, upper, distance  194    0.19000E+01    0.60000E+01    0.79242E+00
 ARIEXC: peak, lower, upper, distance  195    0.17000E+01    0.60000E+01    0.81066E+00
 ARIEXC: peak, lower, upper, distance  196    0.17000E+01    0.31000E+01    0.83157E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.77103E+00
 ARIEXC: peak, lower, upper, distance  198    0.18000E+01    0.36000E+01    0.84431E+00
 ARIEXC: peak, lower, upper, distance  199    0.15000E+01    0.23000E+01    0.87882E+00
 ARIEXC: peak, lower, upper, distance  200    0.17000E+01    0.31000E+01    0.85816E+00
 ARIEXC: peak, lower, upper, distance  201    0.19000E+01    0.60000E+01    0.78682E+00
 ARIEXC: peak, lower, upper, distance  203    0.19000E+01    0.41000E+01    0.87060E+00
 ARIEXC: peak, lower, upper, distance  205    0.20000E+01    0.52000E+01    0.79229E+00
 ARIEXC: peak, lower, upper, distance  206    0.20000E+01    0.56000E+01    0.75498E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.60000E+01    0.77699E+00
 ARIEXC: peak, lower, upper, distance  209    0.18000E+01    0.40000E+01    0.83503E+00
 ARIEXC: peak, lower, upper, distance  212    0.19000E+01    0.41000E+01    0.85460E+00
 ARIEXC: peak, lower, upper, distance  213    0.17000E+01    0.33000E+01    0.83179E+00
 ARIEXC: peak, lower, upper, distance  214    0.18000E+01    0.40000E+01    0.83606E+00
 ARIEXC: peak, lower, upper, distance  215    0.19000E+01    0.43000E+01    0.83338E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.47000E+01    0.88096E+00
 ARIEXC: peak, lower, upper, distance  217    0.15000E+01    0.60000E+01    0.75730E+00
 ARIEXC: peak, lower, upper, distance  219    0.17000E+01    0.31000E+01    0.86018E+00
 ARIEXC: peak, lower, upper, distance  220    0.18000E+01    0.36000E+01    0.83148E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.49000E+01    0.82281E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.51000E+01    0.79776E+00
 ARIEXC: peak, lower, upper, distance  223    0.19000E+01    0.49000E+01    0.80525E+00
 ARIEXC: peak, lower, upper, distance  224    0.20000E+01    0.58000E+01    0.84240E+00
 ARIEXC: peak, lower, upper, distance  226    0.20000E+01    0.52000E+01    0.79310E+00
 ARIEXC: peak, lower, upper, distance  227    0.20000E+01    0.60000E+01    0.76209E+00
 ARIEXC: peak, lower, upper, distance  230    0.20000E+01    0.56000E+01    0.86264E+00
 ARIEXC: peak, lower, upper, distance  231    0.20000E+01    0.56000E+01    0.82993E+00
 ARIEXC: peak, lower, upper, distance  232    0.13000E+01    0.22000E+01    0.91038E+00
 ARIEXC: peak, lower, upper, distance  236    0.20000E+01    0.56000E+01    0.77828E+00
 ARIEXC: peak, lower, upper, distance  237    0.19000E+01    0.60000E+01    0.76500E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.80721E+00
 ARIEXC: peak, lower, upper, distance  239    0.19000E+01    0.60000E+01    0.88786E+00
 ARIEXC: peak, lower, upper, distance  241    0.17000E+01    0.60000E+01    0.80437E+00
 ARIEXC: peak, lower, upper, distance  242    0.20000E+01    0.60000E+01    0.80118E+00
 ARIEXC: peak, lower, upper, distance  243    0.19000E+01    0.51000E+01    0.82977E+00
 ARIEXC: peak, lower, upper, distance  244    0.18000E+01    0.34000E+01    0.85998E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.41000E+01    0.76432E+00
 ARIEXC: peak, lower, upper, distance  249    0.19000E+01    0.39000E+01    0.80986E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.38000E+01    0.85974E+00
 ARIEXC: peak, lower, upper, distance  251    0.18000E+01    0.38000E+01    0.86461E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.88768E+00
 ARIEXC: peak, lower, upper, distance  253    0.19000E+01    0.60000E+01    0.80752E+00
 ARIEXC: peak, lower, upper, distance  258    0.17000E+01    0.33000E+01    0.86294E+00
 ARIEXC: peak, lower, upper, distance  259    0.17000E+01    0.31000E+01    0.83196E+00
 ARIEXC: peak, lower, upper, distance  260    0.20000E+01    0.60000E+01    0.78796E+00
 ARIEXC: peak, lower, upper, distance  261    0.20000E+01    0.60000E+01    0.75250E+00
 ARIEXC: peak, lower, upper, distance  262    0.19000E+01    0.45000E+01    0.80208E+00
 ARIEXC: peak, lower, upper, distance  263    0.20000E+01    0.52000E+01    0.80572E+00
 ARIEXC: peak, lower, upper, distance  264    0.15000E+01    0.25000E+01    0.87343E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.43000E+01    0.84786E+00
 ARIEXC: peak, lower, upper, distance  266    0.19000E+01    0.43000E+01    0.83544E+00
 ARIEXC: peak, lower, upper, distance  269    0.20000E+01    0.52000E+01    0.78625E+00
 ARIEXC: peak, lower, upper, distance  270    0.16000E+01    0.30000E+01    0.85574E+00
 ARIEXC: peak, lower, upper, distance  271    0.20000E+01    0.60000E+01    0.80983E+00
 ARIEXC: peak, lower, upper, distance  272    0.19000E+01    0.43000E+01    0.80590E+00
 ARIEXC: peak, lower, upper, distance  273    0.20000E+01    0.60000E+01    0.79978E+00
 ARIEXC: peak, lower, upper, distance  274    0.19000E+01    0.60000E+01    0.84120E+00
 ARIEXC: peak, lower, upper, distance  275    0.19000E+01    0.47000E+01    0.80462E+00
 ARIEXC: peak, lower, upper, distance  276    0.20000E+01    0.56000E+01    0.82443E+00
 ARIEXC: peak, lower, upper, distance  277    0.18000E+01    0.36000E+01    0.86706E+00
 ARIEXC: peak, lower, upper, distance  279    0.20000E+01    0.54000E+01    0.75464E+00
 ARIEXC: peak, lower, upper, distance  280    0.20000E+01    0.60000E+01    0.78651E+00
 ARIEXC: peak, lower, upper, distance  282    0.18000E+01    0.60000E+01    0.80824E+00
 ARIEXC: peak, lower, upper, distance  283    0.20000E+01    0.60000E+01    0.89387E+00
 ARIEXC: peak, lower, upper, distance  284    0.17000E+01    0.60000E+01    0.81179E+00
 ARIEXC: peak, lower, upper, distance  288    0.19000E+01    0.47000E+01    0.83657E+00
 ARIEXC: peak, lower, upper, distance  289    0.19000E+01    0.51000E+01    0.86143E+00
 ARIEXC: peak, lower, upper, distance  291    0.17000E+01    0.31000E+01    0.85908E+00
 ARIEXC: peak, lower, upper, distance  292    0.17000E+01    0.35000E+01    0.83157E+00
 ARIEXC: peak, lower, upper, distance  293    0.17000E+01    0.60000E+01    0.78158E+00
 ARIEXC: peak, lower, upper, distance  294    0.17000E+01    0.60000E+01    0.74592E+00
 ARIEXC: peak, lower, upper, distance  296    0.19000E+01    0.49000E+01    0.84642E+00
 ARIEXC: peak, lower, upper, distance  297    0.18000E+01    0.40000E+01    0.85507E+00
 ARIEXC: peak, lower, upper, distance  298    0.19000E+01    0.60000E+01    0.81726E+00
 ARIEXC: peak, lower, upper, distance  299    0.20000E+01    0.60000E+01    0.80374E+00
 ARIEXC: peak, lower, upper, distance  300    0.19000E+01    0.60000E+01    0.79719E+00
 ARIEXC: peak, lower, upper, distance  307    0.13000E+01    0.22000E+01    0.91032E+00
 ARIEXC: peak, lower, upper, distance  310    0.20000E+01    0.60000E+01    0.74190E+00
 ARIEXC: peak, lower, upper, distance  311    0.18000E+01    0.60000E+01    0.75598E+00
 ARIEXC: peak, lower, upper, distance  312    0.20000E+01    0.60000E+01    0.79912E+00
 ARIEXC: peak, lower, upper, distance  313    0.20000E+01    0.60000E+01    0.86296E+00
 ARIEXC: peak, lower, upper, distance  314    0.19000E+01    0.60000E+01    0.74164E+00
 ARIEXC: peak, lower, upper, distance  316    0.16000E+01    0.28000E+01    0.85540E+00
 ARIEXC: peak, lower, upper, distance  318    0.19000E+01    0.43000E+01    0.83535E+00
 ARIEXC: peak, lower, upper, distance  319    0.20000E+01    0.60000E+01    0.81137E+00
 ARIEXC: peak, lower, upper, distance  320    0.19000E+01    0.60000E+01    0.74700E+00
 ARIEXC: peak, lower, upper, distance  322    0.15000E+01    0.27000E+01    0.86182E+00
 ARIEXC: peak, lower, upper, distance  324    0.20000E+01    0.48000E+01    0.85806E+00
 ARIEXC: peak, lower, upper, distance  325    0.19000E+01    0.60000E+01    0.79943E+00
 ARIEXC: peak, lower, upper, distance  326    0.20000E+01    0.56000E+01    0.80322E+00
 ARIEXC: peak, lower, upper, distance  327    0.17000E+01    0.33000E+01    0.85318E+00
 ARIEXC: peak, lower, upper, distance  328    0.20000E+01    0.56000E+01    0.84570E+00
 ARIEXC: peak, lower, upper, distance  329    0.20000E+01    0.60000E+01    0.83178E+00
 ARIEXC: peak, lower, upper, distance  331    0.20000E+01    0.58000E+01    0.83133E+00
 ARIEXC: peak, lower, upper, distance  332    0.20000E+01    0.60000E+01    0.86158E+00
 ARIEXC: peak, lower, upper, distance  333    0.19000E+01    0.43000E+01    0.84538E+00
 ARIEXC: peak, lower, upper, distance  337    0.19000E+01    0.55000E+01    0.80255E+00
 ARIEXC: peak, lower, upper, distance  340    0.20000E+01    0.60000E+01    0.84188E+00
 ARIEXC: peak, lower, upper, distance  344    0.20000E+01    0.60000E+01    0.73011E+00
 ARIEXC: peak, lower, upper, distance  345    0.17000E+01    0.31000E+01    0.87541E+00
 ARIEXC: peak, lower, upper, distance  346    0.20000E+01    0.54000E+01    0.81152E+00
 ARIEXC: peak, lower, upper, distance  347    0.18000E+01    0.42000E+01    0.81300E+00
 ARIEXC: peak, lower, upper, distance  348    0.16000E+01    0.60000E+01    0.75492E+00
 ARIEXC: peak, lower, upper, distance  351    0.17000E+01    0.29000E+01    0.85495E+00
 ARIEXC: peak, lower, upper, distance  352    0.20000E+01    0.60000E+01    0.77392E+00
 ARIEXC: peak, lower, upper, distance  353    0.18000E+01    0.36000E+01    0.83291E+00
 ARIEXC: peak, lower, upper, distance  354    0.19000E+01    0.60000E+01    0.78803E+00
 ARIEXC: peak, lower, upper, distance  355    0.20000E+01    0.54000E+01    0.88239E+00
 ARIEXC: peak, lower, upper, distance  356    0.20000E+01    0.60000E+01    0.82003E+00
 ARIEXC: peak, lower, upper, distance  357    0.20000E+01    0.60000E+01    0.78955E+00
 ARIEXC: peak, lower, upper, distance  360    0.18000E+01    0.34000E+01    0.84647E+00
 ARIEXC: peak, lower, upper, distance  363    0.20000E+01    0.50000E+01    0.86713E+00
 ARIEXC: peak, lower, upper, distance  365    0.19000E+01    0.60000E+01    0.75324E+00
 ARIEXC: peak, lower, upper, distance  367    0.16000E+01    0.30000E+01    0.87303E+00
 ARIEXC: peak, lower, upper, distance  368    0.18000E+01    0.38000E+01    0.83625E+00
 ARIEXC: peak, lower, upper, distance  369    0.20000E+01    0.60000E+01    0.78474E+00
 ARIEXC: peak, lower, upper, distance  370    0.20000E+01    0.56000E+01    0.78226E+00
 ARIEXC: peak, lower, upper, distance  372    0.18000E+01    0.34000E+01    0.86148E+00
 ARIEXC: peak, lower, upper, distance  373    0.17000E+01    0.33000E+01    0.83165E+00
 ARIEXC: peak, lower, upper, distance  377    0.20000E+01    0.60000E+01    0.79475E+00
 ARIEXC: peak, lower, upper, distance  378    0.18000E+01    0.60000E+01    0.79382E+00
 ARIEXC: peak, lower, upper, distance  379    0.20000E+01    0.52000E+01    0.79832E+00
 ARIEXC: peak, lower, upper, distance  380    0.17000E+01    0.60000E+01    0.75832E+00
 ARIEXC: peak, lower, upper, distance  381    0.20000E+01    0.54000E+01    0.84044E+00
 ARIEXC: peak, lower, upper, distance  382    0.18000E+01    0.38000E+01    0.80510E+00
 ARIEXC: peak, lower, upper, distance  383    0.20000E+01    0.48000E+01    0.85616E+00
 ARIEXC: peak, lower, upper, distance  384    0.17000E+01    0.33000E+01    0.85680E+00
 ARIEXC: peak, lower, upper, distance  385    0.18000E+01    0.34000E+01    0.89238E+00
 ARIEXC: peak, lower, upper, distance  387    0.16000E+01    0.26000E+01    0.84080E+00
 ARIEXC: peak, lower, upper, distance  390    0.19000E+01    0.60000E+01    0.74805E+00
 ARIEXC: peak, lower, upper, distance  391    0.20000E+01    0.60000E+01    0.74091E+00
 ARIEXC: peak, lower, upper, distance  394    0.17000E+01    0.60000E+01    0.75151E+00
 ARIEXC: peak, lower, upper, distance  395    0.19000E+01    0.60000E+01    0.75174E+00
 ARIEXC: peak, lower, upper, distance  396    0.17000E+01    0.60000E+01    0.79224E+00
 ARIEXC: peak, lower, upper, distance  397    0.19000E+01    0.43000E+01    0.83529E+00
 ARIEXC: peak, lower, upper, distance  399    0.13000E+01    0.60000E+01    0.77391E+00
 ARIEXC: peak, lower, upper, distance  400    0.19000E+01    0.49000E+01    0.79265E+00
 ARIEXC: peak, lower, upper, distance  401    0.18000E+01    0.36000E+01    0.86865E+00
 ARIEXC: peak, lower, upper, distance  402    0.17000E+01    0.33000E+01    0.86671E+00
 ARIEXC: peak, lower, upper, distance  403    0.19000E+01    0.53000E+01    0.84025E+00
 ARIEXC: peak, lower, upper, distance  404    0.18000E+01    0.38000E+01    0.83366E+00
 ARIEXC: peak, lower, upper, distance  405    0.18000E+01    0.60000E+01    0.79991E+00
 ARIEXC: peak, lower, upper, distance  406    0.16000E+01    0.60000E+01    0.74606E+00
 ARIEXC: peak, lower, upper, distance  407    0.19000E+01    0.43000E+01    0.81889E+00
 ARIEXC: peak, lower, upper, distance  408    0.18000E+01    0.60000E+01    0.79740E+00
 ARIEXC: peak, lower, upper, distance  411    0.19000E+01    0.60000E+01    0.77531E+00
 ARIEXC: peak, lower, upper, distance  414    0.19000E+01    0.41000E+01    0.86811E+00
 ARIEXC: peak, lower, upper, distance  416    0.16000E+01    0.60000E+01    0.78236E+00
 ARIEXC: peak, lower, upper, distance  417    0.19000E+01    0.43000E+01    0.86441E+00
 ARIEXC: peak, lower, upper, distance  418    0.20000E+01    0.60000E+01    0.77003E+00
 ARIEXC: peak, lower, upper, distance  422    0.20000E+01    0.60000E+01    0.79973E+00
 ARIEXC: peak, lower, upper, distance  423    0.18000E+01    0.60000E+01    0.73297E+00
 ARIEXC: peak, lower, upper, distance  427    0.20000E+01    0.60000E+01    0.86335E+00
 ARIEXC: peak, lower, upper, distance  428    0.17000E+01    0.31000E+01    0.85542E+00
 ARIEXC: peak, lower, upper, distance  429    0.20000E+01    0.60000E+01    0.76800E+00
 ARIEXC: peak, lower, upper, distance  431    0.20000E+01    0.60000E+01    0.77627E+00
 ARIEXC: peak, lower, upper, distance  432    0.20000E+01    0.50000E+01    0.84638E+00
 ARIEXC: peak, lower, upper, distance  442    0.19000E+01    0.60000E+01    0.77049E+00
 ARIEXC: peak, lower, upper, distance  444    0.18000E+01    0.36000E+01    0.85516E+00
 ARIEXC: peak, lower, upper, distance  446    0.20000E+01    0.60000E+01    0.81227E+00
 ARIEXC: peak, lower, upper, distance  447    0.18000E+01    0.36000E+01    0.83543E+00
 ARIEXC: peak, lower, upper, distance  448    0.20000E+01    0.60000E+01    0.76754E+00
 ARIEXC: peak, lower, upper, distance  449    0.16000E+01    0.60000E+01    0.74153E+00
 ARIEXC: peak, lower, upper, distance  450    0.17000E+01    0.33000E+01    0.85475E+00
 ARIEXC: peak, lower, upper, distance  452    0.19000E+01    0.41000E+01    0.85583E+00
 ARIEXC: peak, lower, upper, distance  453    0.20000E+01    0.60000E+01    0.78384E+00
 ARIEXC: peak, lower, upper, distance  454    0.18000E+01    0.40000E+01    0.83177E+00
 ARIEXC: peak, lower, upper, distance  455    0.19000E+01    0.39000E+01    0.84324E+00
 ARIEXC: peak, lower, upper, distance  457    0.20000E+01    0.60000E+01    0.80283E+00
 ARIEXC: peak, lower, upper, distance  458    0.20000E+01    0.54000E+01    0.80211E+00
 ARIEXC: peak, lower, upper, distance  459    0.16000E+01    0.60000E+01    0.81163E+00
 ARIEXC: peak, lower, upper, distance  460    0.20000E+01    0.56000E+01    0.84813E+00
 ARIEXC: peak, lower, upper, distance  462    0.20000E+01    0.60000E+01    0.78373E+00
 ARIEXC: peak, lower, upper, distance  464    0.13000E+01    0.22000E+01    0.91001E+00
 ARIEXC: peak, lower, upper, distance  465    0.19000E+01    0.60000E+01    0.73466E+00
 ARIEXC: peak, lower, upper, distance  466    0.20000E+01    0.54000E+01    0.81100E+00
 ARIEXC: peak, lower, upper, distance  467    0.20000E+01    0.60000E+01    0.76273E+00
 ARIEXC: peak, lower, upper, distance  468    0.17000E+01    0.60000E+01    0.79254E+00
 ARIEXC: peak, lower, upper, distance  469    0.16000E+01    0.30000E+01    0.85848E+00
 ARIEXC: peak, lower, upper, distance  470    0.19000E+01    0.60000E+01    0.74144E+00
 ARIEXC: peak, lower, upper, distance  471    0.20000E+01    0.60000E+01    0.75344E+00
 ARIEXC: peak, lower, upper, distance  472    0.20000E+01    0.50000E+01    0.77629E+00
 ARIEXC: peak, lower, upper, distance  473    0.20000E+01    0.56000E+01    0.84367E+00
 ARIEXC: peak, lower, upper, distance  474    0.20000E+01    0.60000E+01    0.79573E+00
 ARIEXC: peak, lower, upper, distance  477    0.19000E+01    0.43000E+01    0.83954E+00
 ARIEXC: peak, lower, upper, distance  478    0.20000E+01    0.60000E+01    0.78735E+00
 ARIEXC: peak, lower, upper, distance  479    0.19000E+01    0.60000E+01    0.78219E+00
 ARIEXC: peak, lower, upper, distance  480    0.18000E+01    0.34000E+01    0.85977E+00
 ARIEXC: peak, lower, upper, distance  481    0.18000E+01    0.38000E+01    0.83053E+00
 ARIEXC: peak, lower, upper, distance  482    0.20000E+01    0.60000E+01    0.74675E+00
 ARIEXC: peak, lower, upper, distance  483    0.17000E+01    0.33000E+01    0.85530E+00
 ARIEXC: peak, lower, upper, distance  484    0.20000E+01    0.60000E+01    0.87535E+00
 ARIEXC: peak, lower, upper, distance  487    0.19000E+01    0.60000E+01    0.76328E+00
 ARIEXC: peak, lower, upper, distance  488    0.18000E+01    0.60000E+01    0.77890E+00
 ARIEXC: peak, lower, upper, distance  489    0.18000E+01    0.60000E+01    0.77959E+00
 ARIEXC: peak, lower, upper, distance  490    0.20000E+01    0.54000E+01    0.85432E+00
 ARIEXC: peak, lower, upper, distance  492    0.19000E+01    0.41000E+01    0.83830E+00
 ARIEXC: peak, lower, upper, distance  493    0.17000E+01    0.31000E+01    0.86230E+00
 ARIEXC: peak, lower, upper, distance  494    0.18000E+01    0.38000E+01    0.83157E+00
 ARIEXC: peak, lower, upper, distance  495    0.19000E+01    0.51000E+01    0.78565E+00
 ARIEXC: peak, lower, upper, distance  496    0.20000E+01    0.60000E+01    0.78646E+00
 ARIEXC: peak, lower, upper, distance  497    0.17000E+01    0.31000E+01    0.87172E+00
 ARIEXC: peak, lower, upper, distance  498    0.19000E+01    0.45000E+01    0.83630E+00
 ARIEXC: peak, lower, upper, distance  499    0.20000E+01    0.60000E+01    0.88883E+00
 ARIEXC: peak, lower, upper, distance  501    0.17000E+01    0.31000E+01    0.85839E+00
 ARIEXC: peak, lower, upper, distance  502    0.18000E+01    0.40000E+01    0.80221E+00
 ARIEXC: peak, lower, upper, distance  503    0.19000E+01    0.53000E+01    0.78728E+00
 ARIEXC: peak, lower, upper, distance  504    0.20000E+01    0.60000E+01    0.80433E+00
 ARIEXC: peak, lower, upper, distance  505    0.20000E+01    0.52000E+01    0.83601E+00
 ARIEXC: peak, lower, upper, distance  507    0.18000E+01    0.40000E+01    0.83177E+00
 ARIEXC: peak, lower, upper, distance  509    0.18000E+01    0.36000E+01    0.85954E+00
 ARIEXC: peak, lower, upper, distance  511    0.20000E+01    0.60000E+01    0.78320E+00
 ARIEXC: peak, lower, upper, distance  519    0.19000E+01    0.39000E+01    0.86220E+00
 ARIEXC: peak, lower, upper, distance  520    0.17000E+01    0.33000E+01    0.83204E+00
 ARIEXC: peak, lower, upper, distance  521    0.17000E+01    0.31000E+01    0.83196E+00
 ARIEXC: peak, lower, upper, distance  526    0.20000E+01    0.60000E+01    0.79027E+00
 ARIEXC: peak, lower, upper, distance  529    0.20000E+01    0.56000E+01    0.80183E+00
 ARIEXC: peak, lower, upper, distance  531    0.20000E+01    0.52000E+01    0.85552E+00
 ARIEXC: peak, lower, upper, distance  532    0.20000E+01    0.60000E+01    0.75836E+00
 ARIEXC: peak, lower, upper, distance  534    0.20000E+01    0.60000E+01    0.73025E+00
 ARIEXC: peak, lower, upper, distance  535    0.18000E+01    0.60000E+01    0.78132E+00
 ARIEXC: peak, lower, upper, distance  541    0.17000E+01    0.31000E+01    0.86155E+00
 ARIEXC: peak, lower, upper, distance  542    0.20000E+01    0.46000E+01    0.83509E+00
 ARIEXC: peak, lower, upper, distance  543    0.20000E+01    0.56000E+01    0.80133E+00
 ARIEXC: peak, lower, upper, distance  548    0.18000E+01    0.36000E+01    0.83979E+00
 ARIEXC: peak, lower, upper, distance  549    0.20000E+01    0.60000E+01    0.77533E+00
 ARIEXC: peak, lower, upper, distance  550    0.20000E+01    0.60000E+01    0.78087E+00
 ARIEXC: peak, lower, upper, distance  551    0.20000E+01    0.54000E+01    0.82123E+00
 ARIEXC: peak, lower, upper, distance  558    0.19000E+01    0.47000E+01    0.83948E+00
 ARIEXC: peak, lower, upper, distance  559    0.19000E+01    0.41000E+01    0.87841E+00
 ARIEXC: peak, lower, upper, distance  560    0.16000E+01    0.60000E+01    0.78644E+00
 ARIEXC: peak, lower, upper, distance  561    0.11000E+01    0.60000E+01    0.76390E+00
 ARIEXC: peak, lower, upper, distance  562    0.17000E+01    0.31000E+01    0.85600E+00
 ARIEXC: peak, lower, upper, distance  563    0.18000E+01    0.36000E+01    0.83160E+00
 ARIEXC: peak, lower, upper, distance  566    0.19000E+01    0.60000E+01    0.77552E+00
 ARIEXC: peak, lower, upper, distance  567    0.16000E+01    0.60000E+01    0.76893E+00
 ARIEXC: peak, lower, upper, distance  568    0.20000E+01    0.58000E+01    0.81372E+00
 ARIEXC: peak, lower, upper, distance  569    0.20000E+01    0.58000E+01    0.83004E+00
 ARIEXC: peak, lower, upper, distance  570    0.20000E+01    0.56000E+01    0.84092E+00
 ARIEXC: peak, lower, upper, distance  571    0.19000E+01    0.60000E+01    0.78495E+00
 ARIEXC: peak, lower, upper, distance  572    0.16000E+01    0.60000E+01    0.76490E+00
 ARIEXC: peak, lower, upper, distance  573    0.20000E+01    0.60000E+01    0.81984E+00
 ARIEXC: peak, lower, upper, distance  574    0.17000E+01    0.33000E+01    0.88184E+00
 ARIEXC: peak, lower, upper, distance  575    0.18000E+01    0.34000E+01    0.87345E+00
 ARIEXC: peak, lower, upper, distance  576    0.20000E+01    0.52000E+01    0.81246E+00
 ARIEXC: peak, lower, upper, distance  577    0.19000E+01    0.57000E+01    0.79902E+00
 ARIEXC: peak, lower, upper, distance  578    0.20000E+01    0.56000E+01    0.81194E+00
 ARIEXC: peak, lower, upper, distance  579    0.19000E+01    0.60000E+01    0.79174E+00
 ARIEXC: peak, lower, upper, distance  580    0.20000E+01    0.60000E+01    0.78335E+00
 ARIEXC: peak, lower, upper, distance  581    0.19000E+01    0.60000E+01    0.79843E+00
 ARIEXC: peak, lower, upper, distance  582    0.18000E+01    0.60000E+01    0.78242E+00
 ARIEXC: peak, lower, upper, distance  583    0.16000E+01    0.60000E+01    0.74161E+00
 ARIEXC: peak, lower, upper, distance  584    0.20000E+01    0.60000E+01    0.79590E+00
 ARIEXC: peak, lower, upper, distance  586    0.20000E+01    0.58000E+01    0.80954E+00
 ARIEXC: peak, lower, upper, distance  587    0.20000E+01    0.50000E+01    0.76337E+00
 ARIEXC: peak, lower, upper, distance  588    0.18000E+01    0.38000E+01    0.83144E+00
 ARIEXC: peak, lower, upper, distance  589    0.18000E+01    0.40000E+01    0.86214E+00
 ARIEXC: peak, lower, upper, distance  590    0.20000E+01    0.56000E+01    0.75715E+00
 ARIEXC: peak, lower, upper, distance  591    0.15000E+01    0.60000E+01    0.85164E+00
 ARIEXC: peak, lower, upper, distance  592    0.20000E+01    0.60000E+01    0.80790E+00
 ARIEXC: peak, lower, upper, distance  593    0.20000E+01    0.60000E+01    0.83369E+00
 ARIEXC: peak, lower, upper, distance  594    0.20000E+01    0.52000E+01    0.78665E+00
 ARIEXC: peak, lower, upper, distance  595    0.19000E+01    0.53000E+01    0.86452E+00
 ARIEXC: peak, lower, upper, distance  596    0.20000E+01    0.54000E+01    0.85604E+00
 ARIEXC: peak, lower, upper, distance  597    0.19000E+01    0.47000E+01    0.80799E+00
 ARIEXC: peak, lower, upper, distance  598    0.19000E+01    0.43000E+01    0.80878E+00
 ARIEXC: peak, lower, upper, distance  599    0.13000E+01    0.22000E+01    0.91018E+00
 ARIEXC: peak, lower, upper, distance  601    0.19000E+01    0.60000E+01    0.78462E+00
 ARIEXC: peak, lower, upper, distance  603    0.18000E+01    0.36000E+01    0.85630E+00
 ARIEXC: peak, lower, upper, distance  604    0.19000E+01    0.39000E+01    0.84024E+00
 ARIEXC: peak, lower, upper, distance  605    0.20000E+01    0.60000E+01    0.75813E+00
 ARIEXC: peak, lower, upper, distance  607    0.19000E+01    0.41000E+01    0.84945E+00
 ARIEXC: peak, lower, upper, distance  609    0.18000E+01    0.34000E+01    0.85540E+00
 ARIEXC: peak, lower, upper, distance  610    0.18000E+01    0.42000E+01    0.80796E+00
 ARIEXC: peak, lower, upper, distance  615    0.19000E+01    0.47000E+01    0.83164E+00
 ARIEXC: peak, lower, upper, distance  616    0.19000E+01    0.47000E+01    0.86210E+00
 ARIEXC: peak, lower, upper, distance  617    0.17000E+01    0.33000E+01    0.83228E+00
 ARIEXC: peak, lower, upper, distance  619    0.20000E+01    0.60000E+01    0.81659E+00
 ARIEXC: peak, lower, upper, distance  620    0.20000E+01    0.60000E+01    0.88449E+00
 ARIEXC: peak, lower, upper, distance  623    0.20000E+01    0.60000E+01    0.82815E+00
 ARIEXC: peak, lower, upper, distance  625    0.20000E+01    0.60000E+01    0.86079E+00
 ARIEXC: peak, lower, upper, distance  626    0.15000E+01    0.25000E+01    0.86391E+00
 ARIEXC: peak, lower, upper, distance  628    0.19000E+01    0.45000E+01    0.86195E+00
 ARIEXC: peak, lower, upper, distance  629    0.18000E+01    0.40000E+01    0.82795E+00
 ARIEXC: peak, lower, upper, distance  630    0.20000E+01    0.60000E+01    0.83607E+00
 ARIEXC: peak, lower, upper, distance  631    0.18000E+01    0.40000E+01    0.81896E+00
 ARIEXC: peak, lower, upper, distance  633    0.19000E+01    0.41000E+01    0.80766E+00
 ARIEXC: peak, lower, upper, distance  635    0.19000E+01    0.43000E+01    0.78777E+00
 ARIEXC: peak, lower, upper, distance  638    0.17000E+01    0.33000E+01    0.90241E+00
 ARIEXC: peak, lower, upper, distance  640    0.20000E+01    0.52000E+01    0.83836E+00
 ARIEXC: peak, lower, upper, distance  641    0.20000E+01    0.60000E+01    0.81896E+00
 ARIEXC: peak, lower, upper, distance  642    0.20000E+01    0.54000E+01    0.79250E+00
 ARIEXC: peak, lower, upper, distance  644    0.20000E+01    0.60000E+01    0.79238E+00
 ARIEXC: peak, lower, upper, distance  645    0.12000E+01    0.22000E+01    0.90971E+00
 ARIEXC: peak, lower, upper, distance  647    0.15000E+01    0.27000E+01    0.86965E+00
 ARIEXC: peak, lower, upper, distance  654    0.18000E+01    0.34000E+01    0.86066E+00
 ARIEXC: peak, lower, upper, distance  657    0.20000E+01    0.60000E+01    0.76138E+00
 ARIEXC: peak, lower, upper, distance  658    0.13000E+01    0.22000E+01    0.90975E+00
 ARIEXC: peak, lower, upper, distance  665    0.15000E+01    0.25000E+01    0.84157E+00
 ARIEXC: peak, lower, upper, distance  666    0.20000E+01    0.56000E+01    0.88014E+00
 ARIEXC: peak, lower, upper, distance  667    0.20000E+01    0.60000E+01    0.81134E+00
 ARIEXC: peak, lower, upper, distance  668    0.18000E+01    0.36000E+01    0.83382E+00
 ARIEXC: peak, lower, upper, distance  669    0.20000E+01    0.54000E+01    0.79613E+00
 ARIEXC: peak, lower, upper, distance  670    0.20000E+01    0.48000E+01    0.83471E+00
 ARIEXC: peak, lower, upper, distance  671    0.19000E+01    0.45000E+01    0.84817E+00
 ARIEXC: peak, lower, upper, distance  672    0.17000E+01    0.33000E+01    0.87404E+00
 ARIEXC: peak, lower, upper, distance  673    0.20000E+01    0.56000E+01    0.79742E+00
 ARIEXC: peak, lower, upper, distance  674    0.18000E+01    0.38000E+01    0.82150E+00
 ARIEXC: peak, lower, upper, distance  676    0.20000E+01    0.58000E+01    0.80771E+00
 ARIEXC: peak, lower, upper, distance  677    0.16000E+01    0.60000E+01    0.74134E+00
 ARIEXC: peak, lower, upper, distance  678    0.12000E+01    0.60000E+01    0.75574E+00
 ARIEXC: peak, lower, upper, distance  679    0.15000E+01    0.25000E+01    0.87007E+00
 ARIEXC: peak, lower, upper, distance  680    0.20000E+01    0.60000E+01    0.79940E+00
 ARIEXC: peak, lower, upper, distance  681    0.19000E+01    0.60000E+01    0.79237E+00
 ARIEXC: peak, lower, upper, distance  684    0.18000E+01    0.42000E+01    0.76932E+00
 ARIEXC: peak, lower, upper, distance  685    0.15000E+01    0.60000E+01    0.79031E+00
 ARIEXC: peak, lower, upper, distance  686    0.20000E+01    0.60000E+01    0.75261E+00
 ARIEXC: peak, lower, upper, distance  687    0.14000E+01    0.60000E+01    0.76151E+00
 ARIEXC: peak, lower, upper, distance  688    0.16000E+01    0.28000E+01    0.87301E+00
 ARIEXC: peak, lower, upper, distance  689    0.13000E+01    0.22000E+01    0.90883E+00
 ARIEXC: peak, lower, upper, distance  690    0.17000E+01    0.29000E+01    0.86671E+00
 ARIEXC: peak, lower, upper, distance  696    0.20000E+01    0.60000E+01    0.76034E+00
 ARIEXC: peak, lower, upper, distance  697    0.19000E+01    0.49000E+01    0.86955E+00
 ARIEXC: peak, lower, upper, distance  698    0.19000E+01    0.39000E+01    0.83317E+00
 ARIEXC: peak, lower, upper, distance  699    0.20000E+01    0.54000E+01    0.79706E+00
 ARIEXC: peak, lower, upper, distance  700    0.19000E+01    0.41000E+01    0.86963E+00
 ARIEXC: peak, lower, upper, distance  701    0.18000E+01    0.38000E+01    0.84757E+00
 ARIEXC: peak, lower, upper, distance  702    0.19000E+01    0.39000E+01    0.79862E+00
 ARIEXC: peak, lower, upper, distance  703    0.19000E+01    0.43000E+01    0.85624E+00
 ARIEXC: peak, lower, upper, distance  704    0.19000E+01    0.60000E+01    0.79706E+00
 ARIEXC: peak, lower, upper, distance  706    0.11000E+01    0.60000E+01    0.78884E+00
 ARIEXC: peak, lower, upper, distance  711    0.19000E+01    0.60000E+01    0.79399E+00
 ARIEXC: peak, lower, upper, distance  712    0.14000E+01    0.24000E+01    0.86839E+00
 ARIEXC: peak, lower, upper, distance  713    0.14000E+01    0.22000E+01    0.90899E+00
 ARIEXC: peak, lower, upper, distance  718    0.19000E+01    0.60000E+01    0.80083E+00
 ARIEXC: peak, lower, upper, distance  719    0.20000E+01    0.60000E+01    0.83370E+00
 ARIEXC: peak, lower, upper, distance  722    0.20000E+01    0.60000E+01    0.74525E+00
 ARIEXC: peak, lower, upper, distance  723    0.17000E+01    0.31000E+01    0.86990E+00
 ARIEXC: peak, lower, upper, distance  725    0.20000E+01    0.60000E+01    0.86434E+00
 ARIEXC: peak, lower, upper, distance  728    0.20000E+01    0.54000E+01    0.81812E+00
 ARIEXC: peak, lower, upper, distance  730    0.17000E+01    0.31000E+01    0.86819E+00
 ARIEXC: peak, lower, upper, distance  731    0.20000E+01    0.52000E+01    0.83618E+00
 ARIEXC: peak, lower, upper, distance  732    0.18000E+01    0.60000E+01    0.75400E+00
 ARIEXC: peak, lower, upper, distance  733    0.17000E+01    0.60000E+01    0.74436E+00
 ARIEXC: peak, lower, upper, distance  736    0.15000E+01    0.25000E+01    0.87991E+00
 ARIEXC: peak, lower, upper, distance  738    0.17000E+01    0.31000E+01    0.88106E+00
 ARIEXC: peak, lower, upper, distance  740    0.20000E+01    0.60000E+01    0.77785E+00
 ARIEXC: peak, lower, upper, distance  741    0.20000E+01    0.60000E+01    0.80023E+00
 ARIEXC: peak, lower, upper, distance  743    0.20000E+01    0.56000E+01    0.83154E+00
 ARIEXC: peak, lower, upper, distance  744    0.18000E+01    0.34000E+01    0.83399E+00
 ARIEXC: peak, lower, upper, distance  745    0.16000E+01    0.30000E+01    0.87083E+00
 ARIEXC: peak, lower, upper, distance  748    0.17000E+01    0.35000E+01    0.87185E+00
 ARIEXC: peak, lower, upper, distance  749    0.20000E+01    0.60000E+01    0.83513E+00
 ARIEXC: peak, lower, upper, distance  750    0.18000E+01    0.40000E+01    0.83154E+00
 ARIEXC: peak, lower, upper, distance  752    0.19000E+01    0.39000E+01    0.83998E+00
 ARIEXC: peak, lower, upper, distance  753    0.17000E+01    0.60000E+01    0.78919E+00
 ARIEXC: peak, lower, upper, distance  754    0.19000E+01    0.60000E+01    0.81270E+00
 ARIEXC: peak, lower, upper, distance  758    0.18000E+01    0.38000E+01    0.83413E+00
 ARIEXC: peak, lower, upper, distance  759    0.20000E+01    0.60000E+01    0.79821E+00
 ARIEXC: peak, lower, upper, distance  760    0.19000E+01    0.60000E+01    0.82083E+00
 ARIEXC: peak, lower, upper, distance  761    0.19000E+01    0.43000E+01    0.88552E+00
 ARIEXC: peak, lower, upper, distance  765    0.19000E+01    0.41000E+01    0.79823E+00
 ARIEXC: peak, lower, upper, distance  768    0.19000E+01    0.51000E+01    0.79655E+00
 ARIEXC: peak, lower, upper, distance  769    0.19000E+01    0.60000E+01    0.79270E+00
 ARIEXC: peak, lower, upper, distance  770    0.20000E+01    0.58000E+01    0.82298E+00
 ARIEXC: peak, lower, upper, distance  771    0.16000E+01    0.28000E+01    0.86892E+00
 ARIEXC: peak, lower, upper, distance  772    0.15000E+01    0.27000E+01    0.84907E+00
 ARIEXC: peak, lower, upper, distance  773    0.16000E+01    0.26000E+01    0.86999E+00
 ARIEXC: peak, lower, upper, distance  774    0.19000E+01    0.45000E+01    0.83357E+00
 ARIEXC: peak, lower, upper, distance  775    0.20000E+01    0.46000E+01    0.82410E+00
 ARIEXC: peak, lower, upper, distance  776    0.18000E+01    0.60000E+01    0.77503E+00
 ARIEXC: peak, lower, upper, distance  781    0.16000E+01    0.30000E+01    0.87008E+00
 ARIEXC: peak, lower, upper, distance  783    0.19000E+01    0.41000E+01    0.90614E+00
 ARIEXC: peak, lower, upper, distance  784    0.20000E+01    0.60000E+01    0.80581E+00
 ARIEXC: peak, lower, upper, distance  788    0.18000E+01    0.38000E+01    0.85908E+00
 ARIEXC: peak, lower, upper, distance  789    0.19000E+01    0.43000E+01    0.81829E+00
 ARIEXC: peak, lower, upper, distance  792    0.17000E+01    0.31000E+01    0.84212E+00
 ARIEXC: peak, lower, upper, distance  793    0.19000E+01    0.60000E+01    0.79038E+00
 ARIEXC: peak, lower, upper, distance  794    0.18000E+01    0.60000E+01    0.83561E+00
 ARIEXC: peak, lower, upper, distance  795    0.18000E+01    0.36000E+01    0.86958E+00
 ARIEXC: peak, lower, upper, distance  798    0.13000E+01    0.22000E+01    0.87114E+00
 ARIEXC: peak, lower, upper, distance  802    0.20000E+01    0.60000E+01    0.79875E+00
 ARIEXC: peak, lower, upper, distance  803    0.16000E+01    0.60000E+01    0.76795E+00
 ARIEXC: peak, lower, upper, distance  804    0.15000E+01    0.60000E+01    0.75572E+00
 ARIEXC: peak, lower, upper, distance  805    0.19000E+01    0.41000E+01    0.81446E+00
 ARIEXC: peak, lower, upper, distance  807    0.20000E+01    0.58000E+01    0.79572E+00
 ARIEXC: peak, lower, upper, distance  813    0.19000E+01    0.37000E+01    0.84584E+00
 ARIEXC: peak, lower, upper, distance  814    0.20000E+01    0.60000E+01    0.82821E+00
 ARIEXC: peak, lower, upper, distance  817    0.17000E+01    0.31000E+01    0.85540E+00
 ARIEXC: peak, lower, upper, distance  821    0.15000E+01    0.60000E+01    0.81739E+00
 ARIEXC: peak, lower, upper, distance  826    0.16000E+01    0.28000E+01    0.85552E+00
 ARIEXC: peak, lower, upper, distance  827    0.19000E+01    0.41000E+01    0.83302E+00
 ARIEXC: peak, lower, upper, distance  831    0.19000E+01    0.49000E+01    0.81001E+00
 ARIEXC: peak, lower, upper, distance  832    0.19000E+01    0.39000E+01    0.79916E+00
 ARIEXC: peak, lower, upper, distance  835    0.16000E+01    0.60000E+01    0.78715E+00
 ARIEXC: peak, lower, upper, distance  839    0.20000E+01    0.60000E+01    0.77539E+00
 ARIEXC: peak, lower, upper, distance  845    0.19000E+01    0.60000E+01    0.77981E+00
 ARIEXC: peak, lower, upper, distance  851    0.19000E+01    0.60000E+01    0.77284E+00
 ARIEXC: peak, lower, upper, distance  852    0.18000E+01    0.60000E+01    0.78767E+00
 ARIEXC: peak, lower, upper, distance  853    0.10000E+01    0.60000E+01    0.75176E+00
 ARIEXC: peak, lower, upper, distance  858    0.19000E+01    0.39000E+01    0.80371E+00
 ARIEXC: peak, lower, upper, distance  860    0.20000E+01    0.52000E+01    0.73653E+00
 ARIEXC: peak, lower, upper, distance  861    0.20000E+01    0.54000E+01    0.76221E+00
 ARIEXC: peak, lower, upper, distance  862    0.17000E+01    0.31000E+01    0.85541E+00
 ARIEXC: peak, lower, upper, distance  863    0.18000E+01    0.38000E+01    0.83279E+00
 ARIEXC: peak, lower, upper, distance  865    0.19000E+01    0.60000E+01    0.76232E+00
 ARIEXC: peak, lower, upper, distance  868    0.18000E+01    0.60000E+01    0.78710E+00
 ARIEXC: peak, lower, upper, distance  869    0.20000E+01    0.60000E+01    0.84721E+00
 ARIEXC: peak, lower, upper, distance  872    0.12000E+01    0.22000E+01    0.90877E+00
 ARIEXC: peak, lower, upper, distance  875    0.19000E+01    0.51000E+01    0.83535E+00
 ARIEXC: peak, lower, upper, distance  876    0.19000E+01    0.43000E+01    0.87194E+00
 ARIEXC: peak, lower, upper, distance  877    0.19000E+01    0.60000E+01    0.82642E+00
 ARIEXC: peak, lower, upper, distance  886    0.19000E+01    0.60000E+01    0.85260E+00
 ARIEXC: peak, lower, upper, distance    1    0.19000E+01    0.43000E+01    0.80027E+00
 ARIEXC: peak, lower, upper, distance    1    0.17000E+01    0.29000E+01    0.90614E+00
 ARIEXC: peak, lower, upper, distance    2    0.17000E+01    0.29000E+01    0.85530E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.43000E+01    0.79776E+00
 ARIEXC: peak, lower, upper, distance    5    0.16000E+01    0.28000E+01    0.87931E+00
 ARIEXC: peak, lower, upper, distance    6    0.17000E+01    0.60000E+01    0.75833E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.60000E+01    0.79912E+00
 ARIEXC: peak, lower, upper, distance    8    0.17000E+01    0.60000E+01    0.77125E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.50000E+01    0.80697E+00
 ARIEXC: peak, lower, upper, distance   10    0.20000E+01    0.60000E+01    0.81739E+00
 ARIEXC: peak, lower, upper, distance   11    0.19000E+01    0.60000E+01    0.78767E+00
 ARIEXC: peak, lower, upper, distance   13    0.19000E+01    0.45000E+01    0.88014E+00
 ARIEXC: peak, lower, upper, distance   14    0.20000E+01    0.60000E+01    0.83602E+00
 ARIEXC: peak, lower, upper, distance   15    0.20000E+01    0.56000E+01    0.86607E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.60000E+01    0.77735E+00
 ARIEXC: peak, lower, upper, distance   17    0.20000E+01    0.48000E+01    0.84953E+00
 ARIEXC: peak, lower, upper, distance   18    0.19000E+01    0.39000E+01    0.83789E+00
 ARIEXC: peak, lower, upper, distance   19    0.20000E+01    0.58000E+01    0.81134E+00
 ARIEXC: peak, lower, upper, distance   20    0.20000E+01    0.50000E+01    0.81402E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.47000E+01    0.82846E+00
 ARIEXC: peak, lower, upper, distance   22    0.16000E+01    0.28000E+01    0.87510E+00
 ARIEXC: peak, lower, upper, distance   23    0.19000E+01    0.53000E+01    0.81078E+00
 ARIEXC: peak, lower, upper, distance   25    0.18000E+01    0.60000E+01    0.77358E+00
 ARIEXC: peak, lower, upper, distance   27    0.20000E+01    0.60000E+01    0.80186E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.60000E+01    0.77368E+00
 ARIEXC: peak, lower, upper, distance   29    0.20000E+01    0.60000E+01    0.81057E+00
 ARIEXC: peak, lower, upper, distance   30    0.20000E+01    0.60000E+01    0.76982E+00
 ARIEXC: peak, lower, upper, distance   33    0.16000E+01    0.30000E+01    0.88028E+00
 ARIEXC: peak, lower, upper, distance   34    0.20000E+01    0.50000E+01    0.83526E+00
 ARIEXC: peak, lower, upper, distance   35    0.20000E+01    0.60000E+01    0.81227E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.60000E+01    0.78215E+00
 ARIEXC: peak, lower, upper, distance   37    0.20000E+01    0.48000E+01    0.81831E+00
 ARIEXC: peak, lower, upper, distance   38    0.20000E+01    0.58000E+01    0.84940E+00
 ARIEXC: peak, lower, upper, distance   39    0.19000E+01    0.47000E+01    0.82375E+00
 ARIEXC: peak, lower, upper, distance   40    0.20000E+01    0.60000E+01    0.78236E+00
 ARIEXC: peak, lower, upper, distance   41    0.19000E+01    0.60000E+01    0.77941E+00
 ARIEXC: peak, lower, upper, distance   43    0.15000E+01    0.27000E+01    0.86786E+00
 ARIEXC: peak, lower, upper, distance   44    0.18000E+01    0.38000E+01    0.83724E+00
 ARIEXC: peak, lower, upper, distance   45    0.19000E+01    0.60000E+01    0.79479E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.60000E+01    0.77284E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.77755E+00
 ARIEXC: peak, lower, upper, distance   49    0.19000E+01    0.41000E+01    0.85848E+00
 ARIEXC: peak, lower, upper, distance   50    0.15000E+01    0.23000E+01    0.87882E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.50000E+01    0.78682E+00
 ARIEXC: peak, lower, upper, distance   53    0.20000E+01    0.50000E+01    0.80255E+00
 ARIEXC: peak, lower, upper, distance   54    0.20000E+01    0.46000E+01    0.84240E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.60000E+01    0.77796E+00
 ARIEXC: peak, lower, upper, distance   56    0.19000E+01    0.60000E+01    0.78044E+00
 ARIEXC: peak, lower, upper, distance   57    0.18000E+01    0.38000E+01    0.83544E+00
 ARIEXC: peak, lower, upper, distance   58    0.16000E+01    0.28000E+01    0.86603E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.60000E+01    0.80752E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.60000E+01    0.80824E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.48000E+01    0.89387E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.43000E+01    0.82443E+00
 ARIEXC: peak, lower, upper, distance   65    0.12000E+01    0.22000E+01    0.91291E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.60000E+01    0.77047E+00
 ARIEXC: peak, lower, upper, distance   68    0.19000E+01    0.51000E+01    0.81799E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.48000E+01    0.81179E+00
 ARIEXC: peak, lower, upper, distance   71    0.20000E+01    0.58000E+01    0.83649E+00
 ARIEXC: peak, lower, upper, distance   72    0.13000E+01    0.22000E+01    0.91282E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.60000E+01    0.79742E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.43000E+01    0.82150E+00
 ARIEXC: peak, lower, upper, distance   78    0.19000E+01    0.60000E+01    0.77882E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.60000E+01    0.78518E+00
 ARIEXC: peak, lower, upper, distance   80    0.19000E+01    0.60000E+01    0.77565E+00
 ARIEXC: peak, lower, upper, distance   81    0.20000E+01    0.54000E+01    0.80323E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.60000E+01    0.79902E+00
 ARIEXC: peak, lower, upper, distance   83    0.17000E+01    0.31000E+01    0.87345E+00
 ARIEXC: peak, lower, upper, distance   84    0.20000E+01    0.50000E+01    0.82146E+00
 ARIEXC: peak, lower, upper, distance   85    0.20000E+01    0.56000E+01    0.81504E+00
 ARIEXC: peak, lower, upper, distance   87    0.15000E+01    0.25000E+01    0.87343E+00
 ARIEXC: peak, lower, upper, distance   88    0.19000E+01    0.39000E+01    0.83657E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.46000E+01    0.84642E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.40000E+01    0.85507E+00
 ARIEXC: peak, lower, upper, distance   92    0.20000E+01    0.60000E+01    0.84120E+00
 ARIEXC: peak, lower, upper, distance   93    0.20000E+01    0.60000E+01    0.85661E+00
 ARIEXC: peak, lower, upper, distance   94    0.19000E+01    0.45000E+01    0.86143E+00
 ARIEXC: peak, lower, upper, distance   95    0.20000E+01    0.56000E+01    0.83910E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.50000E+01    0.80374E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.56000E+01    0.81726E+00
 ARIEXC: peak, lower, upper, distance   98    0.20000E+01    0.48000E+01    0.86296E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.77852E+00
 ARIEXC: peak, lower, upper, distance  101    0.20000E+01    0.60000E+01    0.80755E+00
 ARIEXC: peak, lower, upper, distance  103    0.18000E+01    0.42000E+01    0.83535E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.56000E+01    0.82117E+00
 ARIEXC: peak, lower, upper, distance  105    0.17000E+01    0.60000E+01    0.78249E+00
 ARIEXC: peak, lower, upper, distance  106    0.20000E+01    0.60000E+01    0.79719E+00
 ARIEXC: peak, lower, upper, distance  107    0.20000E+01    0.60000E+01    0.78710E+00
 ARIEXC: peak, lower, upper, distance  108    0.17000E+01    0.31000E+01    0.85318E+00
 ARIEXC: peak, lower, upper, distance  109    0.18000E+01    0.36000E+01    0.84584E+00
 ARIEXC: peak, lower, upper, distance  110    0.20000E+01    0.48000E+01    0.81001E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.77981E+00
 ARIEXC: peak, lower, upper, distance  113    0.16000E+01    0.28000E+01    0.89199E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.75219E+00
 ARIEXC: peak, lower, upper, distance  115    0.19000E+01    0.47000E+01    0.81137E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.83451E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.85789E+00
 ARIEXC: peak, lower, upper, distance  118    0.19000E+01    0.60000E+01    0.78946E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.43000E+01    0.83615E+00
 ARIEXC: peak, lower, upper, distance  120    0.20000E+01    0.60000E+01    0.79500E+00
 ARIEXC: peak, lower, upper, distance  122    0.16000E+01    0.60000E+01    0.74842E+00
 ARIEXC: peak, lower, upper, distance  123    0.14000E+01    0.24000E+01    0.91300E+00
 ARIEXC: peak, lower, upper, distance  124    0.19000E+01    0.60000E+01    0.78810E+00
 ARIEXC: peak, lower, upper, distance  125    0.20000E+01    0.50000E+01    0.80211E+00
 ARIEXC: peak, lower, upper, distance  126    0.20000E+01    0.52000E+01    0.81163E+00
 ARIEXC: peak, lower, upper, distance  127    0.20000E+01    0.56000E+01    0.78900E+00
 ARIEXC: peak, lower, upper, distance  128    0.17000E+01    0.33000E+01    0.87302E+00
 ARIEXC: peak, lower, upper, distance  130    0.18000E+01    0.40000E+01    0.84012E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.82956E+00
 ARIEXC: peak, lower, upper, distance  132    0.20000E+01    0.50000E+01    0.81452E+00
 ARIEXC: peak, lower, upper, distance  133    0.17000E+01    0.35000E+01    0.86873E+00
 ARIEXC: peak, lower, upper, distance  134    0.19000E+01    0.51000E+01    0.80911E+00
 ARIEXC: peak, lower, upper, distance  135    0.19000E+01    0.39000E+01    0.84570E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.43000E+01    0.79483E+00
 ARIEXC: peak, lower, upper, distance  137    0.19000E+01    0.41000E+01    0.84319E+00
 ARIEXC: peak, lower, upper, distance  138    0.16000E+01    0.28000E+01    0.87640E+00
 ARIEXC: peak, lower, upper, distance  139    0.18000E+01    0.34000E+01    0.84908E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.60000E+01    0.77779E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.56000E+01    0.79869E+00
 ARIEXC: peak, lower, upper, distance  142    0.19000E+01    0.60000E+01    0.77906E+00
 ARIEXC: peak, lower, upper, distance  143    0.20000E+01    0.60000E+01    0.77770E+00
 ARIEXC: peak, lower, upper, distance  144    0.19000E+01    0.45000E+01    0.78644E+00
 ARIEXC: peak, lower, upper, distance  145    0.19000E+01    0.60000E+01    0.77404E+00
 ARIEXC: peak, lower, upper, distance  146    0.19000E+01    0.41000E+01    0.84786E+00
 ARIEXC: peak, lower, upper, distance  147    0.15000E+01    0.25000E+01    0.87991E+00
 ARIEXC: peak, lower, upper, distance  148    0.18000E+01    0.38000E+01    0.83501E+00
 ARIEXC: peak, lower, upper, distance  149    0.19000E+01    0.60000E+01    0.78274E+00
 ARIEXC: peak, lower, upper, distance  150    0.19000E+01    0.60000E+01    0.80212E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.45000E+01    0.84462E+00
 ARIEXC: peak, lower, upper, distance  152    0.20000E+01    0.60000E+01    0.76160E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.56000E+01    0.78672E+00
 ARIEXC: peak, lower, upper, distance  155    0.19000E+01    0.41000E+01    0.83011E+00
 ARIEXC: peak, lower, upper, distance  156    0.19000E+01    0.41000E+01    0.83625E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.60000E+01    0.76501E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.87541E+00
 ARIEXC: peak, lower, upper, distance  159    0.18000E+01    0.40000E+01    0.80510E+00
 ARIEXC: peak, lower, upper, distance  160    0.19000E+01    0.47000E+01    0.85616E+00
 ARIEXC: peak, lower, upper, distance  161    0.20000E+01    0.48000E+01    0.78803E+00
 ARIEXC: peak, lower, upper, distance  162    0.19000E+01    0.60000E+01    0.73507E+00
 ARIEXC: peak, lower, upper, distance  163    0.19000E+01    0.43000E+01    0.82919E+00
 ARIEXC: peak, lower, upper, distance  166    0.16000E+01    0.28000E+01    0.87303E+00
 ARIEXC: peak, lower, upper, distance  167    0.19000E+01    0.45000E+01    0.83529E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.60000E+01    0.79242E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.56000E+01    0.84044E+00
 ARIEXC: peak, lower, upper, distance  170    0.20000E+01    0.52000E+01    0.79832E+00
 ARIEXC: peak, lower, upper, distance  171    0.20000E+01    0.60000E+01    0.74848E+00
 ARIEXC: peak, lower, upper, distance  172    0.19000E+01    0.45000E+01    0.81889E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.56000E+01    0.77627E+00
 ARIEXC: peak, lower, upper, distance  175    0.20000E+01    0.60000E+01    0.80870E+00
 ARIEXC: peak, lower, upper, distance  176    0.16000E+01    0.26000E+01    0.87569E+00
 ARIEXC: peak, lower, upper, distance  177    0.18000E+01    0.40000E+01    0.83543E+00
 ARIEXC: peak, lower, upper, distance  179    0.18000E+01    0.36000E+01    0.84324E+00
 ARIEXC: peak, lower, upper, distance  180    0.20000E+01    0.60000E+01    0.79740E+00
 ARIEXC: peak, lower, upper, distance  181    0.18000E+01    0.60000E+01    0.78551E+00
 ARIEXC: peak, lower, upper, distance  182    0.18000E+01    0.38000E+01    0.84638E+00
 ARIEXC: peak, lower, upper, distance  183    0.19000E+01    0.39000E+01    0.84813E+00
 ARIEXC: peak, lower, upper, distance  184    0.18000E+01    0.34000E+01    0.87670E+00
 ARIEXC: peak, lower, upper, distance  185    0.20000E+01    0.50000E+01    0.83827E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.54000E+01    0.80740E+00
 ARIEXC: peak, lower, upper, distance  187    0.18000E+01    0.34000E+01    0.84636E+00
 ARIEXC: peak, lower, upper, distance  188    0.19000E+01    0.60000E+01    0.81644E+00
 ARIEXC: peak, lower, upper, distance  189    0.19000E+01    0.60000E+01    0.79338E+00
 ARIEXC: peak, lower, upper, distance  190    0.20000E+01    0.52000E+01    0.81100E+00
 ARIEXC: peak, lower, upper, distance  191    0.19000E+01    0.39000E+01    0.83954E+00
 ARIEXC: peak, lower, upper, distance  192    0.18000E+01    0.40000E+01    0.84367E+00
 ARIEXC: peak, lower, upper, distance  196    0.19000E+01    0.43000E+01    0.83830E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.80888E+00
 ARIEXC: peak, lower, upper, distance  198    0.19000E+01    0.45000E+01    0.84674E+00
 ARIEXC: peak, lower, upper, distance  199    0.19000E+01    0.43000E+01    0.86132E+00
 ARIEXC: peak, lower, upper, distance  200    0.20000E+01    0.54000E+01    0.87535E+00
 ARIEXC: peak, lower, upper, distance  201    0.20000E+01    0.56000E+01    0.81013E+00
 ARIEXC: peak, lower, upper, distance  202    0.19000E+01    0.43000E+01    0.84581E+00
 ARIEXC: peak, lower, upper, distance  203    0.20000E+01    0.56000E+01    0.81592E+00
 ARIEXC: peak, lower, upper, distance  204    0.20000E+01    0.56000E+01    0.80128E+00
 ARIEXC: peak, lower, upper, distance  205    0.16000E+01    0.28000E+01    0.87172E+00
 ARIEXC: peak, lower, upper, distance  206    0.19000E+01    0.60000E+01    0.81932E+00
 ARIEXC: peak, lower, upper, distance  207    0.20000E+01    0.60000E+01    0.77552E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.46000E+01    0.78320E+00
 ARIEXC: peak, lower, upper, distance  209    0.19000E+01    0.47000E+01    0.82482E+00
 ARIEXC: peak, lower, upper, distance  211    0.19000E+01    0.41000E+01    0.83513E+00
 ARIEXC: peak, lower, upper, distance  212    0.18000E+01    0.34000E+01    0.83630E+00
 ARIEXC: peak, lower, upper, distance  213    0.20000E+01    0.60000E+01    0.80283E+00
 ARIEXC: peak, lower, upper, distance  214    0.20000E+01    0.60000E+01    0.77442E+00
 ARIEXC: peak, lower, upper, distance  215    0.20000E+01    0.50000E+01    0.86824E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.60000E+01    0.77825E+00
 ARIEXC: peak, lower, upper, distance  217    0.19000E+01    0.60000E+01    0.77787E+00
 ARIEXC: peak, lower, upper, distance  218    0.20000E+01    0.46000E+01    0.83509E+00
 ARIEXC: peak, lower, upper, distance  219    0.16000E+01    0.30000E+01    0.87185E+00
 ARIEXC: peak, lower, upper, distance  220    0.20000E+01    0.48000E+01    0.80161E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.43000E+01    0.85552E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.47000E+01    0.82123E+00
 ARIEXC: peak, lower, upper, distance  224    0.17000E+01    0.33000E+01    0.86155E+00
 ARIEXC: peak, lower, upper, distance  225    0.19000E+01    0.47000E+01    0.86934E+00
 ARIEXC: peak, lower, upper, distance  226    0.19000E+01    0.60000E+01    0.77552E+00
 ARIEXC: peak, lower, upper, distance  227    0.19000E+01    0.47000E+01    0.81372E+00
 ARIEXC: peak, lower, upper, distance  228    0.20000E+01    0.60000E+01    0.78087E+00
 ARIEXC: peak, lower, upper, distance  230    0.19000E+01    0.41000E+01    0.84256E+00
 ARIEXC: peak, lower, upper, distance  231    0.19000E+01    0.51000E+01    0.85164E+00
 ARIEXC: peak, lower, upper, distance  232    0.20000E+01    0.52000E+01    0.80790E+00
 ARIEXC: peak, lower, upper, distance  233    0.19000E+01    0.60000E+01    0.79006E+00
 ARIEXC: peak, lower, upper, distance  234    0.19000E+01    0.60000E+01    0.83298E+00
 ARIEXC: peak, lower, upper, distance  237    0.17000E+01    0.35000E+01    0.84303E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.76449E+00
 ARIEXC: peak, lower, upper, distance  239    0.18000E+01    0.36000E+01    0.84024E+00
 ARIEXC: peak, lower, upper, distance  240    0.20000E+01    0.50000E+01    0.86452E+00
 ARIEXC: peak, lower, upper, distance  241    0.19000E+01    0.43000E+01    0.80878E+00
 ARIEXC: peak, lower, upper, distance  242    0.17000E+01    0.33000E+01    0.88184E+00
 ARIEXC: peak, lower, upper, distance  243    0.20000E+01    0.60000E+01    0.78495E+00
 ARIEXC: peak, lower, upper, distance  245    0.19000E+01    0.49000E+01    0.88449E+00
 ARIEXC: peak, lower, upper, distance  246    0.17000E+01    0.31000E+01    0.85630E+00
 ARIEXC: peak, lower, upper, distance  247    0.18000E+01    0.60000E+01    0.80344E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.47000E+01    0.83607E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.36000E+01    0.81829E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.76483E+00
 ARIEXC: peak, lower, upper, distance  253    0.15000E+01    0.27000E+01    0.87404E+00
 ARIEXC: peak, lower, upper, distance  255    0.19000E+01    0.45000E+01    0.83370E+00
 ARIEXC: peak, lower, upper, distance  256    0.20000E+01    0.50000E+01    0.79687E+00
 ARIEXC: peak, lower, upper, distance  257    0.18000E+01    0.34000E+01    0.83953E+00
 ARIEXC: peak, lower, upper, distance  258    0.20000E+01    0.58000E+01    0.80377E+00
 ARIEXC: peak, lower, upper, distance  259    0.20000E+01    0.56000E+01    0.84913E+00
 ARIEXC: peak, lower, upper, distance  260    0.19000E+01    0.43000E+01    0.84162E+00
 ARIEXC: peak, lower, upper, distance  262    0.18000E+01    0.38000E+01    0.83936E+00
 ARIEXC: peak, lower, upper, distance  264    0.18000E+01    0.36000E+01    0.82904E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.60000E+01    0.78799E+00
 ARIEXC: peak, lower, upper, distance  266    0.17000E+01    0.60000E+01    0.77666E+00
 ARIEXC: peak, lower, upper, distance    1    0.20000E+01    0.52000E+01    0.84093E+00
 ARIEXC: peak, lower, upper, distance    2    0.16000E+01    0.30000E+01    0.86086E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.60000E+01    0.78522E+00
 ARIEXC: peak, lower, upper, distance    4    0.11000E+01    0.60000E+01    0.74163E+00
 ARIEXC: peak, lower, upper, distance    5    0.20000E+01    0.58000E+01    0.80092E+00
 ARIEXC: peak, lower, upper, distance    6    0.20000E+01    0.60000E+01    0.75836E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.50000E+01    0.79339E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.60000E+01    0.76924E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.56000E+01    0.84113E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.60000E+01    0.75478E+00
 ARIEXC: peak, lower, upper, distance   12    0.19000E+01    0.60000E+01    0.79254E+00
 ARIEXC: peak, lower, upper, distance   13    0.18000E+01    0.36000E+01    0.83819E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.83509E+00
 ARIEXC: peak, lower, upper, distance   16    0.18000E+01    0.60000E+01    0.78554E+00
 ARIEXC: peak, lower, upper, distance   17    0.17000E+01    0.35000E+01    0.86924E+00
 ARIEXC: peak, lower, upper, distance   20    0.19000E+01    0.60000E+01    0.77262E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.60000E+01    0.75890E+00
 ARIEXC: peak, lower, upper, distance   24    0.19000E+01    0.49000E+01    0.80925E+00
 ARIEXC: peak, lower, upper, distance   25    0.14000E+01    0.24000E+01    0.84472E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.84080E+00
 ARIEXC: peak, lower, upper, distance   42    0.20000E+01    0.58000E+01    0.76960E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.60000E+01    0.81532E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.43000E+01    0.79310E+00
 ARIEXC: peak, lower, upper, distance   56    0.20000E+01    0.60000E+01    0.77083E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.58000E+01    0.76655E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.58000E+01    0.76480E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.78311E+00
 ARIEXC: peak, lower, upper, distance   66    0.20000E+01    0.46000E+01    0.81404E+00
 ARIEXC: peak, lower, upper, distance   67    0.20000E+01    0.52000E+01    0.79813E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.33000E+01    0.86079E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.47000E+01    0.81575E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.60000E+01    0.79117E+00
 ARIEXC: peak, lower, upper, distance   71    0.17000E+01    0.33000E+01    0.85680E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.78860E+00
 ARIEXC: peak, lower, upper, distance   73    0.16000E+01    0.26000E+01    0.85712E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.52000E+01    0.81109E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.60000E+01    0.76288E+00
 ARIEXC: peak, lower, upper, distance   77    0.16000E+01    0.28000E+01    0.86174E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.58000E+01    0.80133E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.56000E+01    0.79265E+00
 ARIEXC: peak, lower, upper, distance   80    0.17000E+01    0.33000E+01    0.83409E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.50000E+01    0.79295E+00
 ARIEXC: peak, lower, upper, distance   83    0.19000E+01    0.60000E+01    0.73025E+00
 ARIEXC: peak, lower, upper, distance   84    0.17000E+01    0.35000E+01    0.86179E+00
 ARIEXC: peak, lower, upper, distance   85    0.19000E+01    0.41000E+01    0.84412E+00
 ARIEXC: peak, lower, upper, distance   86    0.20000E+01    0.54000E+01    0.80877E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.54000E+01    0.77743E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.76749E+00
 ARIEXC: peak, lower, upper, distance   91    0.18000E+01    0.40000E+01    0.84645E+00
 ARIEXC: peak, lower, upper, distance   93    0.19000E+01    0.39000E+01    0.85418E+00
 ARIEXC: peak, lower, upper, distance   95    0.19000E+01    0.39000E+01    0.83184E+00
 ARIEXC: peak, lower, upper, distance   96    0.18000E+01    0.60000E+01    0.74755E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.60000E+01    0.81577E+00
 ARIEXC: peak, lower, upper, distance   98    0.17000E+01    0.33000E+01    0.84765E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.79933E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.45000E+01    0.80891E+00
 ARIEXC: peak, lower, upper, distance  102    0.18000E+01    0.38000E+01    0.82410E+00
 ARIEXC: peak, lower, upper, distance  103    0.19000E+01    0.60000E+01    0.76326E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.46000E+01    0.85428E+00
 ARIEXC: peak, lower, upper, distance  105    0.20000E+01    0.60000E+01    0.82484E+00
 ARIEXC: peak, lower, upper, distance  106    0.19000E+01    0.43000E+01    0.85604E+00
 ARIEXC: peak, lower, upper, distance  107    0.18000E+01    0.40000E+01    0.80799E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.74147E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.78665E+00
 ARIEXC: peak, lower, upper, distance  112    0.19000E+01    0.60000E+01    0.83369E+00
 ARIEXC: peak, lower, upper, distance  113    0.20000E+01    0.54000E+01    0.82994E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.78514E+00
 ARIEXC: peak, lower, upper, distance  115    0.18000E+01    0.40000E+01    0.86093E+00
 ARIEXC: peak, lower, upper, distance  116    0.20000E+01    0.50000E+01    0.78819E+00
 ARIEXC: peak, lower, upper, distance  117    0.20000E+01    0.60000E+01    0.75844E+00
 COUNTV:  839 violations above         0.10000
 ARIA>      end 
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_11.float opened.
 ARIA> REVE ((segid "    " and resid 1    and name HA1 ) OR   ( segid "    " and resid 1    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 2    and name HB1 ) OR   ( segid "    " and resid 2    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HG1 ) OR   ( segid "    " and resid 3    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HD1 ) OR   ( segid "    " and resid 3    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 4    and name HB1 ) OR   ( segid "    " and resid 4    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HG1 ) OR   ( segid "    " and resid 5    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HD1 ) OR   ( segid "    " and resid 5    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HB1 ) OR   ( segid "    " and resid 6    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HG1 ) OR   ( segid "    " and resid 11   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HG1 ) OR   ( segid "    " and resid 13   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH21) OR   ( segid "    " and resid 13   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 14   and name HB1 ) OR   ( segid "    " and resid 14   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HG1 ) OR   ( segid "    " and resid 19   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HD1 ) OR   ( segid "    " and resid 19   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HH21) OR   ( segid "    " and resid 19   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 24   and name HD21) OR   ( segid "    " and resid 24   and name HD22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HG1 ) OR   ( segid "    " and resid 26   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH21) OR   ( segid "    " and resid 28   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HD1 ) OR   ( segid "    " and resid 33   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HE1 ) OR   ( segid "    " and resid 33   and name HE2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HB1 ) OR   ( segid "    " and resid 34   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HD1 ) OR   ( segid "    " and resid 34   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH11) OR   ( segid "    " and resid 34   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 35   and name HD1 ) OR   ( segid "    " and resid 35   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 36   and name HB1 ) OR   ( segid "    " and resid 36   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($count=$count+1) 
 EVALUATE: symbol $COUNT set to    4.00000     (real)
 CNSsolve>end loop main 
 CNSsolve>while ($count le $Iterations.Assignstruct) loop main 
 NEXTCD: condition evaluated as true
 CNSsolve>   evaluate ($file = $filenames.bestfile_$count) 
 EVALUATE: symbol $FILE set to "PREVIT:ww1_1.pdb" (string)
 CNSsolve>   display $file 
PREVIT:ww1_1.pdb
 CNSsolve>   coor init end 
 COOR: selected main coordinates initialized
 CNSsolve>   if ($file ne "") then 
 NEXTCD: condition evaluated as true
 CNSsolve>      coor @@$file 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_1.pdb opened.
 COOR>REMARK FILENAME="/usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_1.pdb" 
 COOR>REMARK =============================================================== 
 COOR>REMARK            overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK energies: 224.675, 1.7402, 18.9619, 1.51941, 168.641, 28.5406, 0, 4.44129, 0.830657, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK            bonds,angles,impropers,dihe,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK rms-dev.: 1.656741E-03,0.330032,0.169311,41.3526,9.938074E-03,0.493429,0,0,0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK               noe,cdih,coup,sani,dani,vean 
 COOR>REMARK               >0.3,>5,>1,>0,>5 
 COOR>REMARK violations.: 0, 0, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK DATE:02-Mar-2010  13:57:53       created by user: fkieken 
 COOR>REMARK VERSION:1.1 
 COOR>ATOM      1  HA1 GLY     1       3.747  11.526  -6.953  1.00  0.00 
 COOR>ATOM      2  HA2 GLY     1       3.474  13.207  -6.521  1.00  0.00 
 CNSsolve>      eval ($floatfile = $file - ".pdb" + ".float") 
 EVALUATE: symbol $FLOATFILE set to "PREVIT:ww1_1.float" (string)
 CNSsolve>      fileexist $floatfile end  eval ($qfloatfile = $result) 
 MISCOM: file exists
 EVALUATE: symbol $QFLOATFILE set to TRUE (logical)
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_1.float opened.
 ARIA> REVE ((segid "    " and resid 1    and name HA1 ) OR   ( segid "    " and resid 1    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 2    and name HB1 ) OR   ( segid "    " and resid 2    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HB1 ) OR   ( segid "    " and resid 3    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HD1 ) OR   ( segid "    " and resid 3    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HD1 ) OR   ( segid "    " and resid 5    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HD11) OR   ( segid "    " and resid 6    and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HB1 ) OR   ( segid "    " and resid 7    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HG1 ) OR   ( segid "    " and resid 7    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HD1 ) OR   ( segid "    " and resid 7    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HG1 ) OR   ( segid "    " and resid 8    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HD1 ) OR   ( segid "    " and resid 8    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HG1 ) OR   ( segid "    " and resid 11   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HB1 ) OR   ( segid "    " and resid 12   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HG1 ) OR   ( segid "    " and resid 12   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH21) OR   ( segid "    " and resid 13   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 16   and name HG11) OR   ( segid "    " and resid 16   and name HG21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HG1 ) OR   ( segid "    " and resid 19   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HD1 ) OR   ( segid "    " and resid 19   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 24   and name HD21) OR   ( segid "    " and resid 24   and name HD22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HG1 ) OR   ( segid "    " and resid 26   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 27   and name HB1 ) OR   ( segid "    " and resid 27   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HB1 ) OR   ( segid "    " and resid 28   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HG1 ) OR   ( segid "    " and resid 28   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HD1 ) OR   ( segid "    " and resid 28   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH11) OR   ( segid "    " and resid 28   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH21) OR   ( segid "    " and resid 28   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 31   and name HG1 ) OR   ( segid "    " and resid 31   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HG1 ) OR   ( segid "    " and resid 33   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HE1 ) OR   ( segid "    " and resid 33   and name HE2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HB1 ) OR   ( segid "    " and resid 34   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 36   and name HB1 ) OR   ( segid "    " and resid 36   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HB1 ) OR   ( segid "    " and resid 38   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>      aria 
 ARIA>         analyse_restraints aver end 
DISACC: accumulating distance matrix with dimension  269
 AMBVAC: read in   990 distances in mode ACCU
 ARIA>         countvio threshold $Iterations.violtoler end 
 ARIEXC: peak, lower, upper, distance    1    0.18000E+01    0.36000E+01    0.86762E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.48000E+01    0.86705E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.45000E+01    0.84059E+00
 ARIEXC: peak, lower, upper, distance    5    0.19000E+01    0.47000E+01    0.83150E+00
 ARIEXC: peak, lower, upper, distance    6    0.18000E+01    0.36000E+01    0.86349E+00
 ARIEXC: peak, lower, upper, distance    7    0.19000E+01    0.53000E+01    0.80868E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.43000E+01    0.82985E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.54000E+01    0.75410E+00
 ARIEXC: peak, lower, upper, distance   13    0.20000E+01    0.58000E+01    0.84019E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.86726E+00
 ARIEXC: peak, lower, upper, distance   15    0.18000E+01    0.36000E+01    0.86630E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.45000E+01    0.83215E+00
 ARIEXC: peak, lower, upper, distance   17    0.19000E+01    0.60000E+01    0.84629E+00
 ARIEXC: peak, lower, upper, distance   21    0.13000E+01    0.22000E+01    0.91034E+00
 ARIEXC: peak, lower, upper, distance   23    0.13000E+01    0.60000E+01    0.89161E+00
 ARIEXC: peak, lower, upper, distance   24    0.20000E+01    0.60000E+01    0.81487E+00
 ARIEXC: peak, lower, upper, distance   26    0.15000E+01    0.27000E+01    0.87595E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.43000E+01    0.83210E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.85448E+00
 ARIEXC: peak, lower, upper, distance   30    0.18000E+01    0.38000E+01    0.80604E+00
 ARIEXC: peak, lower, upper, distance   31    0.18000E+01    0.36000E+01    0.86933E+00
 ARIEXC: peak, lower, upper, distance   33    0.18000E+01    0.60000E+01    0.75422E+00
 ARIEXC: peak, lower, upper, distance   34    0.19000E+01    0.49000E+01    0.80809E+00
 ARIEXC: peak, lower, upper, distance   35    0.19000E+01    0.60000E+01    0.78043E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.41000E+01    0.84165E+00
 ARIEXC: peak, lower, upper, distance   43    0.13000E+01    0.22000E+01    0.91035E+00
 ARIEXC: peak, lower, upper, distance   44    0.16000E+01    0.30000E+01    0.86670E+00
 ARIEXC: peak, lower, upper, distance   45    0.17000E+01    0.33000E+01    0.83240E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.43000E+01    0.79492E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.74838E+00
 ARIEXC: peak, lower, upper, distance   52    0.18000E+01    0.34000E+01    0.83207E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.41000E+01    0.83570E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.46000E+01    0.80298E+00
 ARIEXC: peak, lower, upper, distance   57    0.19000E+01    0.51000E+01    0.75529E+00
 ARIEXC: peak, lower, upper, distance   59    0.17000E+01    0.31000E+01    0.83189E+00
 ARIEXC: peak, lower, upper, distance   60    0.18000E+01    0.40000E+01    0.80534E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.86108E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.60000E+01    0.75011E+00
 ARIEXC: peak, lower, upper, distance   63    0.20000E+01    0.58000E+01    0.76978E+00
 ARIEXC: peak, lower, upper, distance   64    0.19000E+01    0.53000E+01    0.83696E+00
 ARIEXC: peak, lower, upper, distance   65    0.16000E+01    0.28000E+01    0.89281E+00
 ARIEXC: peak, lower, upper, distance   66    0.16000E+01    0.28000E+01    0.84521E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.41000E+01    0.83193E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.31000E+01    0.85765E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.60000E+01    0.86502E+00
 ARIEXC: peak, lower, upper, distance   71    0.19000E+01    0.45000E+01    0.86405E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.80718E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.41000E+01    0.82331E+00
 ARIEXC: peak, lower, upper, distance   76    0.20000E+01    0.52000E+01    0.86565E+00
 ARIEXC: peak, lower, upper, distance   77    0.13000E+01    0.22000E+01    0.91069E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.48000E+01    0.84014E+00
 ARIEXC: peak, lower, upper, distance   82    0.19000E+01    0.60000E+01    0.77936E+00
 ARIEXC: peak, lower, upper, distance   86    0.19000E+01    0.60000E+01    0.78998E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.79475E+00
 ARIEXC: peak, lower, upper, distance   91    0.19000E+01    0.60000E+01    0.79542E+00
 ARIEXC: peak, lower, upper, distance   93    0.16000E+01    0.26000E+01    0.87167E+00
 ARIEXC: peak, lower, upper, distance   95    0.11000E+01    0.60000E+01    0.81691E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.60000E+01    0.80607E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.41000E+01    0.84282E+00
 ARIEXC: peak, lower, upper, distance  100    0.20000E+01    0.56000E+01    0.78467E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.41000E+01    0.81983E+00
 ARIEXC: peak, lower, upper, distance  102    0.15000E+01    0.25000E+01    0.87157E+00
 ARIEXC: peak, lower, upper, distance  103    0.20000E+01    0.60000E+01    0.79513E+00
 ARIEXC: peak, lower, upper, distance  104    0.18000E+01    0.42000E+01    0.86607E+00
 ARIEXC: peak, lower, upper, distance  105    0.19000E+01    0.53000E+01    0.80524E+00
 ARIEXC: peak, lower, upper, distance  108    0.18000E+01    0.36000E+01    0.85592E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.83352E+00
 ARIEXC: peak, lower, upper, distance  110    0.17000E+01    0.29000E+01    0.85486E+00
 ARIEXC: peak, lower, upper, distance  112    0.20000E+01    0.60000E+01    0.80051E+00
 ARIEXC: peak, lower, upper, distance  113    0.19000E+01    0.43000E+01    0.85274E+00
 ARIEXC: peak, lower, upper, distance  114    0.20000E+01    0.58000E+01    0.77828E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.85482E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.84993E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.60000E+01    0.75149E+00
 ARIEXC: peak, lower, upper, distance  120    0.17000E+01    0.31000E+01    0.85479E+00
 ARIEXC: peak, lower, upper, distance  121    0.20000E+01    0.60000E+01    0.78513E+00
 ARIEXC: peak, lower, upper, distance  122    0.19000E+01    0.60000E+01    0.84356E+00
 ARIEXC: peak, lower, upper, distance  123    0.20000E+01    0.50000E+01    0.81337E+00
 ARIEXC: peak, lower, upper, distance  124    0.17000E+01    0.33000E+01    0.83206E+00
 ARIEXC: peak, lower, upper, distance  126    0.19000E+01    0.49000E+01    0.85435E+00
 ARIEXC: peak, lower, upper, distance  127    0.19000E+01    0.43000E+01    0.83733E+00
 ARIEXC: peak, lower, upper, distance  128    0.19000E+01    0.51000E+01    0.78555E+00
 ARIEXC: peak, lower, upper, distance  129    0.19000E+01    0.43000E+01    0.79388E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.75772E+00
 ARIEXC: peak, lower, upper, distance  132    0.19000E+01    0.45000E+01    0.80870E+00
 ARIEXC: peak, lower, upper, distance  133    0.19000E+01    0.60000E+01    0.85856E+00
 ARIEXC: peak, lower, upper, distance  134    0.20000E+01    0.48000E+01    0.82519E+00
 ARIEXC: peak, lower, upper, distance  135    0.17000E+01    0.60000E+01    0.78414E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.39000E+01    0.83577E+00
 ARIEXC: peak, lower, upper, distance  137    0.17000E+01    0.31000E+01    0.87216E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.52000E+01    0.82748E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.54000E+01    0.81466E+00
 ARIEXC: peak, lower, upper, distance  143    0.13000E+01    0.22000E+01    0.91044E+00
 ARIEXC: peak, lower, upper, distance  146    0.18000E+01    0.36000E+01    0.83453E+00
 ARIEXC: peak, lower, upper, distance  148    0.14000E+01    0.60000E+01    0.77175E+00
 ARIEXC: peak, lower, upper, distance  149    0.18000E+01    0.38000E+01    0.85792E+00
 ARIEXC: peak, lower, upper, distance  150    0.20000E+01    0.50000E+01    0.81457E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.60000E+01    0.75005E+00
 ARIEXC: peak, lower, upper, distance  153    0.19000E+01    0.60000E+01    0.75650E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.60000E+01    0.77564E+00
 ARIEXC: peak, lower, upper, distance  155    0.15000E+01    0.25000E+01    0.88068E+00
 ARIEXC: peak, lower, upper, distance  156    0.18000E+01    0.36000E+01    0.83750E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.43000E+01    0.83340E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.84972E+00
 ARIEXC: peak, lower, upper, distance  160    0.20000E+01    0.58000E+01    0.80289E+00
 ARIEXC: peak, lower, upper, distance  162    0.17000E+01    0.60000E+01    0.76460E+00
 ARIEXC: peak, lower, upper, distance  164    0.19000E+01    0.60000E+01    0.77788E+00
 ARIEXC: peak, lower, upper, distance  165    0.20000E+01    0.46000E+01    0.80556E+00
 ARIEXC: peak, lower, upper, distance  166    0.20000E+01    0.50000E+01    0.81092E+00
 ARIEXC: peak, lower, upper, distance  167    0.17000E+01    0.33000E+01    0.87475E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.39000E+01    0.84848E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.60000E+01    0.79971E+00
 ARIEXC: peak, lower, upper, distance  170    0.18000E+01    0.60000E+01    0.76673E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.46000E+01    0.77476E+00
 ARIEXC: peak, lower, upper, distance  174    0.20000E+01    0.52000E+01    0.76708E+00
 ARIEXC: peak, lower, upper, distance  175    0.19000E+01    0.43000E+01    0.81896E+00
 ARIEXC: peak, lower, upper, distance  177    0.20000E+01    0.52000E+01    0.76158E+00
 ARIEXC: peak, lower, upper, distance  178    0.20000E+01    0.60000E+01    0.75729E+00
 ARIEXC: peak, lower, upper, distance  180    0.19000E+01    0.45000E+01    0.85391E+00
 ARIEXC: peak, lower, upper, distance  181    0.14000E+01    0.60000E+01    0.80547E+00
 ARIEXC: peak, lower, upper, distance  183    0.20000E+01    0.60000E+01    0.80323E+00
 ARIEXC: peak, lower, upper, distance  184    0.20000E+01    0.48000E+01    0.82735E+00
 ARIEXC: peak, lower, upper, distance  185    0.18000E+01    0.60000E+01    0.79911E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.58000E+01    0.84774E+00
 ARIEXC: peak, lower, upper, distance  188    0.20000E+01    0.60000E+01    0.76218E+00
 ARIEXC: peak, lower, upper, distance  189    0.20000E+01    0.60000E+01    0.86308E+00
 ARIEXC: peak, lower, upper, distance  190    0.19000E+01    0.60000E+01    0.78926E+00
 ARIEXC: peak, lower, upper, distance  191    0.18000E+01    0.60000E+01    0.79135E+00
 ARIEXC: peak, lower, upper, distance  193    0.17000E+01    0.33000E+01    0.83736E+00
 ARIEXC: peak, lower, upper, distance  194    0.19000E+01    0.60000E+01    0.78939E+00
 ARIEXC: peak, lower, upper, distance  195    0.17000E+01    0.60000E+01    0.81773E+00
 ARIEXC: peak, lower, upper, distance  196    0.17000E+01    0.31000E+01    0.86104E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.77091E+00
 ARIEXC: peak, lower, upper, distance  198    0.18000E+01    0.36000E+01    0.84145E+00
 ARIEXC: peak, lower, upper, distance  199    0.15000E+01    0.23000E+01    0.87647E+00
 ARIEXC: peak, lower, upper, distance  200    0.17000E+01    0.31000E+01    0.84635E+00
 ARIEXC: peak, lower, upper, distance  201    0.19000E+01    0.60000E+01    0.79419E+00
 ARIEXC: peak, lower, upper, distance  203    0.19000E+01    0.41000E+01    0.87059E+00
 ARIEXC: peak, lower, upper, distance  205    0.20000E+01    0.52000E+01    0.79207E+00
 ARIEXC: peak, lower, upper, distance  206    0.20000E+01    0.56000E+01    0.75072E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.60000E+01    0.78093E+00
 ARIEXC: peak, lower, upper, distance  209    0.18000E+01    0.40000E+01    0.84428E+00
 ARIEXC: peak, lower, upper, distance  212    0.19000E+01    0.41000E+01    0.82695E+00
 ARIEXC: peak, lower, upper, distance  213    0.17000E+01    0.33000E+01    0.81622E+00
 ARIEXC: peak, lower, upper, distance  214    0.18000E+01    0.40000E+01    0.83711E+00
 ARIEXC: peak, lower, upper, distance  215    0.19000E+01    0.43000E+01    0.80898E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.47000E+01    0.89437E+00
 ARIEXC: peak, lower, upper, distance  217    0.15000E+01    0.60000E+01    0.76793E+00
 ARIEXC: peak, lower, upper, distance  219    0.17000E+01    0.31000E+01    0.85441E+00
 ARIEXC: peak, lower, upper, distance  220    0.18000E+01    0.36000E+01    0.83211E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.49000E+01    0.79912E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.51000E+01    0.85443E+00
 ARIEXC: peak, lower, upper, distance  223    0.19000E+01    0.49000E+01    0.79857E+00
 ARIEXC: peak, lower, upper, distance  224    0.20000E+01    0.58000E+01    0.84263E+00
 ARIEXC: peak, lower, upper, distance  226    0.20000E+01    0.52000E+01    0.79877E+00
 ARIEXC: peak, lower, upper, distance  227    0.20000E+01    0.60000E+01    0.81561E+00
 ARIEXC: peak, lower, upper, distance  230    0.20000E+01    0.56000E+01    0.80378E+00
 ARIEXC: peak, lower, upper, distance  231    0.20000E+01    0.56000E+01    0.82890E+00
 ARIEXC: peak, lower, upper, distance  232    0.13000E+01    0.22000E+01    0.91013E+00
 ARIEXC: peak, lower, upper, distance  236    0.20000E+01    0.56000E+01    0.80968E+00
 ARIEXC: peak, lower, upper, distance  237    0.19000E+01    0.60000E+01    0.77362E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.77199E+00
 ARIEXC: peak, lower, upper, distance  239    0.19000E+01    0.60000E+01    0.77133E+00
 ARIEXC: peak, lower, upper, distance  241    0.17000E+01    0.60000E+01    0.79032E+00
 ARIEXC: peak, lower, upper, distance  242    0.20000E+01    0.60000E+01    0.80426E+00
 ARIEXC: peak, lower, upper, distance  243    0.19000E+01    0.51000E+01    0.83623E+00
 ARIEXC: peak, lower, upper, distance  244    0.18000E+01    0.34000E+01    0.86173E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.41000E+01    0.82191E+00
 ARIEXC: peak, lower, upper, distance  249    0.19000E+01    0.39000E+01    0.83695E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.38000E+01    0.86128E+00
 ARIEXC: peak, lower, upper, distance  251    0.18000E+01    0.38000E+01    0.86331E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.81082E+00
 ARIEXC: peak, lower, upper, distance  253    0.19000E+01    0.60000E+01    0.76760E+00
 ARIEXC: peak, lower, upper, distance  258    0.17000E+01    0.33000E+01    0.86199E+00
 ARIEXC: peak, lower, upper, distance  259    0.17000E+01    0.31000E+01    0.86177E+00
 ARIEXC: peak, lower, upper, distance  260    0.20000E+01    0.60000E+01    0.77424E+00
 ARIEXC: peak, lower, upper, distance  261    0.20000E+01    0.60000E+01    0.75187E+00
 ARIEXC: peak, lower, upper, distance  262    0.19000E+01    0.45000E+01    0.80288E+00
 ARIEXC: peak, lower, upper, distance  263    0.20000E+01    0.52000E+01    0.78614E+00
 ARIEXC: peak, lower, upper, distance  264    0.15000E+01    0.25000E+01    0.87906E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.43000E+01    0.83781E+00
 ARIEXC: peak, lower, upper, distance  266    0.19000E+01    0.43000E+01    0.83543E+00
 ARIEXC: peak, lower, upper, distance  269    0.20000E+01    0.52000E+01    0.78892E+00
 ARIEXC: peak, lower, upper, distance  270    0.16000E+01    0.30000E+01    0.86224E+00
 ARIEXC: peak, lower, upper, distance  271    0.20000E+01    0.60000E+01    0.80784E+00
 ARIEXC: peak, lower, upper, distance  272    0.19000E+01    0.43000E+01    0.80853E+00
 ARIEXC: peak, lower, upper, distance  273    0.20000E+01    0.60000E+01    0.82476E+00
 ARIEXC: peak, lower, upper, distance  274    0.19000E+01    0.60000E+01    0.78896E+00
 ARIEXC: peak, lower, upper, distance  275    0.19000E+01    0.47000E+01    0.83375E+00
 ARIEXC: peak, lower, upper, distance  276    0.20000E+01    0.56000E+01    0.80354E+00
 ARIEXC: peak, lower, upper, distance  277    0.18000E+01    0.36000E+01    0.86065E+00
 ARIEXC: peak, lower, upper, distance  279    0.20000E+01    0.54000E+01    0.78032E+00
 ARIEXC: peak, lower, upper, distance  280    0.20000E+01    0.60000E+01    0.74314E+00
 ARIEXC: peak, lower, upper, distance  282    0.18000E+01    0.60000E+01    0.82546E+00
 ARIEXC: peak, lower, upper, distance  283    0.20000E+01    0.60000E+01    0.89121E+00
 ARIEXC: peak, lower, upper, distance  284    0.17000E+01    0.60000E+01    0.83729E+00
 ARIEXC: peak, lower, upper, distance  288    0.19000E+01    0.47000E+01    0.83748E+00
 ARIEXC: peak, lower, upper, distance  289    0.19000E+01    0.51000E+01    0.87465E+00
 ARIEXC: peak, lower, upper, distance  291    0.17000E+01    0.31000E+01    0.85635E+00
 ARIEXC: peak, lower, upper, distance  292    0.17000E+01    0.35000E+01    0.83175E+00
 ARIEXC: peak, lower, upper, distance  293    0.17000E+01    0.60000E+01    0.77340E+00
 ARIEXC: peak, lower, upper, distance  294    0.17000E+01    0.60000E+01    0.75138E+00
 ARIEXC: peak, lower, upper, distance  296    0.19000E+01    0.49000E+01    0.85303E+00
 ARIEXC: peak, lower, upper, distance  297    0.18000E+01    0.40000E+01    0.85062E+00
 ARIEXC: peak, lower, upper, distance  298    0.19000E+01    0.60000E+01    0.80239E+00
 ARIEXC: peak, lower, upper, distance  299    0.20000E+01    0.60000E+01    0.79178E+00
 ARIEXC: peak, lower, upper, distance  300    0.19000E+01    0.60000E+01    0.78913E+00
 ARIEXC: peak, lower, upper, distance  307    0.13000E+01    0.22000E+01    0.91024E+00
 ARIEXC: peak, lower, upper, distance  310    0.20000E+01    0.60000E+01    0.72860E+00
 ARIEXC: peak, lower, upper, distance  311    0.18000E+01    0.60000E+01    0.73322E+00
 ARIEXC: peak, lower, upper, distance  312    0.20000E+01    0.60000E+01    0.82192E+00
 ARIEXC: peak, lower, upper, distance  313    0.20000E+01    0.60000E+01    0.86075E+00
 ARIEXC: peak, lower, upper, distance  314    0.19000E+01    0.60000E+01    0.74029E+00
 ARIEXC: peak, lower, upper, distance  316    0.16000E+01    0.28000E+01    0.85535E+00
 ARIEXC: peak, lower, upper, distance  318    0.19000E+01    0.43000E+01    0.83787E+00
 ARIEXC: peak, lower, upper, distance  319    0.20000E+01    0.60000E+01    0.81117E+00
 ARIEXC: peak, lower, upper, distance  320    0.19000E+01    0.60000E+01    0.77941E+00
 ARIEXC: peak, lower, upper, distance  322    0.15000E+01    0.27000E+01    0.86088E+00
 ARIEXC: peak, lower, upper, distance  324    0.20000E+01    0.48000E+01    0.85896E+00
 ARIEXC: peak, lower, upper, distance  325    0.19000E+01    0.60000E+01    0.80296E+00
 ARIEXC: peak, lower, upper, distance  326    0.20000E+01    0.56000E+01    0.80695E+00
 ARIEXC: peak, lower, upper, distance  327    0.17000E+01    0.33000E+01    0.85886E+00
 ARIEXC: peak, lower, upper, distance  328    0.20000E+01    0.56000E+01    0.84660E+00
 ARIEXC: peak, lower, upper, distance  329    0.20000E+01    0.60000E+01    0.83176E+00
 ARIEXC: peak, lower, upper, distance  331    0.20000E+01    0.58000E+01    0.83643E+00
 ARIEXC: peak, lower, upper, distance  332    0.20000E+01    0.60000E+01    0.85236E+00
 ARIEXC: peak, lower, upper, distance  333    0.19000E+01    0.43000E+01    0.84438E+00
 ARIEXC: peak, lower, upper, distance  337    0.19000E+01    0.55000E+01    0.80882E+00
 ARIEXC: peak, lower, upper, distance  340    0.20000E+01    0.60000E+01    0.84035E+00
 ARIEXC: peak, lower, upper, distance  344    0.20000E+01    0.60000E+01    0.72678E+00
 ARIEXC: peak, lower, upper, distance  345    0.17000E+01    0.31000E+01    0.87283E+00
 ARIEXC: peak, lower, upper, distance  346    0.20000E+01    0.54000E+01    0.81234E+00
 ARIEXC: peak, lower, upper, distance  347    0.18000E+01    0.42000E+01    0.82413E+00
 ARIEXC: peak, lower, upper, distance  348    0.16000E+01    0.60000E+01    0.74967E+00
 ARIEXC: peak, lower, upper, distance  351    0.17000E+01    0.29000E+01    0.85500E+00
 ARIEXC: peak, lower, upper, distance  352    0.20000E+01    0.60000E+01    0.77261E+00
 ARIEXC: peak, lower, upper, distance  353    0.18000E+01    0.36000E+01    0.84091E+00
 ARIEXC: peak, lower, upper, distance  354    0.19000E+01    0.60000E+01    0.79107E+00
 ARIEXC: peak, lower, upper, distance  355    0.20000E+01    0.54000E+01    0.85253E+00
 ARIEXC: peak, lower, upper, distance  356    0.20000E+01    0.60000E+01    0.80787E+00
 ARIEXC: peak, lower, upper, distance  357    0.20000E+01    0.60000E+01    0.79685E+00
 ARIEXC: peak, lower, upper, distance  360    0.18000E+01    0.34000E+01    0.84426E+00
 ARIEXC: peak, lower, upper, distance  363    0.20000E+01    0.50000E+01    0.86717E+00
 ARIEXC: peak, lower, upper, distance  365    0.19000E+01    0.60000E+01    0.77901E+00
 ARIEXC: peak, lower, upper, distance  367    0.16000E+01    0.30000E+01    0.87478E+00
 ARIEXC: peak, lower, upper, distance  368    0.18000E+01    0.38000E+01    0.83510E+00
 ARIEXC: peak, lower, upper, distance  369    0.20000E+01    0.60000E+01    0.78040E+00
 ARIEXC: peak, lower, upper, distance  370    0.20000E+01    0.56000E+01    0.77569E+00
 ARIEXC: peak, lower, upper, distance  372    0.18000E+01    0.34000E+01    0.86309E+00
 ARIEXC: peak, lower, upper, distance  373    0.17000E+01    0.33000E+01    0.83164E+00
 ARIEXC: peak, lower, upper, distance  377    0.20000E+01    0.60000E+01    0.79045E+00
 ARIEXC: peak, lower, upper, distance  378    0.18000E+01    0.60000E+01    0.80096E+00
 ARIEXC: peak, lower, upper, distance  379    0.20000E+01    0.52000E+01    0.79622E+00
 ARIEXC: peak, lower, upper, distance  380    0.17000E+01    0.60000E+01    0.76092E+00
 ARIEXC: peak, lower, upper, distance  381    0.20000E+01    0.54000E+01    0.83294E+00
 ARIEXC: peak, lower, upper, distance  382    0.18000E+01    0.38000E+01    0.80185E+00
 ARIEXC: peak, lower, upper, distance  383    0.20000E+01    0.48000E+01    0.84908E+00
 ARIEXC: peak, lower, upper, distance  384    0.17000E+01    0.33000E+01    0.85999E+00
 ARIEXC: peak, lower, upper, distance  385    0.18000E+01    0.34000E+01    0.88087E+00
 ARIEXC: peak, lower, upper, distance  387    0.16000E+01    0.26000E+01    0.83905E+00
 ARIEXC: peak, lower, upper, distance  390    0.19000E+01    0.60000E+01    0.74838E+00
 ARIEXC: peak, lower, upper, distance  391    0.20000E+01    0.60000E+01    0.74142E+00
 ARIEXC: peak, lower, upper, distance  394    0.17000E+01    0.60000E+01    0.75285E+00
 ARIEXC: peak, lower, upper, distance  395    0.19000E+01    0.60000E+01    0.74902E+00
 ARIEXC: peak, lower, upper, distance  396    0.17000E+01    0.60000E+01    0.78611E+00
 ARIEXC: peak, lower, upper, distance  397    0.19000E+01    0.43000E+01    0.83512E+00
 ARIEXC: peak, lower, upper, distance  399    0.13000E+01    0.60000E+01    0.76627E+00
 ARIEXC: peak, lower, upper, distance  400    0.19000E+01    0.49000E+01    0.77875E+00
 ARIEXC: peak, lower, upper, distance  401    0.18000E+01    0.36000E+01    0.85856E+00
 ARIEXC: peak, lower, upper, distance  402    0.17000E+01    0.33000E+01    0.86628E+00
 ARIEXC: peak, lower, upper, distance  403    0.19000E+01    0.53000E+01    0.81243E+00
 ARIEXC: peak, lower, upper, distance  404    0.18000E+01    0.38000E+01    0.83408E+00
 ARIEXC: peak, lower, upper, distance  405    0.18000E+01    0.60000E+01    0.77545E+00
 ARIEXC: peak, lower, upper, distance  406    0.16000E+01    0.60000E+01    0.74671E+00
 ARIEXC: peak, lower, upper, distance  407    0.19000E+01    0.43000E+01    0.82199E+00
 ARIEXC: peak, lower, upper, distance  408    0.18000E+01    0.60000E+01    0.79502E+00
 ARIEXC: peak, lower, upper, distance  411    0.19000E+01    0.60000E+01    0.77356E+00
 ARIEXC: peak, lower, upper, distance  414    0.19000E+01    0.41000E+01    0.83409E+00
 ARIEXC: peak, lower, upper, distance  416    0.16000E+01    0.60000E+01    0.78602E+00
 ARIEXC: peak, lower, upper, distance  417    0.19000E+01    0.43000E+01    0.87080E+00
 ARIEXC: peak, lower, upper, distance  418    0.20000E+01    0.60000E+01    0.76847E+00
 ARIEXC: peak, lower, upper, distance  422    0.20000E+01    0.60000E+01    0.79954E+00
 ARIEXC: peak, lower, upper, distance  423    0.18000E+01    0.60000E+01    0.73685E+00
 ARIEXC: peak, lower, upper, distance  427    0.20000E+01    0.60000E+01    0.86482E+00
 ARIEXC: peak, lower, upper, distance  428    0.17000E+01    0.31000E+01    0.85549E+00
 ARIEXC: peak, lower, upper, distance  429    0.20000E+01    0.60000E+01    0.77042E+00
 ARIEXC: peak, lower, upper, distance  431    0.20000E+01    0.60000E+01    0.77627E+00
 ARIEXC: peak, lower, upper, distance  432    0.20000E+01    0.50000E+01    0.83804E+00
 ARIEXC: peak, lower, upper, distance  442    0.19000E+01    0.60000E+01    0.76952E+00
 ARIEXC: peak, lower, upper, distance  444    0.18000E+01    0.36000E+01    0.85506E+00
 ARIEXC: peak, lower, upper, distance  446    0.20000E+01    0.60000E+01    0.81613E+00
 ARIEXC: peak, lower, upper, distance  447    0.18000E+01    0.36000E+01    0.83615E+00
 ARIEXC: peak, lower, upper, distance  448    0.20000E+01    0.60000E+01    0.77032E+00
 ARIEXC: peak, lower, upper, distance  449    0.16000E+01    0.60000E+01    0.74269E+00
 ARIEXC: peak, lower, upper, distance  450    0.17000E+01    0.33000E+01    0.86491E+00
 ARIEXC: peak, lower, upper, distance  452    0.19000E+01    0.41000E+01    0.85833E+00
 ARIEXC: peak, lower, upper, distance  453    0.20000E+01    0.60000E+01    0.77887E+00
 ARIEXC: peak, lower, upper, distance  454    0.18000E+01    0.40000E+01    0.83154E+00
 ARIEXC: peak, lower, upper, distance  455    0.19000E+01    0.39000E+01    0.84600E+00
 ARIEXC: peak, lower, upper, distance  457    0.20000E+01    0.60000E+01    0.80128E+00
 ARIEXC: peak, lower, upper, distance  458    0.20000E+01    0.54000E+01    0.80084E+00
 ARIEXC: peak, lower, upper, distance  459    0.16000E+01    0.60000E+01    0.79181E+00
 ARIEXC: peak, lower, upper, distance  460    0.20000E+01    0.56000E+01    0.85528E+00
 ARIEXC: peak, lower, upper, distance  462    0.20000E+01    0.60000E+01    0.79142E+00
 ARIEXC: peak, lower, upper, distance  464    0.13000E+01    0.22000E+01    0.91013E+00
 ARIEXC: peak, lower, upper, distance  465    0.19000E+01    0.60000E+01    0.73647E+00
 ARIEXC: peak, lower, upper, distance  466    0.20000E+01    0.54000E+01    0.81677E+00
 ARIEXC: peak, lower, upper, distance  467    0.20000E+01    0.60000E+01    0.76346E+00
 ARIEXC: peak, lower, upper, distance  468    0.17000E+01    0.60000E+01    0.77845E+00
 ARIEXC: peak, lower, upper, distance  469    0.16000E+01    0.30000E+01    0.85739E+00
 ARIEXC: peak, lower, upper, distance  470    0.19000E+01    0.60000E+01    0.78017E+00
 ARIEXC: peak, lower, upper, distance  471    0.20000E+01    0.60000E+01    0.74138E+00
 ARIEXC: peak, lower, upper, distance  472    0.20000E+01    0.50000E+01    0.77659E+00
 ARIEXC: peak, lower, upper, distance  473    0.20000E+01    0.56000E+01    0.81791E+00
 ARIEXC: peak, lower, upper, distance  474    0.20000E+01    0.60000E+01    0.80177E+00
 ARIEXC: peak, lower, upper, distance  477    0.19000E+01    0.43000E+01    0.83734E+00
 ARIEXC: peak, lower, upper, distance  478    0.20000E+01    0.60000E+01    0.78723E+00
 ARIEXC: peak, lower, upper, distance  479    0.19000E+01    0.60000E+01    0.77696E+00
 ARIEXC: peak, lower, upper, distance  480    0.18000E+01    0.34000E+01    0.86384E+00
 ARIEXC: peak, lower, upper, distance  481    0.18000E+01    0.38000E+01    0.82464E+00
 ARIEXC: peak, lower, upper, distance  482    0.20000E+01    0.60000E+01    0.74165E+00
 ARIEXC: peak, lower, upper, distance  483    0.17000E+01    0.33000E+01    0.84181E+00
 ARIEXC: peak, lower, upper, distance  484    0.20000E+01    0.60000E+01    0.87071E+00
 ARIEXC: peak, lower, upper, distance  487    0.19000E+01    0.60000E+01    0.75753E+00
 ARIEXC: peak, lower, upper, distance  488    0.18000E+01    0.60000E+01    0.77573E+00
 ARIEXC: peak, lower, upper, distance  489    0.18000E+01    0.60000E+01    0.78294E+00
 ARIEXC: peak, lower, upper, distance  490    0.20000E+01    0.54000E+01    0.84933E+00
 ARIEXC: peak, lower, upper, distance  492    0.19000E+01    0.41000E+01    0.83546E+00
 ARIEXC: peak, lower, upper, distance  493    0.17000E+01    0.31000E+01    0.83142E+00
 ARIEXC: peak, lower, upper, distance  494    0.18000E+01    0.38000E+01    0.86018E+00
 ARIEXC: peak, lower, upper, distance  495    0.19000E+01    0.51000E+01    0.76442E+00
 ARIEXC: peak, lower, upper, distance  496    0.20000E+01    0.60000E+01    0.78444E+00
 ARIEXC: peak, lower, upper, distance  497    0.17000E+01    0.31000E+01    0.87029E+00
 ARIEXC: peak, lower, upper, distance  498    0.19000E+01    0.45000E+01    0.84169E+00
 ARIEXC: peak, lower, upper, distance  499    0.20000E+01    0.60000E+01    0.77393E+00
 ARIEXC: peak, lower, upper, distance  501    0.17000E+01    0.31000E+01    0.85568E+00
 ARIEXC: peak, lower, upper, distance  502    0.18000E+01    0.40000E+01    0.80536E+00
 ARIEXC: peak, lower, upper, distance  503    0.19000E+01    0.53000E+01    0.81918E+00
 ARIEXC: peak, lower, upper, distance  504    0.20000E+01    0.60000E+01    0.80614E+00
 ARIEXC: peak, lower, upper, distance  505    0.20000E+01    0.52000E+01    0.83424E+00
 ARIEXC: peak, lower, upper, distance  507    0.18000E+01    0.40000E+01    0.86770E+00
 ARIEXC: peak, lower, upper, distance  509    0.18000E+01    0.36000E+01    0.83236E+00
 ARIEXC: peak, lower, upper, distance  511    0.20000E+01    0.60000E+01    0.83061E+00
 ARIEXC: peak, lower, upper, distance  519    0.19000E+01    0.39000E+01    0.86164E+00
 ARIEXC: peak, lower, upper, distance  520    0.17000E+01    0.33000E+01    0.85849E+00
 ARIEXC: peak, lower, upper, distance  521    0.17000E+01    0.31000E+01    0.85902E+00
 ARIEXC: peak, lower, upper, distance  526    0.20000E+01    0.60000E+01    0.81598E+00
 ARIEXC: peak, lower, upper, distance  529    0.20000E+01    0.56000E+01    0.80945E+00
 ARIEXC: peak, lower, upper, distance  531    0.20000E+01    0.52000E+01    0.85261E+00
 ARIEXC: peak, lower, upper, distance  532    0.20000E+01    0.60000E+01    0.75272E+00
 ARIEXC: peak, lower, upper, distance  534    0.20000E+01    0.60000E+01    0.72909E+00
 ARIEXC: peak, lower, upper, distance  535    0.18000E+01    0.60000E+01    0.77590E+00
 ARIEXC: peak, lower, upper, distance  541    0.17000E+01    0.31000E+01    0.86429E+00
 ARIEXC: peak, lower, upper, distance  542    0.20000E+01    0.46000E+01    0.83568E+00
 ARIEXC: peak, lower, upper, distance  543    0.20000E+01    0.56000E+01    0.78718E+00
 ARIEXC: peak, lower, upper, distance  548    0.18000E+01    0.36000E+01    0.84658E+00
 ARIEXC: peak, lower, upper, distance  549    0.20000E+01    0.60000E+01    0.76962E+00
 ARIEXC: peak, lower, upper, distance  550    0.20000E+01    0.60000E+01    0.78954E+00
 ARIEXC: peak, lower, upper, distance  551    0.20000E+01    0.54000E+01    0.81356E+00
 ARIEXC: peak, lower, upper, distance  558    0.19000E+01    0.47000E+01    0.83750E+00
 ARIEXC: peak, lower, upper, distance  559    0.19000E+01    0.41000E+01    0.87979E+00
 ARIEXC: peak, lower, upper, distance  560    0.16000E+01    0.60000E+01    0.80321E+00
 ARIEXC: peak, lower, upper, distance  561    0.11000E+01    0.60000E+01    0.76764E+00
 ARIEXC: peak, lower, upper, distance  562    0.17000E+01    0.31000E+01    0.83050E+00
 ARIEXC: peak, lower, upper, distance  563    0.18000E+01    0.36000E+01    0.83156E+00
 ARIEXC: peak, lower, upper, distance  566    0.19000E+01    0.60000E+01    0.76820E+00
 ARIEXC: peak, lower, upper, distance  567    0.16000E+01    0.60000E+01    0.77761E+00
 ARIEXC: peak, lower, upper, distance  568    0.20000E+01    0.58000E+01    0.81741E+00
 ARIEXC: peak, lower, upper, distance  569    0.20000E+01    0.58000E+01    0.83631E+00
 ARIEXC: peak, lower, upper, distance  570    0.20000E+01    0.56000E+01    0.78051E+00
 ARIEXC: peak, lower, upper, distance  571    0.19000E+01    0.60000E+01    0.78845E+00
 ARIEXC: peak, lower, upper, distance  572    0.16000E+01    0.60000E+01    0.77223E+00
 ARIEXC: peak, lower, upper, distance  573    0.20000E+01    0.60000E+01    0.89256E+00
 ARIEXC: peak, lower, upper, distance  574    0.17000E+01    0.33000E+01    0.82759E+00
 ARIEXC: peak, lower, upper, distance  575    0.18000E+01    0.34000E+01    0.87393E+00
 ARIEXC: peak, lower, upper, distance  576    0.20000E+01    0.52000E+01    0.83596E+00
 ARIEXC: peak, lower, upper, distance  577    0.19000E+01    0.57000E+01    0.79221E+00
 ARIEXC: peak, lower, upper, distance  578    0.20000E+01    0.56000E+01    0.81190E+00
 ARIEXC: peak, lower, upper, distance  579    0.19000E+01    0.60000E+01    0.80109E+00
 ARIEXC: peak, lower, upper, distance  580    0.20000E+01    0.60000E+01    0.77830E+00
 ARIEXC: peak, lower, upper, distance  581    0.19000E+01    0.60000E+01    0.77470E+00
 ARIEXC: peak, lower, upper, distance  582    0.18000E+01    0.60000E+01    0.80787E+00
 ARIEXC: peak, lower, upper, distance  583    0.16000E+01    0.60000E+01    0.74121E+00
 ARIEXC: peak, lower, upper, distance  584    0.20000E+01    0.60000E+01    0.79068E+00
 ARIEXC: peak, lower, upper, distance  586    0.20000E+01    0.58000E+01    0.81185E+00
 ARIEXC: peak, lower, upper, distance  587    0.20000E+01    0.50000E+01    0.77061E+00
 ARIEXC: peak, lower, upper, distance  588    0.18000E+01    0.38000E+01    0.83142E+00
 ARIEXC: peak, lower, upper, distance  589    0.18000E+01    0.40000E+01    0.86017E+00
 ARIEXC: peak, lower, upper, distance  590    0.20000E+01    0.56000E+01    0.75909E+00
 ARIEXC: peak, lower, upper, distance  591    0.15000E+01    0.60000E+01    0.85725E+00
 ARIEXC: peak, lower, upper, distance  592    0.20000E+01    0.60000E+01    0.80770E+00
 ARIEXC: peak, lower, upper, distance  593    0.20000E+01    0.60000E+01    0.83403E+00
 ARIEXC: peak, lower, upper, distance  594    0.20000E+01    0.52000E+01    0.78664E+00
 ARIEXC: peak, lower, upper, distance  595    0.19000E+01    0.53000E+01    0.84097E+00
 ARIEXC: peak, lower, upper, distance  596    0.20000E+01    0.54000E+01    0.85612E+00
 ARIEXC: peak, lower, upper, distance  597    0.19000E+01    0.47000E+01    0.80788E+00
 ARIEXC: peak, lower, upper, distance  598    0.19000E+01    0.43000E+01    0.79877E+00
 ARIEXC: peak, lower, upper, distance  599    0.13000E+01    0.22000E+01    0.91004E+00
 ARIEXC: peak, lower, upper, distance  601    0.19000E+01    0.60000E+01    0.79567E+00
 ARIEXC: peak, lower, upper, distance  603    0.18000E+01    0.36000E+01    0.84897E+00
 ARIEXC: peak, lower, upper, distance  604    0.19000E+01    0.39000E+01    0.83649E+00
 ARIEXC: peak, lower, upper, distance  605    0.20000E+01    0.60000E+01    0.75360E+00
 ARIEXC: peak, lower, upper, distance  607    0.19000E+01    0.41000E+01    0.79847E+00
 ARIEXC: peak, lower, upper, distance  609    0.18000E+01    0.34000E+01    0.84677E+00
 ARIEXC: peak, lower, upper, distance  610    0.18000E+01    0.42000E+01    0.80552E+00
 ARIEXC: peak, lower, upper, distance  615    0.19000E+01    0.47000E+01    0.83233E+00
 ARIEXC: peak, lower, upper, distance  616    0.19000E+01    0.47000E+01    0.86706E+00
 ARIEXC: peak, lower, upper, distance  617    0.17000E+01    0.33000E+01    0.86276E+00
 ARIEXC: peak, lower, upper, distance  619    0.20000E+01    0.60000E+01    0.80555E+00
 ARIEXC: peak, lower, upper, distance  620    0.20000E+01    0.60000E+01    0.88192E+00
 ARIEXC: peak, lower, upper, distance  623    0.20000E+01    0.60000E+01    0.81793E+00
 ARIEXC: peak, lower, upper, distance  625    0.20000E+01    0.60000E+01    0.86259E+00
 ARIEXC: peak, lower, upper, distance  626    0.15000E+01    0.25000E+01    0.86287E+00
 ARIEXC: peak, lower, upper, distance  628    0.19000E+01    0.45000E+01    0.83181E+00
 ARIEXC: peak, lower, upper, distance  629    0.18000E+01    0.40000E+01    0.80319E+00
 ARIEXC: peak, lower, upper, distance  630    0.20000E+01    0.60000E+01    0.83722E+00
 ARIEXC: peak, lower, upper, distance  631    0.18000E+01    0.40000E+01    0.78684E+00
 ARIEXC: peak, lower, upper, distance  633    0.19000E+01    0.41000E+01    0.85475E+00
 ARIEXC: peak, lower, upper, distance  635    0.19000E+01    0.43000E+01    0.82339E+00
 ARIEXC: peak, lower, upper, distance  638    0.17000E+01    0.33000E+01    0.81625E+00
 ARIEXC: peak, lower, upper, distance  640    0.20000E+01    0.52000E+01    0.78717E+00
 ARIEXC: peak, lower, upper, distance  641    0.20000E+01    0.60000E+01    0.83577E+00
 ARIEXC: peak, lower, upper, distance  642    0.20000E+01    0.54000E+01    0.87097E+00
 ARIEXC: peak, lower, upper, distance  644    0.20000E+01    0.60000E+01    0.82435E+00
 ARIEXC: peak, lower, upper, distance  645    0.12000E+01    0.22000E+01    0.91000E+00
 ARIEXC: peak, lower, upper, distance  647    0.15000E+01    0.27000E+01    0.87204E+00
 ARIEXC: peak, lower, upper, distance  654    0.18000E+01    0.34000E+01    0.86197E+00
 ARIEXC: peak, lower, upper, distance  657    0.20000E+01    0.60000E+01    0.77256E+00
 ARIEXC: peak, lower, upper, distance  658    0.13000E+01    0.22000E+01    0.90970E+00
 ARIEXC: peak, lower, upper, distance  665    0.15000E+01    0.25000E+01    0.86065E+00
 ARIEXC: peak, lower, upper, distance  666    0.20000E+01    0.56000E+01    0.87933E+00
 ARIEXC: peak, lower, upper, distance  667    0.20000E+01    0.60000E+01    0.80610E+00
 ARIEXC: peak, lower, upper, distance  668    0.18000E+01    0.36000E+01    0.84630E+00
 ARIEXC: peak, lower, upper, distance  669    0.20000E+01    0.54000E+01    0.79296E+00
 ARIEXC: peak, lower, upper, distance  670    0.20000E+01    0.48000E+01    0.79859E+00
 ARIEXC: peak, lower, upper, distance  671    0.19000E+01    0.45000E+01    0.83993E+00
 ARIEXC: peak, lower, upper, distance  672    0.17000E+01    0.33000E+01    0.87801E+00
 ARIEXC: peak, lower, upper, distance  673    0.20000E+01    0.56000E+01    0.79006E+00
 ARIEXC: peak, lower, upper, distance  674    0.18000E+01    0.38000E+01    0.85763E+00
 ARIEXC: peak, lower, upper, distance  676    0.20000E+01    0.58000E+01    0.79150E+00
 ARIEXC: peak, lower, upper, distance  677    0.16000E+01    0.60000E+01    0.74097E+00
 ARIEXC: peak, lower, upper, distance  678    0.12000E+01    0.60000E+01    0.77649E+00
 ARIEXC: peak, lower, upper, distance  679    0.15000E+01    0.25000E+01    0.87257E+00
 ARIEXC: peak, lower, upper, distance  680    0.20000E+01    0.60000E+01    0.79759E+00
 ARIEXC: peak, lower, upper, distance  681    0.19000E+01    0.60000E+01    0.79559E+00
 ARIEXC: peak, lower, upper, distance  684    0.18000E+01    0.42000E+01    0.80882E+00
 ARIEXC: peak, lower, upper, distance  685    0.15000E+01    0.60000E+01    0.82177E+00
 ARIEXC: peak, lower, upper, distance  686    0.20000E+01    0.60000E+01    0.78162E+00
 ARIEXC: peak, lower, upper, distance  687    0.14000E+01    0.60000E+01    0.74188E+00
 ARIEXC: peak, lower, upper, distance  688    0.16000E+01    0.28000E+01    0.85813E+00
 ARIEXC: peak, lower, upper, distance  689    0.13000E+01    0.22000E+01    0.90870E+00
 ARIEXC: peak, lower, upper, distance  690    0.17000E+01    0.29000E+01    0.88047E+00
 ARIEXC: peak, lower, upper, distance  696    0.20000E+01    0.60000E+01    0.74877E+00
 ARIEXC: peak, lower, upper, distance  697    0.19000E+01    0.49000E+01    0.83312E+00
 ARIEXC: peak, lower, upper, distance  698    0.19000E+01    0.39000E+01    0.86967E+00
 ARIEXC: peak, lower, upper, distance  699    0.20000E+01    0.54000E+01    0.79241E+00
 ARIEXC: peak, lower, upper, distance  700    0.19000E+01    0.41000E+01    0.84815E+00
 ARIEXC: peak, lower, upper, distance  701    0.18000E+01    0.38000E+01    0.86937E+00
 ARIEXC: peak, lower, upper, distance  702    0.19000E+01    0.39000E+01    0.83262E+00
 ARIEXC: peak, lower, upper, distance  703    0.19000E+01    0.43000E+01    0.83138E+00
 ARIEXC: peak, lower, upper, distance  704    0.19000E+01    0.60000E+01    0.77523E+00
 ARIEXC: peak, lower, upper, distance  706    0.11000E+01    0.60000E+01    0.77091E+00
 ARIEXC: peak, lower, upper, distance  711    0.19000E+01    0.60000E+01    0.78929E+00
 ARIEXC: peak, lower, upper, distance  712    0.14000E+01    0.24000E+01    0.87014E+00
 ARIEXC: peak, lower, upper, distance  713    0.14000E+01    0.22000E+01    0.90903E+00
 ARIEXC: peak, lower, upper, distance  718    0.19000E+01    0.60000E+01    0.85140E+00
 ARIEXC: peak, lower, upper, distance  719    0.20000E+01    0.60000E+01    0.82117E+00
 ARIEXC: peak, lower, upper, distance  722    0.20000E+01    0.60000E+01    0.74533E+00
 ARIEXC: peak, lower, upper, distance  723    0.17000E+01    0.31000E+01    0.87243E+00
 ARIEXC: peak, lower, upper, distance  725    0.20000E+01    0.60000E+01    0.83092E+00
 ARIEXC: peak, lower, upper, distance  728    0.20000E+01    0.54000E+01    0.79053E+00
 ARIEXC: peak, lower, upper, distance  730    0.17000E+01    0.31000E+01    0.86992E+00
 ARIEXC: peak, lower, upper, distance  731    0.20000E+01    0.52000E+01    0.84359E+00
 ARIEXC: peak, lower, upper, distance  732    0.18000E+01    0.60000E+01    0.75326E+00
 ARIEXC: peak, lower, upper, distance  733    0.17000E+01    0.60000E+01    0.74117E+00
 ARIEXC: peak, lower, upper, distance  736    0.15000E+01    0.25000E+01    0.87983E+00
 ARIEXC: peak, lower, upper, distance  738    0.17000E+01    0.31000E+01    0.87501E+00
 ARIEXC: peak, lower, upper, distance  740    0.20000E+01    0.60000E+01    0.77816E+00
 ARIEXC: peak, lower, upper, distance  741    0.20000E+01    0.60000E+01    0.78773E+00
 ARIEXC: peak, lower, upper, distance  743    0.20000E+01    0.56000E+01    0.83144E+00
 ARIEXC: peak, lower, upper, distance  744    0.18000E+01    0.34000E+01    0.83449E+00
 ARIEXC: peak, lower, upper, distance  745    0.16000E+01    0.30000E+01    0.87124E+00
 ARIEXC: peak, lower, upper, distance  748    0.17000E+01    0.35000E+01    0.87201E+00
 ARIEXC: peak, lower, upper, distance  749    0.20000E+01    0.60000E+01    0.83601E+00
 ARIEXC: peak, lower, upper, distance  750    0.18000E+01    0.40000E+01    0.83157E+00
 ARIEXC: peak, lower, upper, distance  752    0.19000E+01    0.39000E+01    0.84201E+00
 ARIEXC: peak, lower, upper, distance  753    0.17000E+01    0.60000E+01    0.77752E+00
 ARIEXC: peak, lower, upper, distance  754    0.19000E+01    0.60000E+01    0.83467E+00
 ARIEXC: peak, lower, upper, distance  758    0.18000E+01    0.38000E+01    0.83530E+00
 ARIEXC: peak, lower, upper, distance  759    0.20000E+01    0.60000E+01    0.83428E+00
 ARIEXC: peak, lower, upper, distance  760    0.19000E+01    0.60000E+01    0.82054E+00
 ARIEXC: peak, lower, upper, distance  761    0.19000E+01    0.43000E+01    0.88422E+00
 ARIEXC: peak, lower, upper, distance  765    0.19000E+01    0.41000E+01    0.79845E+00
 ARIEXC: peak, lower, upper, distance  768    0.19000E+01    0.51000E+01    0.79702E+00
 ARIEXC: peak, lower, upper, distance  769    0.19000E+01    0.60000E+01    0.79319E+00
 ARIEXC: peak, lower, upper, distance  770    0.20000E+01    0.58000E+01    0.82487E+00
 ARIEXC: peak, lower, upper, distance  771    0.16000E+01    0.28000E+01    0.86886E+00
 ARIEXC: peak, lower, upper, distance  772    0.15000E+01    0.27000E+01    0.84927E+00
 ARIEXC: peak, lower, upper, distance  773    0.16000E+01    0.26000E+01    0.86965E+00
 ARIEXC: peak, lower, upper, distance  774    0.19000E+01    0.45000E+01    0.83339E+00
 ARIEXC: peak, lower, upper, distance  775    0.20000E+01    0.46000E+01    0.78271E+00
 ARIEXC: peak, lower, upper, distance  776    0.18000E+01    0.60000E+01    0.78874E+00
 ARIEXC: peak, lower, upper, distance  781    0.16000E+01    0.30000E+01    0.84553E+00
 ARIEXC: peak, lower, upper, distance  783    0.19000E+01    0.41000E+01    0.84771E+00
 ARIEXC: peak, lower, upper, distance  784    0.20000E+01    0.60000E+01    0.83045E+00
 ARIEXC: peak, lower, upper, distance  788    0.18000E+01    0.38000E+01    0.83221E+00
 ARIEXC: peak, lower, upper, distance  789    0.19000E+01    0.43000E+01    0.85704E+00
 ARIEXC: peak, lower, upper, distance  792    0.17000E+01    0.31000E+01    0.83154E+00
 ARIEXC: peak, lower, upper, distance  793    0.19000E+01    0.60000E+01    0.86250E+00
 ARIEXC: peak, lower, upper, distance  794    0.18000E+01    0.60000E+01    0.79563E+00
 ARIEXC: peak, lower, upper, distance  795    0.18000E+01    0.36000E+01    0.86357E+00
 ARIEXC: peak, lower, upper, distance  798    0.13000E+01    0.22000E+01    0.87284E+00
 ARIEXC: peak, lower, upper, distance  802    0.20000E+01    0.60000E+01    0.79216E+00
 ARIEXC: peak, lower, upper, distance  803    0.16000E+01    0.60000E+01    0.76969E+00
 ARIEXC: peak, lower, upper, distance  804    0.15000E+01    0.60000E+01    0.75534E+00
 ARIEXC: peak, lower, upper, distance  805    0.19000E+01    0.41000E+01    0.80861E+00
 ARIEXC: peak, lower, upper, distance  807    0.20000E+01    0.58000E+01    0.82974E+00
 ARIEXC: peak, lower, upper, distance  813    0.19000E+01    0.37000E+01    0.86360E+00
 ARIEXC: peak, lower, upper, distance  814    0.20000E+01    0.60000E+01    0.82733E+00
 ARIEXC: peak, lower, upper, distance  817    0.17000E+01    0.31000E+01    0.85537E+00
 ARIEXC: peak, lower, upper, distance  821    0.15000E+01    0.60000E+01    0.78248E+00
 ARIEXC: peak, lower, upper, distance  826    0.16000E+01    0.28000E+01    0.85516E+00
 ARIEXC: peak, lower, upper, distance  827    0.19000E+01    0.41000E+01    0.83242E+00
 ARIEXC: peak, lower, upper, distance  831    0.19000E+01    0.49000E+01    0.76984E+00
 ARIEXC: peak, lower, upper, distance  832    0.19000E+01    0.39000E+01    0.84209E+00
 ARIEXC: peak, lower, upper, distance  835    0.16000E+01    0.60000E+01    0.73092E+00
 ARIEXC: peak, lower, upper, distance  839    0.20000E+01    0.60000E+01    0.78144E+00
 ARIEXC: peak, lower, upper, distance  845    0.19000E+01    0.60000E+01    0.78906E+00
 ARIEXC: peak, lower, upper, distance  851    0.19000E+01    0.60000E+01    0.78666E+00
 ARIEXC: peak, lower, upper, distance  852    0.18000E+01    0.60000E+01    0.77657E+00
 ARIEXC: peak, lower, upper, distance  853    0.10000E+01    0.60000E+01    0.74305E+00
 ARIEXC: peak, lower, upper, distance  858    0.19000E+01    0.39000E+01    0.77969E+00
 ARIEXC: peak, lower, upper, distance  860    0.20000E+01    0.52000E+01    0.75411E+00
 ARIEXC: peak, lower, upper, distance  861    0.20000E+01    0.54000E+01    0.74245E+00
 ARIEXC: peak, lower, upper, distance  862    0.17000E+01    0.31000E+01    0.85533E+00
 ARIEXC: peak, lower, upper, distance  863    0.18000E+01    0.38000E+01    0.83991E+00
 ARIEXC: peak, lower, upper, distance  865    0.19000E+01    0.60000E+01    0.77195E+00
 ARIEXC: peak, lower, upper, distance  868    0.18000E+01    0.60000E+01    0.83213E+00
 ARIEXC: peak, lower, upper, distance  869    0.20000E+01    0.60000E+01    0.83511E+00
 ARIEXC: peak, lower, upper, distance  872    0.12000E+01    0.22000E+01    0.90906E+00
 ARIEXC: peak, lower, upper, distance  875    0.19000E+01    0.51000E+01    0.87248E+00
 ARIEXC: peak, lower, upper, distance  876    0.19000E+01    0.43000E+01    0.83607E+00
 ARIEXC: peak, lower, upper, distance  877    0.19000E+01    0.60000E+01    0.79342E+00
 ARIEXC: peak, lower, upper, distance  886    0.19000E+01    0.60000E+01    0.85295E+00
 ARIEXC: peak, lower, upper, distance    1    0.19000E+01    0.43000E+01    0.79911E+00
 ARIEXC: peak, lower, upper, distance    1    0.17000E+01    0.29000E+01    0.84771E+00
 ARIEXC: peak, lower, upper, distance    2    0.17000E+01    0.29000E+01    0.84181E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.43000E+01    0.85443E+00
 ARIEXC: peak, lower, upper, distance    5    0.16000E+01    0.28000E+01    0.86762E+00
 ARIEXC: peak, lower, upper, distance    6    0.17000E+01    0.60000E+01    0.77078E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.60000E+01    0.82192E+00
 ARIEXC: peak, lower, upper, distance    8    0.17000E+01    0.60000E+01    0.76105E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.50000E+01    0.80718E+00
 ARIEXC: peak, lower, upper, distance   10    0.20000E+01    0.60000E+01    0.78248E+00
 ARIEXC: peak, lower, upper, distance   11    0.19000E+01    0.60000E+01    0.77657E+00
 ARIEXC: peak, lower, upper, distance   13    0.19000E+01    0.45000E+01    0.87933E+00
 ARIEXC: peak, lower, upper, distance   14    0.20000E+01    0.60000E+01    0.83552E+00
 ARIEXC: peak, lower, upper, distance   15    0.20000E+01    0.56000E+01    0.86488E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.60000E+01    0.78160E+00
 ARIEXC: peak, lower, upper, distance   17    0.20000E+01    0.48000E+01    0.85400E+00
 ARIEXC: peak, lower, upper, distance   18    0.19000E+01    0.39000E+01    0.83750E+00
 ARIEXC: peak, lower, upper, distance   19    0.20000E+01    0.58000E+01    0.80610E+00
 ARIEXC: peak, lower, upper, distance   20    0.20000E+01    0.50000E+01    0.81466E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.47000E+01    0.82748E+00
 ARIEXC: peak, lower, upper, distance   22    0.16000E+01    0.28000E+01    0.87475E+00
 ARIEXC: peak, lower, upper, distance   23    0.19000E+01    0.53000E+01    0.81092E+00
 ARIEXC: peak, lower, upper, distance   25    0.18000E+01    0.60000E+01    0.77517E+00
 ARIEXC: peak, lower, upper, distance   27    0.20000E+01    0.60000E+01    0.77758E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.60000E+01    0.79591E+00
 ARIEXC: peak, lower, upper, distance   29    0.20000E+01    0.60000E+01    0.75749E+00
 ARIEXC: peak, lower, upper, distance   30    0.20000E+01    0.60000E+01    0.76196E+00
 ARIEXC: peak, lower, upper, distance   33    0.16000E+01    0.30000E+01    0.88068E+00
 ARIEXC: peak, lower, upper, distance   34    0.20000E+01    0.50000E+01    0.83515E+00
 ARIEXC: peak, lower, upper, distance   35    0.20000E+01    0.60000E+01    0.81613E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.60000E+01    0.77788E+00
 ARIEXC: peak, lower, upper, distance   37    0.20000E+01    0.48000E+01    0.80556E+00
 ARIEXC: peak, lower, upper, distance   38    0.20000E+01    0.58000E+01    0.86308E+00
 ARIEXC: peak, lower, upper, distance   39    0.19000E+01    0.47000E+01    0.82735E+00
 ARIEXC: peak, lower, upper, distance   40    0.20000E+01    0.60000E+01    0.78602E+00
 ARIEXC: peak, lower, upper, distance   41    0.19000E+01    0.60000E+01    0.77814E+00
 ARIEXC: peak, lower, upper, distance   43    0.15000E+01    0.27000E+01    0.87135E+00
 ARIEXC: peak, lower, upper, distance   44    0.18000E+01    0.38000E+01    0.83736E+00
 ARIEXC: peak, lower, upper, distance   45    0.19000E+01    0.60000E+01    0.78926E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.60000E+01    0.78666E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.77629E+00
 ARIEXC: peak, lower, upper, distance   49    0.19000E+01    0.41000E+01    0.83693E+00
 ARIEXC: peak, lower, upper, distance   50    0.15000E+01    0.23000E+01    0.87647E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.50000E+01    0.79419E+00
 ARIEXC: peak, lower, upper, distance   53    0.20000E+01    0.50000E+01    0.80882E+00
 ARIEXC: peak, lower, upper, distance   54    0.20000E+01    0.46000E+01    0.84263E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.60000E+01    0.77964E+00
 ARIEXC: peak, lower, upper, distance   56    0.19000E+01    0.60000E+01    0.78156E+00
 ARIEXC: peak, lower, upper, distance   57    0.18000E+01    0.38000E+01    0.83543E+00
 ARIEXC: peak, lower, upper, distance   58    0.16000E+01    0.28000E+01    0.86705E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.60000E+01    0.76760E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.60000E+01    0.82546E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.48000E+01    0.89121E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.43000E+01    0.80354E+00
 ARIEXC: peak, lower, upper, distance   65    0.12000E+01    0.22000E+01    0.91312E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.60000E+01    0.82060E+00
 ARIEXC: peak, lower, upper, distance   68    0.19000E+01    0.51000E+01    0.88852E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.48000E+01    0.83729E+00
 ARIEXC: peak, lower, upper, distance   71    0.20000E+01    0.58000E+01    0.81062E+00
 ARIEXC: peak, lower, upper, distance   72    0.13000E+01    0.22000E+01    0.91305E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.60000E+01    0.79006E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.43000E+01    0.85763E+00
 ARIEXC: peak, lower, upper, distance   78    0.19000E+01    0.60000E+01    0.75832E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.60000E+01    0.77508E+00
 ARIEXC: peak, lower, upper, distance   80    0.19000E+01    0.60000E+01    0.74113E+00
 ARIEXC: peak, lower, upper, distance   81    0.20000E+01    0.54000E+01    0.77245E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.60000E+01    0.79221E+00
 ARIEXC: peak, lower, upper, distance   83    0.17000E+01    0.31000E+01    0.87393E+00
 ARIEXC: peak, lower, upper, distance   84    0.20000E+01    0.50000E+01    0.83642E+00
 ARIEXC: peak, lower, upper, distance   85    0.20000E+01    0.56000E+01    0.80612E+00
 ARIEXC: peak, lower, upper, distance   87    0.15000E+01    0.25000E+01    0.87906E+00
 ARIEXC: peak, lower, upper, distance   88    0.19000E+01    0.39000E+01    0.83748E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.46000E+01    0.85303E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.40000E+01    0.85062E+00
 ARIEXC: peak, lower, upper, distance   92    0.20000E+01    0.60000E+01    0.78896E+00
 ARIEXC: peak, lower, upper, distance   93    0.20000E+01    0.60000E+01    0.84806E+00
 ARIEXC: peak, lower, upper, distance   94    0.19000E+01    0.45000E+01    0.87465E+00
 ARIEXC: peak, lower, upper, distance   95    0.20000E+01    0.56000E+01    0.84356E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.50000E+01    0.79178E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.56000E+01    0.80239E+00
 ARIEXC: peak, lower, upper, distance   98    0.20000E+01    0.48000E+01    0.86075E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.77847E+00
 ARIEXC: peak, lower, upper, distance  101    0.20000E+01    0.60000E+01    0.79773E+00
 ARIEXC: peak, lower, upper, distance  103    0.18000E+01    0.42000E+01    0.83787E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.56000E+01    0.81337E+00
 ARIEXC: peak, lower, upper, distance  105    0.17000E+01    0.60000E+01    0.77175E+00
 ARIEXC: peak, lower, upper, distance  106    0.20000E+01    0.60000E+01    0.78913E+00
 ARIEXC: peak, lower, upper, distance  107    0.20000E+01    0.60000E+01    0.83213E+00
 ARIEXC: peak, lower, upper, distance  108    0.17000E+01    0.31000E+01    0.85886E+00
 ARIEXC: peak, lower, upper, distance  109    0.18000E+01    0.36000E+01    0.86360E+00
 ARIEXC: peak, lower, upper, distance  110    0.20000E+01    0.48000E+01    0.76984E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.78906E+00
 ARIEXC: peak, lower, upper, distance  113    0.16000E+01    0.28000E+01    0.86655E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.75086E+00
 ARIEXC: peak, lower, upper, distance  115    0.19000E+01    0.47000E+01    0.81117E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.83453E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.85792E+00
 ARIEXC: peak, lower, upper, distance  118    0.19000E+01    0.60000E+01    0.78847E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.43000E+01    0.83904E+00
 ARIEXC: peak, lower, upper, distance  120    0.20000E+01    0.60000E+01    0.79733E+00
 ARIEXC: peak, lower, upper, distance  122    0.16000E+01    0.60000E+01    0.74909E+00
 ARIEXC: peak, lower, upper, distance  123    0.14000E+01    0.24000E+01    0.91296E+00
 ARIEXC: peak, lower, upper, distance  124    0.19000E+01    0.60000E+01    0.86540E+00
 ARIEXC: peak, lower, upper, distance  125    0.20000E+01    0.50000E+01    0.80084E+00
 ARIEXC: peak, lower, upper, distance  126    0.20000E+01    0.52000E+01    0.79181E+00
 ARIEXC: peak, lower, upper, distance  127    0.20000E+01    0.56000E+01    0.78629E+00
 ARIEXC: peak, lower, upper, distance  128    0.17000E+01    0.33000E+01    0.87291E+00
 ARIEXC: peak, lower, upper, distance  130    0.18000E+01    0.40000E+01    0.83950E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.82941E+00
 ARIEXC: peak, lower, upper, distance  132    0.20000E+01    0.50000E+01    0.81457E+00
 ARIEXC: peak, lower, upper, distance  133    0.17000E+01    0.35000E+01    0.86933E+00
 ARIEXC: peak, lower, upper, distance  134    0.19000E+01    0.51000E+01    0.80912E+00
 ARIEXC: peak, lower, upper, distance  135    0.19000E+01    0.39000E+01    0.84660E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.43000E+01    0.79492E+00
 ARIEXC: peak, lower, upper, distance  137    0.19000E+01    0.41000E+01    0.84407E+00
 ARIEXC: peak, lower, upper, distance  138    0.16000E+01    0.28000E+01    0.87595E+00
 ARIEXC: peak, lower, upper, distance  139    0.18000E+01    0.34000E+01    0.84993E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.60000E+01    0.77774E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.56000E+01    0.79865E+00
 ARIEXC: peak, lower, upper, distance  142    0.19000E+01    0.60000E+01    0.77857E+00
 ARIEXC: peak, lower, upper, distance  143    0.20000E+01    0.60000E+01    0.77762E+00
 ARIEXC: peak, lower, upper, distance  144    0.19000E+01    0.45000E+01    0.78954E+00
 ARIEXC: peak, lower, upper, distance  145    0.19000E+01    0.60000E+01    0.77318E+00
 ARIEXC: peak, lower, upper, distance  146    0.19000E+01    0.41000E+01    0.83781E+00
 ARIEXC: peak, lower, upper, distance  147    0.15000E+01    0.25000E+01    0.87983E+00
 ARIEXC: peak, lower, upper, distance  148    0.18000E+01    0.38000E+01    0.83543E+00
 ARIEXC: peak, lower, upper, distance  149    0.19000E+01    0.60000E+01    0.78221E+00
 ARIEXC: peak, lower, upper, distance  150    0.19000E+01    0.60000E+01    0.80308E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.45000E+01    0.84734E+00
 ARIEXC: peak, lower, upper, distance  152    0.20000E+01    0.60000E+01    0.76081E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.56000E+01    0.78621E+00
 ARIEXC: peak, lower, upper, distance  155    0.19000E+01    0.41000E+01    0.85970E+00
 ARIEXC: peak, lower, upper, distance  156    0.19000E+01    0.41000E+01    0.83510E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.60000E+01    0.77435E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.87283E+00
 ARIEXC: peak, lower, upper, distance  159    0.18000E+01    0.40000E+01    0.80185E+00
 ARIEXC: peak, lower, upper, distance  160    0.19000E+01    0.47000E+01    0.84908E+00
 ARIEXC: peak, lower, upper, distance  161    0.20000E+01    0.48000E+01    0.79107E+00
 ARIEXC: peak, lower, upper, distance  162    0.19000E+01    0.60000E+01    0.75556E+00
 ARIEXC: peak, lower, upper, distance  163    0.19000E+01    0.43000E+01    0.82151E+00
 ARIEXC: peak, lower, upper, distance  166    0.16000E+01    0.28000E+01    0.87478E+00
 ARIEXC: peak, lower, upper, distance  167    0.19000E+01    0.45000E+01    0.83512E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.60000E+01    0.78939E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.56000E+01    0.83294E+00
 ARIEXC: peak, lower, upper, distance  170    0.20000E+01    0.52000E+01    0.79622E+00
 ARIEXC: peak, lower, upper, distance  171    0.20000E+01    0.60000E+01    0.74426E+00
 ARIEXC: peak, lower, upper, distance  172    0.19000E+01    0.45000E+01    0.82199E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.56000E+01    0.77627E+00
 ARIEXC: peak, lower, upper, distance  175    0.20000E+01    0.60000E+01    0.79942E+00
 ARIEXC: peak, lower, upper, distance  176    0.16000E+01    0.26000E+01    0.87851E+00
 ARIEXC: peak, lower, upper, distance  177    0.18000E+01    0.40000E+01    0.83615E+00
 ARIEXC: peak, lower, upper, distance  179    0.18000E+01    0.36000E+01    0.84600E+00
 ARIEXC: peak, lower, upper, distance  180    0.20000E+01    0.60000E+01    0.79502E+00
 ARIEXC: peak, lower, upper, distance  181    0.18000E+01    0.60000E+01    0.76158E+00
 ARIEXC: peak, lower, upper, distance  182    0.18000E+01    0.38000E+01    0.83804E+00
 ARIEXC: peak, lower, upper, distance  183    0.19000E+01    0.39000E+01    0.85528E+00
 ARIEXC: peak, lower, upper, distance  184    0.18000E+01    0.34000E+01    0.87586E+00
 ARIEXC: peak, lower, upper, distance  185    0.20000E+01    0.50000E+01    0.83822E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.54000E+01    0.80748E+00
 ARIEXC: peak, lower, upper, distance  187    0.18000E+01    0.34000E+01    0.85358E+00
 ARIEXC: peak, lower, upper, distance  188    0.19000E+01    0.60000E+01    0.84822E+00
 ARIEXC: peak, lower, upper, distance  189    0.19000E+01    0.60000E+01    0.80361E+00
 ARIEXC: peak, lower, upper, distance  190    0.20000E+01    0.52000E+01    0.81677E+00
 ARIEXC: peak, lower, upper, distance  191    0.19000E+01    0.39000E+01    0.83734E+00
 ARIEXC: peak, lower, upper, distance  192    0.18000E+01    0.40000E+01    0.81791E+00
 ARIEXC: peak, lower, upper, distance  196    0.19000E+01    0.43000E+01    0.83546E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.80861E+00
 ARIEXC: peak, lower, upper, distance  198    0.19000E+01    0.45000E+01    0.85435E+00
 ARIEXC: peak, lower, upper, distance  199    0.19000E+01    0.43000E+01    0.83733E+00
 ARIEXC: peak, lower, upper, distance  200    0.20000E+01    0.54000E+01    0.87071E+00
 ARIEXC: peak, lower, upper, distance  201    0.20000E+01    0.56000E+01    0.81682E+00
 ARIEXC: peak, lower, upper, distance  202    0.19000E+01    0.43000E+01    0.83375E+00
 ARIEXC: peak, lower, upper, distance  203    0.20000E+01    0.56000E+01    0.82768E+00
 ARIEXC: peak, lower, upper, distance  204    0.20000E+01    0.56000E+01    0.80003E+00
 ARIEXC: peak, lower, upper, distance  205    0.16000E+01    0.28000E+01    0.87029E+00
 ARIEXC: peak, lower, upper, distance  206    0.19000E+01    0.60000E+01    0.76932E+00
 ARIEXC: peak, lower, upper, distance  207    0.20000E+01    0.60000E+01    0.76348E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.46000E+01    0.83061E+00
 ARIEXC: peak, lower, upper, distance  209    0.19000E+01    0.47000E+01    0.83106E+00
 ARIEXC: peak, lower, upper, distance  211    0.19000E+01    0.41000E+01    0.83601E+00
 ARIEXC: peak, lower, upper, distance  212    0.18000E+01    0.34000E+01    0.84169E+00
 ARIEXC: peak, lower, upper, distance  213    0.20000E+01    0.60000E+01    0.80128E+00
 ARIEXC: peak, lower, upper, distance  214    0.20000E+01    0.60000E+01    0.77546E+00
 ARIEXC: peak, lower, upper, distance  215    0.20000E+01    0.50000E+01    0.86628E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.60000E+01    0.77720E+00
 ARIEXC: peak, lower, upper, distance  217    0.19000E+01    0.60000E+01    0.77670E+00
 ARIEXC: peak, lower, upper, distance  218    0.20000E+01    0.46000E+01    0.83568E+00
 ARIEXC: peak, lower, upper, distance  219    0.16000E+01    0.30000E+01    0.87201E+00
 ARIEXC: peak, lower, upper, distance  220    0.20000E+01    0.48000E+01    0.80524E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.43000E+01    0.85261E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.47000E+01    0.81356E+00
 ARIEXC: peak, lower, upper, distance  224    0.17000E+01    0.33000E+01    0.86429E+00
 ARIEXC: peak, lower, upper, distance  225    0.19000E+01    0.47000E+01    0.86607E+00
 ARIEXC: peak, lower, upper, distance  226    0.19000E+01    0.60000E+01    0.76820E+00
 ARIEXC: peak, lower, upper, distance  227    0.19000E+01    0.47000E+01    0.81741E+00
 ARIEXC: peak, lower, upper, distance  228    0.20000E+01    0.60000E+01    0.78954E+00
 ARIEXC: peak, lower, upper, distance  230    0.19000E+01    0.41000E+01    0.84107E+00
 ARIEXC: peak, lower, upper, distance  231    0.19000E+01    0.51000E+01    0.85725E+00
 ARIEXC: peak, lower, upper, distance  232    0.20000E+01    0.52000E+01    0.80770E+00
 ARIEXC: peak, lower, upper, distance  233    0.19000E+01    0.60000E+01    0.78504E+00
 ARIEXC: peak, lower, upper, distance  234    0.19000E+01    0.60000E+01    0.82288E+00
 ARIEXC: peak, lower, upper, distance  237    0.17000E+01    0.35000E+01    0.85377E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.75848E+00
 ARIEXC: peak, lower, upper, distance  239    0.18000E+01    0.36000E+01    0.83649E+00
 ARIEXC: peak, lower, upper, distance  240    0.20000E+01    0.50000E+01    0.84097E+00
 ARIEXC: peak, lower, upper, distance  241    0.19000E+01    0.43000E+01    0.79877E+00
 ARIEXC: peak, lower, upper, distance  242    0.17000E+01    0.33000E+01    0.82759E+00
 ARIEXC: peak, lower, upper, distance  243    0.20000E+01    0.60000E+01    0.78845E+00
 ARIEXC: peak, lower, upper, distance  245    0.19000E+01    0.49000E+01    0.88192E+00
 ARIEXC: peak, lower, upper, distance  246    0.17000E+01    0.31000E+01    0.84897E+00
 ARIEXC: peak, lower, upper, distance  247    0.18000E+01    0.60000E+01    0.77035E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.47000E+01    0.83722E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.36000E+01    0.85704E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.82391E+00
 ARIEXC: peak, lower, upper, distance  253    0.15000E+01    0.27000E+01    0.87801E+00
 ARIEXC: peak, lower, upper, distance  255    0.19000E+01    0.45000E+01    0.82117E+00
 ARIEXC: peak, lower, upper, distance  256    0.20000E+01    0.50000E+01    0.79665E+00
 ARIEXC: peak, lower, upper, distance  257    0.18000E+01    0.34000E+01    0.84019E+00
 ARIEXC: peak, lower, upper, distance  258    0.20000E+01    0.58000E+01    0.79298E+00
 ARIEXC: peak, lower, upper, distance  259    0.20000E+01    0.56000E+01    0.89161E+00
 ARIEXC: peak, lower, upper, distance  260    0.19000E+01    0.43000E+01    0.84629E+00
 ARIEXC: peak, lower, upper, distance  262    0.18000E+01    0.38000E+01    0.84059E+00
 ARIEXC: peak, lower, upper, distance  264    0.18000E+01    0.36000E+01    0.82985E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.60000E+01    0.78675E+00
 ARIEXC: peak, lower, upper, distance  266    0.17000E+01    0.60000E+01    0.78157E+00
 ARIEXC: peak, lower, upper, distance    1    0.20000E+01    0.52000E+01    0.84102E+00
 ARIEXC: peak, lower, upper, distance    2    0.16000E+01    0.30000E+01    0.86105E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.60000E+01    0.78532E+00
 ARIEXC: peak, lower, upper, distance    4    0.11000E+01    0.60000E+01    0.74117E+00
 ARIEXC: peak, lower, upper, distance    5    0.20000E+01    0.58000E+01    0.80480E+00
 ARIEXC: peak, lower, upper, distance    6    0.20000E+01    0.60000E+01    0.75272E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.50000E+01    0.78510E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.60000E+01    0.76946E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.56000E+01    0.84119E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.60000E+01    0.74876E+00
 ARIEXC: peak, lower, upper, distance   12    0.19000E+01    0.60000E+01    0.77845E+00
 ARIEXC: peak, lower, upper, distance   13    0.18000E+01    0.36000E+01    0.84728E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.80146E+00
 ARIEXC: peak, lower, upper, distance   16    0.18000E+01    0.60000E+01    0.81293E+00
 ARIEXC: peak, lower, upper, distance   17    0.17000E+01    0.35000E+01    0.86012E+00
 ARIEXC: peak, lower, upper, distance   20    0.19000E+01    0.60000E+01    0.76606E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.60000E+01    0.77387E+00
 ARIEXC: peak, lower, upper, distance   24    0.19000E+01    0.49000E+01    0.80675E+00
 ARIEXC: peak, lower, upper, distance   25    0.14000E+01    0.24000E+01    0.84469E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.83905E+00
 ARIEXC: peak, lower, upper, distance   42    0.20000E+01    0.58000E+01    0.78688E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.60000E+01    0.75498E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.43000E+01    0.79877E+00
 ARIEXC: peak, lower, upper, distance   56    0.20000E+01    0.60000E+01    0.76651E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.58000E+01    0.76656E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.58000E+01    0.76460E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.77369E+00
 ARIEXC: peak, lower, upper, distance   66    0.20000E+01    0.46000E+01    0.79786E+00
 ARIEXC: peak, lower, upper, distance   67    0.20000E+01    0.52000E+01    0.78482E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.33000E+01    0.86057E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.47000E+01    0.81679E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.60000E+01    0.79092E+00
 ARIEXC: peak, lower, upper, distance   71    0.17000E+01    0.33000E+01    0.85999E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.81327E+00
 ARIEXC: peak, lower, upper, distance   73    0.16000E+01    0.26000E+01    0.85649E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.52000E+01    0.80740E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.60000E+01    0.75970E+00
 ARIEXC: peak, lower, upper, distance   77    0.16000E+01    0.28000E+01    0.86177E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.58000E+01    0.78718E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.56000E+01    0.77875E+00
 ARIEXC: peak, lower, upper, distance   80    0.17000E+01    0.33000E+01    0.82582E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.50000E+01    0.83555E+00
 ARIEXC: peak, lower, upper, distance   83    0.19000E+01    0.60000E+01    0.72909E+00
 ARIEXC: peak, lower, upper, distance   84    0.17000E+01    0.35000E+01    0.86171E+00
 ARIEXC: peak, lower, upper, distance   85    0.19000E+01    0.41000E+01    0.84165E+00
 ARIEXC: peak, lower, upper, distance   86    0.20000E+01    0.54000E+01    0.80809E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.54000E+01    0.77828E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.79540E+00
 ARIEXC: peak, lower, upper, distance   91    0.18000E+01    0.40000E+01    0.89708E+00
 ARIEXC: peak, lower, upper, distance   93    0.19000E+01    0.39000E+01    0.85424E+00
 ARIEXC: peak, lower, upper, distance   95    0.19000E+01    0.39000E+01    0.82767E+00
 ARIEXC: peak, lower, upper, distance   96    0.18000E+01    0.60000E+01    0.74708E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.60000E+01    0.75724E+00
 ARIEXC: peak, lower, upper, distance   98    0.17000E+01    0.33000E+01    0.84848E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.79971E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.45000E+01    0.90111E+00
 ARIEXC: peak, lower, upper, distance  102    0.18000E+01    0.38000E+01    0.78271E+00
 ARIEXC: peak, lower, upper, distance  103    0.19000E+01    0.60000E+01    0.77638E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.46000E+01    0.85426E+00
 ARIEXC: peak, lower, upper, distance  105    0.20000E+01    0.60000E+01    0.82439E+00
 ARIEXC: peak, lower, upper, distance  106    0.19000E+01    0.43000E+01    0.85612E+00
 ARIEXC: peak, lower, upper, distance  107    0.18000E+01    0.40000E+01    0.80788E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.74126E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.78664E+00
 ARIEXC: peak, lower, upper, distance  112    0.19000E+01    0.60000E+01    0.83403E+00
 ARIEXC: peak, lower, upper, distance  113    0.20000E+01    0.54000E+01    0.83745E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.78506E+00
 ARIEXC: peak, lower, upper, distance  115    0.18000E+01    0.40000E+01    0.86087E+00
 ARIEXC: peak, lower, upper, distance  116    0.20000E+01    0.50000E+01    0.78043E+00
 ARIEXC: peak, lower, upper, distance  117    0.20000E+01    0.60000E+01    0.75422E+00
 COUNTV:  839 violations above         0.10000
 ARIA>      end 
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_1.float opened.
 ARIA> REVE ((segid "    " and resid 1    and name HA1 ) OR   ( segid "    " and resid 1    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 2    and name HB1 ) OR   ( segid "    " and resid 2    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HB1 ) OR   ( segid "    " and resid 3    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HD1 ) OR   ( segid "    " and resid 3    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HD1 ) OR   ( segid "    " and resid 5    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HD11) OR   ( segid "    " and resid 6    and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HB1 ) OR   ( segid "    " and resid 7    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HG1 ) OR   ( segid "    " and resid 7    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HD1 ) OR   ( segid "    " and resid 7    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HG1 ) OR   ( segid "    " and resid 8    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HD1 ) OR   ( segid "    " and resid 8    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HG1 ) OR   ( segid "    " and resid 11   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HB1 ) OR   ( segid "    " and resid 12   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HG1 ) OR   ( segid "    " and resid 12   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH21) OR   ( segid "    " and resid 13   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 16   and name HG11) OR   ( segid "    " and resid 16   and name HG21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HG1 ) OR   ( segid "    " and resid 19   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HD1 ) OR   ( segid "    " and resid 19   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 24   and name HD21) OR   ( segid "    " and resid 24   and name HD22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HG1 ) OR   ( segid "    " and resid 26   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 27   and name HB1 ) OR   ( segid "    " and resid 27   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HB1 ) OR   ( segid "    " and resid 28   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HG1 ) OR   ( segid "    " and resid 28   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HD1 ) OR   ( segid "    " and resid 28   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH11) OR   ( segid "    " and resid 28   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH21) OR   ( segid "    " and resid 28   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 31   and name HG1 ) OR   ( segid "    " and resid 31   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HG1 ) OR   ( segid "    " and resid 33   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HE1 ) OR   ( segid "    " and resid 33   and name HE2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HB1 ) OR   ( segid "    " and resid 34   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 36   and name HB1 ) OR   ( segid "    " and resid 36   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HB1 ) OR   ( segid "    " and resid 38   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($count=$count+1) 
 EVALUATE: symbol $COUNT set to    5.00000     (real)
 CNSsolve>end loop main 
 CNSsolve>while ($count le $Iterations.Assignstruct) loop main 
 NEXTCD: condition evaluated as true
 CNSsolve>   evaluate ($file = $filenames.bestfile_$count) 
 EVALUATE: symbol $FILE set to "PREVIT:ww1_10.pdb" (string)
 CNSsolve>   display $file 
PREVIT:ww1_10.pdb
 CNSsolve>   coor init end 
 COOR: selected main coordinates initialized
 CNSsolve>   if ($file ne "") then 
 NEXTCD: condition evaluated as true
 CNSsolve>      coor @@$file 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_10.pdb opened.
 COOR>REMARK FILENAME="/usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_10.pdb" 
 COOR>REMARK =============================================================== 
 COOR>REMARK            overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK energies: 226.487, 1.87728, 17.8801, 2.31948, 170.302, 28.7336, 0, 4.83372, 0.540974, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK            bonds,angles,impropers,dihe,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK rms-dev.: 1.720759E-03,0.320479,0.209191,41.1927,1.035302E-02,0.3982,0,0,0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK               noe,cdih,coup,sani,dani,vean 
 COOR>REMARK               >0.3,>5,>1,>0,>5 
 COOR>REMARK violations.: 0, 0, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK DATE:02-Mar-2010  14:03:12       created by user: fkieken 
 COOR>REMARK VERSION:1.1 
 COOR>ATOM      1  HA1 GLY     1      12.989 -15.509   2.053  1.00  0.00 
 COOR>ATOM      2  HA2 GLY     1      13.200 -14.837   3.663  1.00  0.00 
 CNSsolve>      eval ($floatfile = $file - ".pdb" + ".float") 
 EVALUATE: symbol $FLOATFILE set to "PREVIT:ww1_10.float" (string)
 CNSsolve>      fileexist $floatfile end  eval ($qfloatfile = $result) 
 MISCOM: file exists
 EVALUATE: symbol $QFLOATFILE set to TRUE (logical)
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_10.float opened.
 ARIA> REVE ((segid "    " and resid 3    and name HG1 ) OR   ( segid "    " and resid 3    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HB1 ) OR   ( segid "    " and resid 6    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HB1 ) OR   ( segid "    " and resid 7    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HG1 ) OR   ( segid "    " and resid 7    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HD1 ) OR   ( segid "    " and resid 7    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HB1 ) OR   ( segid "    " and resid 8    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HD1 ) OR   ( segid "    " and resid 8    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 9    and name HA1 ) OR   ( segid "    " and resid 9    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HB1 ) OR   ( segid "    " and resid 11   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH11) OR   ( segid "    " and resid 13   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 15   and name HB1 ) OR   ( segid "    " and resid 15   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HB1 ) OR   ( segid "    " and resid 19   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HD1 ) OR   ( segid "    " and resid 19   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HH11) OR   ( segid "    " and resid 19   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 24   and name HD21) OR   ( segid "    " and resid 24   and name HD22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 27   and name HB1 ) OR   ( segid "    " and resid 27   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HG1 ) OR   ( segid "    " and resid 28   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH21) OR   ( segid "    " and resid 28   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 32   and name HB1 ) OR   ( segid "    " and resid 32   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HB1 ) OR   ( segid "    " and resid 33   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HG1 ) OR   ( segid "    " and resid 33   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HE1 ) OR   ( segid "    " and resid 33   and name HE2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HG1 ) OR   ( segid "    " and resid 34   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH11) OR   ( segid "    " and resid 34   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HB1 ) OR   ( segid "    " and resid 38   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HG1 ) OR   ( segid "    " and resid 38   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>      aria 
 ARIA>         analyse_restraints aver end 
DISACC: accumulating distance matrix with dimension  269
 AMBVAC: read in   990 distances in mode ACCU
 ARIA>         countvio threshold $Iterations.violtoler end 
 ARIEXC: peak, lower, upper, distance    1    0.18000E+01    0.36000E+01    0.87611E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.48000E+01    0.86686E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.45000E+01    0.83805E+00
 ARIEXC: peak, lower, upper, distance    5    0.19000E+01    0.47000E+01    0.83144E+00
 ARIEXC: peak, lower, upper, distance    6    0.18000E+01    0.36000E+01    0.85942E+00
 ARIEXC: peak, lower, upper, distance    7    0.19000E+01    0.53000E+01    0.81683E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.43000E+01    0.83302E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.54000E+01    0.75779E+00
 ARIEXC: peak, lower, upper, distance   13    0.20000E+01    0.58000E+01    0.84003E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.86816E+00
 ARIEXC: peak, lower, upper, distance   15    0.18000E+01    0.36000E+01    0.86337E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.45000E+01    0.85964E+00
 ARIEXC: peak, lower, upper, distance   17    0.19000E+01    0.60000E+01    0.80752E+00
 ARIEXC: peak, lower, upper, distance   21    0.13000E+01    0.22000E+01    0.91034E+00
 ARIEXC: peak, lower, upper, distance   23    0.13000E+01    0.60000E+01    0.89402E+00
 ARIEXC: peak, lower, upper, distance   24    0.20000E+01    0.60000E+01    0.80384E+00
 ARIEXC: peak, lower, upper, distance   26    0.15000E+01    0.27000E+01    0.88160E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.43000E+01    0.86107E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.86242E+00
 ARIEXC: peak, lower, upper, distance   30    0.18000E+01    0.38000E+01    0.80243E+00
 ARIEXC: peak, lower, upper, distance   31    0.18000E+01    0.36000E+01    0.84577E+00
 ARIEXC: peak, lower, upper, distance   33    0.18000E+01    0.60000E+01    0.83346E+00
 ARIEXC: peak, lower, upper, distance   34    0.19000E+01    0.49000E+01    0.84534E+00
 ARIEXC: peak, lower, upper, distance   35    0.19000E+01    0.60000E+01    0.78402E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.41000E+01    0.78082E+00
 ARIEXC: peak, lower, upper, distance   43    0.13000E+01    0.22000E+01    0.91066E+00
 ARIEXC: peak, lower, upper, distance   44    0.16000E+01    0.30000E+01    0.86375E+00
 ARIEXC: peak, lower, upper, distance   45    0.17000E+01    0.33000E+01    0.86084E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.43000E+01    0.82309E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.76175E+00
 ARIEXC: peak, lower, upper, distance   52    0.18000E+01    0.34000E+01    0.86204E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.41000E+01    0.80472E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.46000E+01    0.80413E+00
 ARIEXC: peak, lower, upper, distance   57    0.19000E+01    0.51000E+01    0.81753E+00
 ARIEXC: peak, lower, upper, distance   59    0.17000E+01    0.31000E+01    0.83196E+00
 ARIEXC: peak, lower, upper, distance   60    0.18000E+01    0.40000E+01    0.85795E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.83192E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.60000E+01    0.75015E+00
 ARIEXC: peak, lower, upper, distance   63    0.20000E+01    0.58000E+01    0.78202E+00
 ARIEXC: peak, lower, upper, distance   64    0.19000E+01    0.53000E+01    0.83579E+00
 ARIEXC: peak, lower, upper, distance   65    0.16000E+01    0.28000E+01    0.84815E+00
 ARIEXC: peak, lower, upper, distance   66    0.16000E+01    0.28000E+01    0.87218E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.41000E+01    0.87027E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.31000E+01    0.85296E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.60000E+01    0.78356E+00
 ARIEXC: peak, lower, upper, distance   71    0.19000E+01    0.45000E+01    0.81187E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.80282E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.41000E+01    0.83147E+00
 ARIEXC: peak, lower, upper, distance   76    0.20000E+01    0.52000E+01    0.88840E+00
 ARIEXC: peak, lower, upper, distance   77    0.13000E+01    0.22000E+01    0.91094E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.48000E+01    0.84473E+00
 ARIEXC: peak, lower, upper, distance   82    0.19000E+01    0.60000E+01    0.78609E+00
 ARIEXC: peak, lower, upper, distance   86    0.19000E+01    0.60000E+01    0.76665E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.79532E+00
 ARIEXC: peak, lower, upper, distance   91    0.19000E+01    0.60000E+01    0.83035E+00
 ARIEXC: peak, lower, upper, distance   93    0.16000E+01    0.26000E+01    0.86935E+00
 ARIEXC: peak, lower, upper, distance   95    0.11000E+01    0.60000E+01    0.77732E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.60000E+01    0.76805E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.41000E+01    0.80876E+00
 ARIEXC: peak, lower, upper, distance  100    0.20000E+01    0.56000E+01    0.75150E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.41000E+01    0.80655E+00
 ARIEXC: peak, lower, upper, distance  102    0.15000E+01    0.25000E+01    0.86902E+00
 ARIEXC: peak, lower, upper, distance  103    0.20000E+01    0.60000E+01    0.79793E+00
 ARIEXC: peak, lower, upper, distance  104    0.18000E+01    0.42000E+01    0.84707E+00
 ARIEXC: peak, lower, upper, distance  105    0.19000E+01    0.53000E+01    0.80343E+00
 ARIEXC: peak, lower, upper, distance  108    0.18000E+01    0.36000E+01    0.86013E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.79934E+00
 ARIEXC: peak, lower, upper, distance  110    0.17000E+01    0.29000E+01    0.85478E+00
 ARIEXC: peak, lower, upper, distance  112    0.20000E+01    0.60000E+01    0.79299E+00
 ARIEXC: peak, lower, upper, distance  113    0.19000E+01    0.43000E+01    0.85545E+00
 ARIEXC: peak, lower, upper, distance  114    0.20000E+01    0.58000E+01    0.77000E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.85479E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.84938E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.60000E+01    0.75465E+00
 ARIEXC: peak, lower, upper, distance  120    0.17000E+01    0.31000E+01    0.85491E+00
 ARIEXC: peak, lower, upper, distance  121    0.20000E+01    0.60000E+01    0.79430E+00
 ARIEXC: peak, lower, upper, distance  122    0.19000E+01    0.60000E+01    0.84026E+00
 ARIEXC: peak, lower, upper, distance  123    0.20000E+01    0.50000E+01    0.81488E+00
 ARIEXC: peak, lower, upper, distance  124    0.17000E+01    0.33000E+01    0.85982E+00
 ARIEXC: peak, lower, upper, distance  126    0.19000E+01    0.49000E+01    0.85618E+00
 ARIEXC: peak, lower, upper, distance  127    0.19000E+01    0.43000E+01    0.83629E+00
 ARIEXC: peak, lower, upper, distance  128    0.19000E+01    0.51000E+01    0.78627E+00
 ARIEXC: peak, lower, upper, distance  129    0.19000E+01    0.43000E+01    0.79400E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.75833E+00
 ARIEXC: peak, lower, upper, distance  132    0.19000E+01    0.45000E+01    0.85931E+00
 ARIEXC: peak, lower, upper, distance  133    0.19000E+01    0.60000E+01    0.80809E+00
 ARIEXC: peak, lower, upper, distance  134    0.20000E+01    0.48000E+01    0.81897E+00
 ARIEXC: peak, lower, upper, distance  135    0.17000E+01    0.60000E+01    0.78435E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.39000E+01    0.83631E+00
 ARIEXC: peak, lower, upper, distance  137    0.17000E+01    0.31000E+01    0.87237E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.52000E+01    0.81426E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.54000E+01    0.82868E+00
 ARIEXC: peak, lower, upper, distance  143    0.13000E+01    0.22000E+01    0.91021E+00
 ARIEXC: peak, lower, upper, distance  146    0.18000E+01    0.36000E+01    0.83487E+00
 ARIEXC: peak, lower, upper, distance  148    0.14000E+01    0.60000E+01    0.76852E+00
 ARIEXC: peak, lower, upper, distance  149    0.18000E+01    0.38000E+01    0.86285E+00
 ARIEXC: peak, lower, upper, distance  150    0.20000E+01    0.50000E+01    0.81436E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.60000E+01    0.74820E+00
 ARIEXC: peak, lower, upper, distance  153    0.19000E+01    0.60000E+01    0.76779E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.60000E+01    0.77029E+00
 ARIEXC: peak, lower, upper, distance  155    0.15000E+01    0.25000E+01    0.87534E+00
 ARIEXC: peak, lower, upper, distance  156    0.18000E+01    0.36000E+01    0.83718E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.43000E+01    0.83254E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.85212E+00
 ARIEXC: peak, lower, upper, distance  160    0.20000E+01    0.58000E+01    0.80543E+00
 ARIEXC: peak, lower, upper, distance  162    0.17000E+01    0.60000E+01    0.76347E+00
 ARIEXC: peak, lower, upper, distance  164    0.19000E+01    0.60000E+01    0.78805E+00
 ARIEXC: peak, lower, upper, distance  165    0.20000E+01    0.46000E+01    0.83286E+00
 ARIEXC: peak, lower, upper, distance  166    0.20000E+01    0.50000E+01    0.80924E+00
 ARIEXC: peak, lower, upper, distance  167    0.17000E+01    0.33000E+01    0.87118E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.39000E+01    0.84729E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.60000E+01    0.79922E+00
 ARIEXC: peak, lower, upper, distance  170    0.18000E+01    0.60000E+01    0.76708E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.46000E+01    0.77164E+00
 ARIEXC: peak, lower, upper, distance  174    0.20000E+01    0.52000E+01    0.77384E+00
 ARIEXC: peak, lower, upper, distance  175    0.19000E+01    0.43000E+01    0.82024E+00
 ARIEXC: peak, lower, upper, distance  177    0.20000E+01    0.52000E+01    0.82867E+00
 ARIEXC: peak, lower, upper, distance  178    0.20000E+01    0.60000E+01    0.78032E+00
 ARIEXC: peak, lower, upper, distance  180    0.19000E+01    0.45000E+01    0.83993E+00
 ARIEXC: peak, lower, upper, distance  181    0.14000E+01    0.60000E+01    0.79804E+00
 ARIEXC: peak, lower, upper, distance  183    0.20000E+01    0.60000E+01    0.84223E+00
 ARIEXC: peak, lower, upper, distance  184    0.20000E+01    0.48000E+01    0.79800E+00
 ARIEXC: peak, lower, upper, distance  185    0.18000E+01    0.60000E+01    0.83386E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.58000E+01    0.78983E+00
 ARIEXC: peak, lower, upper, distance  188    0.20000E+01    0.60000E+01    0.75955E+00
 ARIEXC: peak, lower, upper, distance  189    0.20000E+01    0.60000E+01    0.78854E+00
 ARIEXC: peak, lower, upper, distance  190    0.19000E+01    0.60000E+01    0.79814E+00
 ARIEXC: peak, lower, upper, distance  191    0.18000E+01    0.60000E+01    0.82565E+00
 ARIEXC: peak, lower, upper, distance  193    0.17000E+01    0.33000E+01    0.83706E+00
 ARIEXC: peak, lower, upper, distance  194    0.19000E+01    0.60000E+01    0.78924E+00
 ARIEXC: peak, lower, upper, distance  195    0.17000E+01    0.60000E+01    0.81496E+00
 ARIEXC: peak, lower, upper, distance  196    0.17000E+01    0.31000E+01    0.83164E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.77658E+00
 ARIEXC: peak, lower, upper, distance  198    0.18000E+01    0.36000E+01    0.84166E+00
 ARIEXC: peak, lower, upper, distance  199    0.15000E+01    0.23000E+01    0.87934E+00
 ARIEXC: peak, lower, upper, distance  200    0.17000E+01    0.31000E+01    0.86220E+00
 ARIEXC: peak, lower, upper, distance  201    0.19000E+01    0.60000E+01    0.78983E+00
 ARIEXC: peak, lower, upper, distance  203    0.19000E+01    0.41000E+01    0.83463E+00
 ARIEXC: peak, lower, upper, distance  205    0.20000E+01    0.52000E+01    0.79246E+00
 ARIEXC: peak, lower, upper, distance  206    0.20000E+01    0.56000E+01    0.76625E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.60000E+01    0.77639E+00
 ARIEXC: peak, lower, upper, distance  209    0.18000E+01    0.40000E+01    0.83223E+00
 ARIEXC: peak, lower, upper, distance  212    0.19000E+01    0.41000E+01    0.85355E+00
 ARIEXC: peak, lower, upper, distance  213    0.17000E+01    0.33000E+01    0.85524E+00
 ARIEXC: peak, lower, upper, distance  214    0.18000E+01    0.40000E+01    0.83674E+00
 ARIEXC: peak, lower, upper, distance  215    0.19000E+01    0.43000E+01    0.82181E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.47000E+01    0.79908E+00
 ARIEXC: peak, lower, upper, distance  217    0.15000E+01    0.60000E+01    0.76854E+00
 ARIEXC: peak, lower, upper, distance  219    0.17000E+01    0.31000E+01    0.85583E+00
 ARIEXC: peak, lower, upper, distance  220    0.18000E+01    0.36000E+01    0.83188E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.49000E+01    0.79923E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.51000E+01    0.85401E+00
 ARIEXC: peak, lower, upper, distance  223    0.19000E+01    0.49000E+01    0.79948E+00
 ARIEXC: peak, lower, upper, distance  224    0.20000E+01    0.58000E+01    0.84397E+00
 ARIEXC: peak, lower, upper, distance  226    0.20000E+01    0.52000E+01    0.80448E+00
 ARIEXC: peak, lower, upper, distance  227    0.20000E+01    0.60000E+01    0.82068E+00
 ARIEXC: peak, lower, upper, distance  230    0.20000E+01    0.56000E+01    0.86961E+00
 ARIEXC: peak, lower, upper, distance  231    0.20000E+01    0.56000E+01    0.80840E+00
 ARIEXC: peak, lower, upper, distance  232    0.13000E+01    0.22000E+01    0.91019E+00
 ARIEXC: peak, lower, upper, distance  236    0.20000E+01    0.56000E+01    0.81482E+00
 ARIEXC: peak, lower, upper, distance  237    0.19000E+01    0.60000E+01    0.78025E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.76716E+00
 ARIEXC: peak, lower, upper, distance  239    0.19000E+01    0.60000E+01    0.77369E+00
 ARIEXC: peak, lower, upper, distance  241    0.17000E+01    0.60000E+01    0.77320E+00
 ARIEXC: peak, lower, upper, distance  242    0.20000E+01    0.60000E+01    0.80259E+00
 ARIEXC: peak, lower, upper, distance  243    0.19000E+01    0.51000E+01    0.84434E+00
 ARIEXC: peak, lower, upper, distance  244    0.18000E+01    0.34000E+01    0.85808E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.41000E+01    0.82343E+00
 ARIEXC: peak, lower, upper, distance  249    0.19000E+01    0.39000E+01    0.87056E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.38000E+01    0.85478E+00
 ARIEXC: peak, lower, upper, distance  251    0.18000E+01    0.38000E+01    0.86920E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.76343E+00
 ARIEXC: peak, lower, upper, distance  253    0.19000E+01    0.60000E+01    0.80541E+00
 ARIEXC: peak, lower, upper, distance  258    0.17000E+01    0.33000E+01    0.85814E+00
 ARIEXC: peak, lower, upper, distance  259    0.17000E+01    0.31000E+01    0.83214E+00
 ARIEXC: peak, lower, upper, distance  260    0.20000E+01    0.60000E+01    0.77229E+00
 ARIEXC: peak, lower, upper, distance  261    0.20000E+01    0.60000E+01    0.79013E+00
 ARIEXC: peak, lower, upper, distance  262    0.19000E+01    0.45000E+01    0.78730E+00
 ARIEXC: peak, lower, upper, distance  263    0.20000E+01    0.52000E+01    0.80908E+00
 ARIEXC: peak, lower, upper, distance  264    0.15000E+01    0.25000E+01    0.88067E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.43000E+01    0.84576E+00
 ARIEXC: peak, lower, upper, distance  266    0.19000E+01    0.43000E+01    0.83521E+00
 ARIEXC: peak, lower, upper, distance  269    0.20000E+01    0.52000E+01    0.78868E+00
 ARIEXC: peak, lower, upper, distance  270    0.16000E+01    0.30000E+01    0.86190E+00
 ARIEXC: peak, lower, upper, distance  271    0.20000E+01    0.60000E+01    0.80101E+00
 ARIEXC: peak, lower, upper, distance  272    0.19000E+01    0.43000E+01    0.80826E+00
 ARIEXC: peak, lower, upper, distance  273    0.20000E+01    0.60000E+01    0.81903E+00
 ARIEXC: peak, lower, upper, distance  274    0.19000E+01    0.60000E+01    0.78670E+00
 ARIEXC: peak, lower, upper, distance  275    0.19000E+01    0.47000E+01    0.83125E+00
 ARIEXC: peak, lower, upper, distance  276    0.20000E+01    0.56000E+01    0.80229E+00
 ARIEXC: peak, lower, upper, distance  277    0.18000E+01    0.36000E+01    0.86100E+00
 ARIEXC: peak, lower, upper, distance  279    0.20000E+01    0.54000E+01    0.77829E+00
 ARIEXC: peak, lower, upper, distance  280    0.20000E+01    0.60000E+01    0.74170E+00
 ARIEXC: peak, lower, upper, distance  282    0.18000E+01    0.60000E+01    0.82192E+00
 ARIEXC: peak, lower, upper, distance  283    0.20000E+01    0.60000E+01    0.88785E+00
 ARIEXC: peak, lower, upper, distance  284    0.17000E+01    0.60000E+01    0.83650E+00
 ARIEXC: peak, lower, upper, distance  288    0.19000E+01    0.47000E+01    0.83662E+00
 ARIEXC: peak, lower, upper, distance  289    0.19000E+01    0.51000E+01    0.85674E+00
 ARIEXC: peak, lower, upper, distance  291    0.17000E+01    0.31000E+01    0.86628E+00
 ARIEXC: peak, lower, upper, distance  292    0.17000E+01    0.35000E+01    0.85540E+00
 ARIEXC: peak, lower, upper, distance  293    0.17000E+01    0.60000E+01    0.77473E+00
 ARIEXC: peak, lower, upper, distance  294    0.17000E+01    0.60000E+01    0.74842E+00
 ARIEXC: peak, lower, upper, distance  296    0.19000E+01    0.49000E+01    0.83349E+00
 ARIEXC: peak, lower, upper, distance  297    0.18000E+01    0.40000E+01    0.80746E+00
 ARIEXC: peak, lower, upper, distance  298    0.19000E+01    0.60000E+01    0.88144E+00
 ARIEXC: peak, lower, upper, distance  299    0.20000E+01    0.60000E+01    0.81226E+00
 ARIEXC: peak, lower, upper, distance  300    0.19000E+01    0.60000E+01    0.79200E+00
 ARIEXC: peak, lower, upper, distance  307    0.13000E+01    0.22000E+01    0.90999E+00
 ARIEXC: peak, lower, upper, distance  310    0.20000E+01    0.60000E+01    0.75265E+00
 ARIEXC: peak, lower, upper, distance  311    0.18000E+01    0.60000E+01    0.80234E+00
 ARIEXC: peak, lower, upper, distance  312    0.20000E+01    0.60000E+01    0.82436E+00
 ARIEXC: peak, lower, upper, distance  313    0.20000E+01    0.60000E+01    0.85552E+00
 ARIEXC: peak, lower, upper, distance  314    0.19000E+01    0.60000E+01    0.74176E+00
 ARIEXC: peak, lower, upper, distance  316    0.16000E+01    0.28000E+01    0.85538E+00
 ARIEXC: peak, lower, upper, distance  318    0.19000E+01    0.43000E+01    0.84003E+00
 ARIEXC: peak, lower, upper, distance  319    0.20000E+01    0.60000E+01    0.81141E+00
 ARIEXC: peak, lower, upper, distance  320    0.19000E+01    0.60000E+01    0.74876E+00
 ARIEXC: peak, lower, upper, distance  322    0.15000E+01    0.27000E+01    0.85891E+00
 ARIEXC: peak, lower, upper, distance  324    0.20000E+01    0.48000E+01    0.85728E+00
 ARIEXC: peak, lower, upper, distance  325    0.19000E+01    0.60000E+01    0.82269E+00
 ARIEXC: peak, lower, upper, distance  326    0.20000E+01    0.56000E+01    0.80814E+00
 ARIEXC: peak, lower, upper, distance  327    0.17000E+01    0.33000E+01    0.86162E+00
 ARIEXC: peak, lower, upper, distance  328    0.20000E+01    0.56000E+01    0.84781E+00
 ARIEXC: peak, lower, upper, distance  329    0.20000E+01    0.60000E+01    0.83180E+00
 ARIEXC: peak, lower, upper, distance  331    0.20000E+01    0.58000E+01    0.75889E+00
 ARIEXC: peak, lower, upper, distance  332    0.20000E+01    0.60000E+01    0.76151E+00
 ARIEXC: peak, lower, upper, distance  333    0.19000E+01    0.43000E+01    0.84717E+00
 ARIEXC: peak, lower, upper, distance  337    0.19000E+01    0.55000E+01    0.80662E+00
 ARIEXC: peak, lower, upper, distance  340    0.20000E+01    0.60000E+01    0.84128E+00
 ARIEXC: peak, lower, upper, distance  344    0.20000E+01    0.60000E+01    0.73879E+00
 ARIEXC: peak, lower, upper, distance  345    0.17000E+01    0.31000E+01    0.84631E+00
 ARIEXC: peak, lower, upper, distance  346    0.20000E+01    0.54000E+01    0.85888E+00
 ARIEXC: peak, lower, upper, distance  347    0.18000E+01    0.42000E+01    0.79030E+00
 ARIEXC: peak, lower, upper, distance  348    0.16000E+01    0.60000E+01    0.75255E+00
 ARIEXC: peak, lower, upper, distance  351    0.17000E+01    0.29000E+01    0.85549E+00
 ARIEXC: peak, lower, upper, distance  352    0.20000E+01    0.60000E+01    0.77164E+00
 ARIEXC: peak, lower, upper, distance  353    0.18000E+01    0.36000E+01    0.88326E+00
 ARIEXC: peak, lower, upper, distance  354    0.19000E+01    0.60000E+01    0.80759E+00
 ARIEXC: peak, lower, upper, distance  355    0.20000E+01    0.54000E+01    0.82084E+00
 ARIEXC: peak, lower, upper, distance  356    0.20000E+01    0.60000E+01    0.80188E+00
 ARIEXC: peak, lower, upper, distance  357    0.20000E+01    0.60000E+01    0.74710E+00
 ARIEXC: peak, lower, upper, distance  360    0.18000E+01    0.34000E+01    0.83972E+00
 ARIEXC: peak, lower, upper, distance  363    0.20000E+01    0.50000E+01    0.86618E+00
 ARIEXC: peak, lower, upper, distance  365    0.19000E+01    0.60000E+01    0.74361E+00
 ARIEXC: peak, lower, upper, distance  367    0.16000E+01    0.30000E+01    0.87068E+00
 ARIEXC: peak, lower, upper, distance  368    0.18000E+01    0.38000E+01    0.83580E+00
 ARIEXC: peak, lower, upper, distance  369    0.20000E+01    0.60000E+01    0.78344E+00
 ARIEXC: peak, lower, upper, distance  370    0.20000E+01    0.56000E+01    0.77391E+00
 ARIEXC: peak, lower, upper, distance  372    0.18000E+01    0.34000E+01    0.86727E+00
 ARIEXC: peak, lower, upper, distance  373    0.17000E+01    0.33000E+01    0.83238E+00
 ARIEXC: peak, lower, upper, distance  377    0.20000E+01    0.60000E+01    0.78126E+00
 ARIEXC: peak, lower, upper, distance  378    0.18000E+01    0.60000E+01    0.81087E+00
 ARIEXC: peak, lower, upper, distance  379    0.20000E+01    0.52000E+01    0.80795E+00
 ARIEXC: peak, lower, upper, distance  380    0.17000E+01    0.60000E+01    0.76463E+00
 ARIEXC: peak, lower, upper, distance  381    0.20000E+01    0.54000E+01    0.84256E+00
 ARIEXC: peak, lower, upper, distance  382    0.18000E+01    0.38000E+01    0.79660E+00
 ARIEXC: peak, lower, upper, distance  383    0.20000E+01    0.48000E+01    0.83413E+00
 ARIEXC: peak, lower, upper, distance  384    0.17000E+01    0.33000E+01    0.86935E+00
 ARIEXC: peak, lower, upper, distance  385    0.18000E+01    0.34000E+01    0.87410E+00
 ARIEXC: peak, lower, upper, distance  387    0.16000E+01    0.26000E+01    0.85045E+00
 ARIEXC: peak, lower, upper, distance  390    0.19000E+01    0.60000E+01    0.75440E+00
 ARIEXC: peak, lower, upper, distance  391    0.20000E+01    0.60000E+01    0.74102E+00
 ARIEXC: peak, lower, upper, distance  394    0.17000E+01    0.60000E+01    0.75410E+00
 ARIEXC: peak, lower, upper, distance  395    0.19000E+01    0.60000E+01    0.76559E+00
 ARIEXC: peak, lower, upper, distance  396    0.17000E+01    0.60000E+01    0.80124E+00
 ARIEXC: peak, lower, upper, distance  397    0.19000E+01    0.43000E+01    0.83546E+00
 ARIEXC: peak, lower, upper, distance  399    0.13000E+01    0.60000E+01    0.77655E+00
 ARIEXC: peak, lower, upper, distance  400    0.19000E+01    0.49000E+01    0.79198E+00
 ARIEXC: peak, lower, upper, distance  401    0.18000E+01    0.36000E+01    0.87394E+00
 ARIEXC: peak, lower, upper, distance  402    0.17000E+01    0.33000E+01    0.86139E+00
 ARIEXC: peak, lower, upper, distance  403    0.19000E+01    0.53000E+01    0.84007E+00
 ARIEXC: peak, lower, upper, distance  404    0.18000E+01    0.38000E+01    0.84098E+00
 ARIEXC: peak, lower, upper, distance  405    0.18000E+01    0.60000E+01    0.79929E+00
 ARIEXC: peak, lower, upper, distance  406    0.16000E+01    0.60000E+01    0.74882E+00
 ARIEXC: peak, lower, upper, distance  407    0.19000E+01    0.43000E+01    0.82344E+00
 ARIEXC: peak, lower, upper, distance  408    0.18000E+01    0.60000E+01    0.79440E+00
 ARIEXC: peak, lower, upper, distance  411    0.19000E+01    0.60000E+01    0.78061E+00
 ARIEXC: peak, lower, upper, distance  414    0.19000E+01    0.41000E+01    0.85839E+00
 ARIEXC: peak, lower, upper, distance  416    0.16000E+01    0.60000E+01    0.78251E+00
 ARIEXC: peak, lower, upper, distance  417    0.19000E+01    0.43000E+01    0.84696E+00
 ARIEXC: peak, lower, upper, distance  418    0.20000E+01    0.60000E+01    0.77935E+00
 ARIEXC: peak, lower, upper, distance  422    0.20000E+01    0.60000E+01    0.79870E+00
 ARIEXC: peak, lower, upper, distance  423    0.18000E+01    0.60000E+01    0.74457E+00
 ARIEXC: peak, lower, upper, distance  427    0.20000E+01    0.60000E+01    0.86680E+00
 ARIEXC: peak, lower, upper, distance  428    0.17000E+01    0.31000E+01    0.85550E+00
 ARIEXC: peak, lower, upper, distance  429    0.20000E+01    0.60000E+01    0.78988E+00
 ARIEXC: peak, lower, upper, distance  431    0.20000E+01    0.60000E+01    0.77233E+00
 ARIEXC: peak, lower, upper, distance  432    0.20000E+01    0.50000E+01    0.85139E+00
 ARIEXC: peak, lower, upper, distance  442    0.19000E+01    0.60000E+01    0.75717E+00
 ARIEXC: peak, lower, upper, distance  444    0.18000E+01    0.36000E+01    0.85527E+00
 ARIEXC: peak, lower, upper, distance  446    0.20000E+01    0.60000E+01    0.80332E+00
 ARIEXC: peak, lower, upper, distance  447    0.18000E+01    0.36000E+01    0.83532E+00
 ARIEXC: peak, lower, upper, distance  448    0.20000E+01    0.60000E+01    0.76927E+00
 ARIEXC: peak, lower, upper, distance  449    0.16000E+01    0.60000E+01    0.74302E+00
 ARIEXC: peak, lower, upper, distance  450    0.17000E+01    0.33000E+01    0.85190E+00
 ARIEXC: peak, lower, upper, distance  452    0.19000E+01    0.41000E+01    0.85883E+00
 ARIEXC: peak, lower, upper, distance  453    0.20000E+01    0.60000E+01    0.77833E+00
 ARIEXC: peak, lower, upper, distance  454    0.18000E+01    0.40000E+01    0.83155E+00
 ARIEXC: peak, lower, upper, distance  455    0.19000E+01    0.39000E+01    0.83926E+00
 ARIEXC: peak, lower, upper, distance  457    0.20000E+01    0.60000E+01    0.79485E+00
 ARIEXC: peak, lower, upper, distance  458    0.20000E+01    0.54000E+01    0.80211E+00
 ARIEXC: peak, lower, upper, distance  459    0.16000E+01    0.60000E+01    0.81200E+00
 ARIEXC: peak, lower, upper, distance  460    0.20000E+01    0.56000E+01    0.85318E+00
 ARIEXC: peak, lower, upper, distance  462    0.20000E+01    0.60000E+01    0.78786E+00
 ARIEXC: peak, lower, upper, distance  464    0.13000E+01    0.22000E+01    0.91014E+00
 ARIEXC: peak, lower, upper, distance  465    0.19000E+01    0.60000E+01    0.73961E+00
 ARIEXC: peak, lower, upper, distance  466    0.20000E+01    0.54000E+01    0.81743E+00
 ARIEXC: peak, lower, upper, distance  467    0.20000E+01    0.60000E+01    0.76737E+00
 ARIEXC: peak, lower, upper, distance  468    0.17000E+01    0.60000E+01    0.79274E+00
 ARIEXC: peak, lower, upper, distance  469    0.16000E+01    0.30000E+01    0.85611E+00
 ARIEXC: peak, lower, upper, distance  470    0.19000E+01    0.60000E+01    0.74159E+00
 ARIEXC: peak, lower, upper, distance  471    0.20000E+01    0.60000E+01    0.80294E+00
 ARIEXC: peak, lower, upper, distance  472    0.20000E+01    0.50000E+01    0.77157E+00
 ARIEXC: peak, lower, upper, distance  473    0.20000E+01    0.56000E+01    0.81633E+00
 ARIEXC: peak, lower, upper, distance  474    0.20000E+01    0.60000E+01    0.79620E+00
 ARIEXC: peak, lower, upper, distance  477    0.19000E+01    0.43000E+01    0.83777E+00
 ARIEXC: peak, lower, upper, distance  478    0.20000E+01    0.60000E+01    0.78443E+00
 ARIEXC: peak, lower, upper, distance  479    0.19000E+01    0.60000E+01    0.77581E+00
 ARIEXC: peak, lower, upper, distance  480    0.18000E+01    0.34000E+01    0.86270E+00
 ARIEXC: peak, lower, upper, distance  481    0.18000E+01    0.38000E+01    0.82648E+00
 ARIEXC: peak, lower, upper, distance  482    0.20000E+01    0.60000E+01    0.74174E+00
 ARIEXC: peak, lower, upper, distance  483    0.17000E+01    0.33000E+01    0.84524E+00
 ARIEXC: peak, lower, upper, distance  484    0.20000E+01    0.60000E+01    0.86879E+00
 ARIEXC: peak, lower, upper, distance  487    0.19000E+01    0.60000E+01    0.75428E+00
 ARIEXC: peak, lower, upper, distance  488    0.18000E+01    0.60000E+01    0.77445E+00
 ARIEXC: peak, lower, upper, distance  489    0.18000E+01    0.60000E+01    0.78198E+00
 ARIEXC: peak, lower, upper, distance  490    0.20000E+01    0.54000E+01    0.80045E+00
 ARIEXC: peak, lower, upper, distance  492    0.19000E+01    0.41000E+01    0.83552E+00
 ARIEXC: peak, lower, upper, distance  493    0.17000E+01    0.31000E+01    0.83145E+00
 ARIEXC: peak, lower, upper, distance  494    0.18000E+01    0.38000E+01    0.86125E+00
 ARIEXC: peak, lower, upper, distance  495    0.19000E+01    0.51000E+01    0.78587E+00
 ARIEXC: peak, lower, upper, distance  496    0.20000E+01    0.60000E+01    0.79558E+00
 ARIEXC: peak, lower, upper, distance  497    0.17000E+01    0.31000E+01    0.87170E+00
 ARIEXC: peak, lower, upper, distance  498    0.19000E+01    0.45000E+01    0.83448E+00
 ARIEXC: peak, lower, upper, distance  499    0.20000E+01    0.60000E+01    0.78465E+00
 ARIEXC: peak, lower, upper, distance  501    0.17000E+01    0.31000E+01    0.85917E+00
 ARIEXC: peak, lower, upper, distance  502    0.18000E+01    0.40000E+01    0.85773E+00
 ARIEXC: peak, lower, upper, distance  503    0.19000E+01    0.53000E+01    0.80031E+00
 ARIEXC: peak, lower, upper, distance  504    0.20000E+01    0.60000E+01    0.85604E+00
 ARIEXC: peak, lower, upper, distance  505    0.20000E+01    0.52000E+01    0.86227E+00
 ARIEXC: peak, lower, upper, distance  507    0.18000E+01    0.40000E+01    0.83165E+00
 ARIEXC: peak, lower, upper, distance  509    0.18000E+01    0.36000E+01    0.86013E+00
 ARIEXC: peak, lower, upper, distance  511    0.20000E+01    0.60000E+01    0.81423E+00
 ARIEXC: peak, lower, upper, distance  519    0.19000E+01    0.39000E+01    0.86243E+00
 ARIEXC: peak, lower, upper, distance  520    0.17000E+01    0.33000E+01    0.86240E+00
 ARIEXC: peak, lower, upper, distance  521    0.17000E+01    0.31000E+01    0.86046E+00
 ARIEXC: peak, lower, upper, distance  526    0.20000E+01    0.60000E+01    0.80109E+00
 ARIEXC: peak, lower, upper, distance  529    0.20000E+01    0.56000E+01    0.81477E+00
 ARIEXC: peak, lower, upper, distance  531    0.20000E+01    0.52000E+01    0.83749E+00
 ARIEXC: peak, lower, upper, distance  532    0.20000E+01    0.60000E+01    0.75114E+00
 ARIEXC: peak, lower, upper, distance  534    0.20000E+01    0.60000E+01    0.73537E+00
 ARIEXC: peak, lower, upper, distance  535    0.18000E+01    0.60000E+01    0.77890E+00
 ARIEXC: peak, lower, upper, distance  541    0.17000E+01    0.31000E+01    0.87038E+00
 ARIEXC: peak, lower, upper, distance  542    0.20000E+01    0.46000E+01    0.83536E+00
 ARIEXC: peak, lower, upper, distance  543    0.20000E+01    0.56000E+01    0.80224E+00
 ARIEXC: peak, lower, upper, distance  548    0.18000E+01    0.36000E+01    0.84086E+00
 ARIEXC: peak, lower, upper, distance  549    0.20000E+01    0.60000E+01    0.79010E+00
 ARIEXC: peak, lower, upper, distance  550    0.20000E+01    0.60000E+01    0.77739E+00
 ARIEXC: peak, lower, upper, distance  551    0.20000E+01    0.54000E+01    0.82427E+00
 ARIEXC: peak, lower, upper, distance  558    0.19000E+01    0.47000E+01    0.83729E+00
 ARIEXC: peak, lower, upper, distance  559    0.19000E+01    0.41000E+01    0.88108E+00
 ARIEXC: peak, lower, upper, distance  560    0.16000E+01    0.60000E+01    0.79610E+00
 ARIEXC: peak, lower, upper, distance  561    0.11000E+01    0.60000E+01    0.76360E+00
 ARIEXC: peak, lower, upper, distance  562    0.17000E+01    0.31000E+01    0.85580E+00
 ARIEXC: peak, lower, upper, distance  563    0.18000E+01    0.36000E+01    0.83160E+00
 ARIEXC: peak, lower, upper, distance  566    0.19000E+01    0.60000E+01    0.77733E+00
 ARIEXC: peak, lower, upper, distance  567    0.16000E+01    0.60000E+01    0.77000E+00
 ARIEXC: peak, lower, upper, distance  568    0.20000E+01    0.58000E+01    0.81757E+00
 ARIEXC: peak, lower, upper, distance  569    0.20000E+01    0.58000E+01    0.83701E+00
 ARIEXC: peak, lower, upper, distance  570    0.20000E+01    0.56000E+01    0.84190E+00
 ARIEXC: peak, lower, upper, distance  571    0.19000E+01    0.60000E+01    0.78080E+00
 ARIEXC: peak, lower, upper, distance  572    0.16000E+01    0.60000E+01    0.76696E+00
 ARIEXC: peak, lower, upper, distance  573    0.20000E+01    0.60000E+01    0.83111E+00
 ARIEXC: peak, lower, upper, distance  574    0.17000E+01    0.33000E+01    0.87342E+00
 ARIEXC: peak, lower, upper, distance  575    0.18000E+01    0.34000E+01    0.87294E+00
 ARIEXC: peak, lower, upper, distance  576    0.20000E+01    0.52000E+01    0.81227E+00
 ARIEXC: peak, lower, upper, distance  577    0.19000E+01    0.57000E+01    0.79997E+00
 ARIEXC: peak, lower, upper, distance  578    0.20000E+01    0.56000E+01    0.81184E+00
 ARIEXC: peak, lower, upper, distance  579    0.19000E+01    0.60000E+01    0.79166E+00
 ARIEXC: peak, lower, upper, distance  580    0.20000E+01    0.60000E+01    0.78396E+00
 ARIEXC: peak, lower, upper, distance  581    0.19000E+01    0.60000E+01    0.79846E+00
 ARIEXC: peak, lower, upper, distance  582    0.18000E+01    0.60000E+01    0.75536E+00
 ARIEXC: peak, lower, upper, distance  583    0.16000E+01    0.60000E+01    0.74158E+00
 ARIEXC: peak, lower, upper, distance  584    0.20000E+01    0.60000E+01    0.80959E+00
 ARIEXC: peak, lower, upper, distance  586    0.20000E+01    0.58000E+01    0.81009E+00
 ARIEXC: peak, lower, upper, distance  587    0.20000E+01    0.50000E+01    0.77988E+00
 ARIEXC: peak, lower, upper, distance  588    0.18000E+01    0.38000E+01    0.83325E+00
 ARIEXC: peak, lower, upper, distance  589    0.18000E+01    0.40000E+01    0.86973E+00
 ARIEXC: peak, lower, upper, distance  590    0.20000E+01    0.56000E+01    0.75836E+00
 ARIEXC: peak, lower, upper, distance  591    0.15000E+01    0.60000E+01    0.87643E+00
 ARIEXC: peak, lower, upper, distance  592    0.20000E+01    0.60000E+01    0.83690E+00
 ARIEXC: peak, lower, upper, distance  593    0.20000E+01    0.60000E+01    0.82912E+00
 ARIEXC: peak, lower, upper, distance  594    0.20000E+01    0.52000E+01    0.78648E+00
 ARIEXC: peak, lower, upper, distance  595    0.19000E+01    0.53000E+01    0.84354E+00
 ARIEXC: peak, lower, upper, distance  596    0.20000E+01    0.54000E+01    0.85596E+00
 ARIEXC: peak, lower, upper, distance  597    0.19000E+01    0.47000E+01    0.81042E+00
 ARIEXC: peak, lower, upper, distance  598    0.19000E+01    0.43000E+01    0.79165E+00
 ARIEXC: peak, lower, upper, distance  599    0.13000E+01    0.22000E+01    0.91021E+00
 ARIEXC: peak, lower, upper, distance  601    0.19000E+01    0.60000E+01    0.80124E+00
 ARIEXC: peak, lower, upper, distance  603    0.18000E+01    0.36000E+01    0.87479E+00
 ARIEXC: peak, lower, upper, distance  604    0.19000E+01    0.39000E+01    0.84081E+00
 ARIEXC: peak, lower, upper, distance  605    0.20000E+01    0.60000E+01    0.74713E+00
 ARIEXC: peak, lower, upper, distance  607    0.19000E+01    0.41000E+01    0.85001E+00
 ARIEXC: peak, lower, upper, distance  609    0.18000E+01    0.34000E+01    0.86346E+00
 ARIEXC: peak, lower, upper, distance  610    0.18000E+01    0.42000E+01    0.85085E+00
 ARIEXC: peak, lower, upper, distance  615    0.19000E+01    0.47000E+01    0.83164E+00
 ARIEXC: peak, lower, upper, distance  616    0.19000E+01    0.47000E+01    0.86334E+00
 ARIEXC: peak, lower, upper, distance  617    0.17000E+01    0.33000E+01    0.83234E+00
 ARIEXC: peak, lower, upper, distance  619    0.20000E+01    0.60000E+01    0.77807E+00
 ARIEXC: peak, lower, upper, distance  620    0.20000E+01    0.60000E+01    0.78169E+00
 ARIEXC: peak, lower, upper, distance  623    0.20000E+01    0.60000E+01    0.82362E+00
 ARIEXC: peak, lower, upper, distance  625    0.20000E+01    0.60000E+01    0.86473E+00
 ARIEXC: peak, lower, upper, distance  626    0.15000E+01    0.25000E+01    0.86258E+00
 ARIEXC: peak, lower, upper, distance  628    0.19000E+01    0.45000E+01    0.83201E+00
 ARIEXC: peak, lower, upper, distance  629    0.18000E+01    0.40000E+01    0.80323E+00
 ARIEXC: peak, lower, upper, distance  630    0.20000E+01    0.60000E+01    0.84163E+00
 ARIEXC: peak, lower, upper, distance  631    0.18000E+01    0.40000E+01    0.80475E+00
 ARIEXC: peak, lower, upper, distance  633    0.19000E+01    0.41000E+01    0.85549E+00
 ARIEXC: peak, lower, upper, distance  635    0.19000E+01    0.43000E+01    0.82787E+00
 ARIEXC: peak, lower, upper, distance  638    0.17000E+01    0.33000E+01    0.81095E+00
 ARIEXC: peak, lower, upper, distance  640    0.20000E+01    0.52000E+01    0.80096E+00
 ARIEXC: peak, lower, upper, distance  641    0.20000E+01    0.60000E+01    0.82274E+00
 ARIEXC: peak, lower, upper, distance  642    0.20000E+01    0.54000E+01    0.82105E+00
 ARIEXC: peak, lower, upper, distance  644    0.20000E+01    0.60000E+01    0.79356E+00
 ARIEXC: peak, lower, upper, distance  645    0.12000E+01    0.22000E+01    0.91057E+00
 ARIEXC: peak, lower, upper, distance  647    0.15000E+01    0.27000E+01    0.87110E+00
 ARIEXC: peak, lower, upper, distance  654    0.18000E+01    0.34000E+01    0.86049E+00
 ARIEXC: peak, lower, upper, distance  657    0.20000E+01    0.60000E+01    0.81002E+00
 ARIEXC: peak, lower, upper, distance  658    0.13000E+01    0.22000E+01    0.90976E+00
 ARIEXC: peak, lower, upper, distance  665    0.15000E+01    0.25000E+01    0.85969E+00
 ARIEXC: peak, lower, upper, distance  666    0.20000E+01    0.56000E+01    0.87877E+00
 ARIEXC: peak, lower, upper, distance  667    0.20000E+01    0.60000E+01    0.81399E+00
 ARIEXC: peak, lower, upper, distance  668    0.18000E+01    0.36000E+01    0.87122E+00
 ARIEXC: peak, lower, upper, distance  669    0.20000E+01    0.54000E+01    0.79454E+00
 ARIEXC: peak, lower, upper, distance  670    0.20000E+01    0.48000E+01    0.83009E+00
 ARIEXC: peak, lower, upper, distance  671    0.19000E+01    0.45000E+01    0.87228E+00
 ARIEXC: peak, lower, upper, distance  672    0.17000E+01    0.33000E+01    0.87930E+00
 ARIEXC: peak, lower, upper, distance  673    0.20000E+01    0.56000E+01    0.82434E+00
 ARIEXC: peak, lower, upper, distance  674    0.18000E+01    0.38000E+01    0.84245E+00
 ARIEXC: peak, lower, upper, distance  676    0.20000E+01    0.58000E+01    0.79097E+00
 ARIEXC: peak, lower, upper, distance  677    0.16000E+01    0.60000E+01    0.74415E+00
 ARIEXC: peak, lower, upper, distance  678    0.12000E+01    0.60000E+01    0.76419E+00
 ARIEXC: peak, lower, upper, distance  679    0.15000E+01    0.25000E+01    0.86893E+00
 ARIEXC: peak, lower, upper, distance  680    0.20000E+01    0.60000E+01    0.79913E+00
 ARIEXC: peak, lower, upper, distance  681    0.19000E+01    0.60000E+01    0.79182E+00
 ARIEXC: peak, lower, upper, distance  684    0.18000E+01    0.42000E+01    0.79567E+00
 ARIEXC: peak, lower, upper, distance  685    0.15000E+01    0.60000E+01    0.79792E+00
 ARIEXC: peak, lower, upper, distance  686    0.20000E+01    0.60000E+01    0.77466E+00
 ARIEXC: peak, lower, upper, distance  687    0.14000E+01    0.60000E+01    0.74414E+00
 ARIEXC: peak, lower, upper, distance  688    0.16000E+01    0.28000E+01    0.87893E+00
 ARIEXC: peak, lower, upper, distance  689    0.13000E+01    0.22000E+01    0.90886E+00
 ARIEXC: peak, lower, upper, distance  690    0.17000E+01    0.29000E+01    0.86505E+00
 ARIEXC: peak, lower, upper, distance  696    0.20000E+01    0.60000E+01    0.79505E+00
 ARIEXC: peak, lower, upper, distance  697    0.19000E+01    0.49000E+01    0.83431E+00
 ARIEXC: peak, lower, upper, distance  698    0.19000E+01    0.39000E+01    0.87121E+00
 ARIEXC: peak, lower, upper, distance  699    0.20000E+01    0.54000E+01    0.79315E+00
 ARIEXC: peak, lower, upper, distance  700    0.19000E+01    0.41000E+01    0.84492E+00
 ARIEXC: peak, lower, upper, distance  701    0.18000E+01    0.38000E+01    0.87112E+00
 ARIEXC: peak, lower, upper, distance  702    0.19000E+01    0.39000E+01    0.83042E+00
 ARIEXC: peak, lower, upper, distance  703    0.19000E+01    0.43000E+01    0.85451E+00
 ARIEXC: peak, lower, upper, distance  704    0.19000E+01    0.60000E+01    0.80248E+00
 ARIEXC: peak, lower, upper, distance  706    0.11000E+01    0.60000E+01    0.78651E+00
 ARIEXC: peak, lower, upper, distance  711    0.19000E+01    0.60000E+01    0.82980E+00
 ARIEXC: peak, lower, upper, distance  712    0.14000E+01    0.24000E+01    0.86874E+00
 ARIEXC: peak, lower, upper, distance  713    0.14000E+01    0.22000E+01    0.90907E+00
 ARIEXC: peak, lower, upper, distance  718    0.19000E+01    0.60000E+01    0.80030E+00
 ARIEXC: peak, lower, upper, distance  719    0.20000E+01    0.60000E+01    0.80827E+00
 ARIEXC: peak, lower, upper, distance  722    0.20000E+01    0.60000E+01    0.75509E+00
 ARIEXC: peak, lower, upper, distance  723    0.17000E+01    0.31000E+01    0.86876E+00
 ARIEXC: peak, lower, upper, distance  725    0.20000E+01    0.60000E+01    0.81154E+00
 ARIEXC: peak, lower, upper, distance  728    0.20000E+01    0.54000E+01    0.80129E+00
 ARIEXC: peak, lower, upper, distance  730    0.17000E+01    0.31000E+01    0.86858E+00
 ARIEXC: peak, lower, upper, distance  731    0.20000E+01    0.52000E+01    0.84166E+00
 ARIEXC: peak, lower, upper, distance  732    0.18000E+01    0.60000E+01    0.75513E+00
 ARIEXC: peak, lower, upper, distance  733    0.17000E+01    0.60000E+01    0.77424E+00
 ARIEXC: peak, lower, upper, distance  736    0.15000E+01    0.25000E+01    0.88066E+00
 ARIEXC: peak, lower, upper, distance  738    0.17000E+01    0.31000E+01    0.87018E+00
 ARIEXC: peak, lower, upper, distance  740    0.20000E+01    0.60000E+01    0.77785E+00
 ARIEXC: peak, lower, upper, distance  741    0.20000E+01    0.60000E+01    0.79702E+00
 ARIEXC: peak, lower, upper, distance  743    0.20000E+01    0.56000E+01    0.83163E+00
 ARIEXC: peak, lower, upper, distance  744    0.18000E+01    0.34000E+01    0.84629E+00
 ARIEXC: peak, lower, upper, distance  745    0.16000E+01    0.30000E+01    0.87075E+00
 ARIEXC: peak, lower, upper, distance  748    0.17000E+01    0.35000E+01    0.87814E+00
 ARIEXC: peak, lower, upper, distance  749    0.20000E+01    0.60000E+01    0.83602E+00
 ARIEXC: peak, lower, upper, distance  750    0.18000E+01    0.40000E+01    0.83163E+00
 ARIEXC: peak, lower, upper, distance  752    0.19000E+01    0.39000E+01    0.83968E+00
 ARIEXC: peak, lower, upper, distance  753    0.17000E+01    0.60000E+01    0.78354E+00
 ARIEXC: peak, lower, upper, distance  754    0.19000E+01    0.60000E+01    0.80204E+00
 ARIEXC: peak, lower, upper, distance  758    0.18000E+01    0.38000E+01    0.83334E+00
 ARIEXC: peak, lower, upper, distance  759    0.20000E+01    0.60000E+01    0.79817E+00
 ARIEXC: peak, lower, upper, distance  760    0.19000E+01    0.60000E+01    0.82545E+00
 ARIEXC: peak, lower, upper, distance  761    0.19000E+01    0.43000E+01    0.89243E+00
 ARIEXC: peak, lower, upper, distance  765    0.19000E+01    0.41000E+01    0.79806E+00
 ARIEXC: peak, lower, upper, distance  768    0.19000E+01    0.51000E+01    0.79628E+00
 ARIEXC: peak, lower, upper, distance  769    0.19000E+01    0.60000E+01    0.79249E+00
 ARIEXC: peak, lower, upper, distance  770    0.20000E+01    0.58000E+01    0.82218E+00
 ARIEXC: peak, lower, upper, distance  771    0.16000E+01    0.28000E+01    0.86909E+00
 ARIEXC: peak, lower, upper, distance  772    0.15000E+01    0.27000E+01    0.84897E+00
 ARIEXC: peak, lower, upper, distance  773    0.16000E+01    0.26000E+01    0.87015E+00
 ARIEXC: peak, lower, upper, distance  774    0.19000E+01    0.45000E+01    0.83369E+00
 ARIEXC: peak, lower, upper, distance  775    0.20000E+01    0.46000E+01    0.80157E+00
 ARIEXC: peak, lower, upper, distance  776    0.18000E+01    0.60000E+01    0.77383E+00
 ARIEXC: peak, lower, upper, distance  781    0.16000E+01    0.30000E+01    0.88950E+00
 ARIEXC: peak, lower, upper, distance  783    0.19000E+01    0.41000E+01    0.87219E+00
 ARIEXC: peak, lower, upper, distance  784    0.20000E+01    0.60000E+01    0.80726E+00
 ARIEXC: peak, lower, upper, distance  788    0.18000E+01    0.38000E+01    0.86328E+00
 ARIEXC: peak, lower, upper, distance  789    0.19000E+01    0.43000E+01    0.85539E+00
 ARIEXC: peak, lower, upper, distance  792    0.17000E+01    0.31000E+01    0.83154E+00
 ARIEXC: peak, lower, upper, distance  793    0.19000E+01    0.60000E+01    0.79450E+00
 ARIEXC: peak, lower, upper, distance  794    0.18000E+01    0.60000E+01    0.77739E+00
 ARIEXC: peak, lower, upper, distance  795    0.18000E+01    0.36000E+01    0.86201E+00
 ARIEXC: peak, lower, upper, distance  798    0.13000E+01    0.22000E+01    0.87231E+00
 ARIEXC: peak, lower, upper, distance  802    0.20000E+01    0.60000E+01    0.79862E+00
 ARIEXC: peak, lower, upper, distance  803    0.16000E+01    0.60000E+01    0.75579E+00
 ARIEXC: peak, lower, upper, distance  804    0.15000E+01    0.60000E+01    0.75327E+00
 ARIEXC: peak, lower, upper, distance  805    0.19000E+01    0.41000E+01    0.81441E+00
 ARIEXC: peak, lower, upper, distance  807    0.20000E+01    0.58000E+01    0.79306E+00
 ARIEXC: peak, lower, upper, distance  813    0.19000E+01    0.37000E+01    0.86596E+00
 ARIEXC: peak, lower, upper, distance  814    0.20000E+01    0.60000E+01    0.83502E+00
 ARIEXC: peak, lower, upper, distance  817    0.17000E+01    0.31000E+01    0.85531E+00
 ARIEXC: peak, lower, upper, distance  821    0.15000E+01    0.60000E+01    0.83807E+00
 ARIEXC: peak, lower, upper, distance  826    0.16000E+01    0.28000E+01    0.85537E+00
 ARIEXC: peak, lower, upper, distance  827    0.19000E+01    0.41000E+01    0.83276E+00
 ARIEXC: peak, lower, upper, distance  831    0.19000E+01    0.49000E+01    0.82875E+00
 ARIEXC: peak, lower, upper, distance  832    0.19000E+01    0.39000E+01    0.79871E+00
 ARIEXC: peak, lower, upper, distance  835    0.16000E+01    0.60000E+01    0.79836E+00
 ARIEXC: peak, lower, upper, distance  839    0.20000E+01    0.60000E+01    0.78836E+00
 ARIEXC: peak, lower, upper, distance  845    0.19000E+01    0.60000E+01    0.78388E+00
 ARIEXC: peak, lower, upper, distance  851    0.19000E+01    0.60000E+01    0.79390E+00
 ARIEXC: peak, lower, upper, distance  852    0.18000E+01    0.60000E+01    0.77278E+00
 ARIEXC: peak, lower, upper, distance  853    0.10000E+01    0.60000E+01    0.75457E+00
 ARIEXC: peak, lower, upper, distance  858    0.19000E+01    0.39000E+01    0.80537E+00
 ARIEXC: peak, lower, upper, distance  860    0.20000E+01    0.52000E+01    0.75778E+00
 ARIEXC: peak, lower, upper, distance  861    0.20000E+01    0.54000E+01    0.74021E+00
 ARIEXC: peak, lower, upper, distance  862    0.17000E+01    0.31000E+01    0.85538E+00
 ARIEXC: peak, lower, upper, distance  863    0.18000E+01    0.38000E+01    0.83589E+00
 ARIEXC: peak, lower, upper, distance  865    0.19000E+01    0.60000E+01    0.76272E+00
 ARIEXC: peak, lower, upper, distance  868    0.18000E+01    0.60000E+01    0.78863E+00
 ARIEXC: peak, lower, upper, distance  869    0.20000E+01    0.60000E+01    0.84251E+00
 ARIEXC: peak, lower, upper, distance  872    0.12000E+01    0.22000E+01    0.90860E+00
 ARIEXC: peak, lower, upper, distance  875    0.19000E+01    0.51000E+01    0.87266E+00
 ARIEXC: peak, lower, upper, distance  876    0.19000E+01    0.43000E+01    0.84068E+00
 ARIEXC: peak, lower, upper, distance  877    0.19000E+01    0.60000E+01    0.79721E+00
 ARIEXC: peak, lower, upper, distance  886    0.19000E+01    0.60000E+01    0.77150E+00
 ARIEXC: peak, lower, upper, distance    1    0.19000E+01    0.43000E+01    0.83386E+00
 ARIEXC: peak, lower, upper, distance    1    0.17000E+01    0.29000E+01    0.87219E+00
 ARIEXC: peak, lower, upper, distance    2    0.17000E+01    0.29000E+01    0.84524E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.43000E+01    0.85401E+00
 ARIEXC: peak, lower, upper, distance    5    0.16000E+01    0.28000E+01    0.87611E+00
 ARIEXC: peak, lower, upper, distance    6    0.17000E+01    0.60000E+01    0.75888E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.60000E+01    0.82436E+00
 ARIEXC: peak, lower, upper, distance    8    0.17000E+01    0.60000E+01    0.77287E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.50000E+01    0.80282E+00
 ARIEXC: peak, lower, upper, distance   10    0.20000E+01    0.60000E+01    0.83807E+00
 ARIEXC: peak, lower, upper, distance   11    0.19000E+01    0.60000E+01    0.77278E+00
 ARIEXC: peak, lower, upper, distance   13    0.19000E+01    0.45000E+01    0.87877E+00
 ARIEXC: peak, lower, upper, distance   14    0.20000E+01    0.60000E+01    0.86687E+00
 ARIEXC: peak, lower, upper, distance   15    0.20000E+01    0.56000E+01    0.83634E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.60000E+01    0.77586E+00
 ARIEXC: peak, lower, upper, distance   17    0.20000E+01    0.48000E+01    0.84773E+00
 ARIEXC: peak, lower, upper, distance   18    0.19000E+01    0.39000E+01    0.83718E+00
 ARIEXC: peak, lower, upper, distance   19    0.20000E+01    0.58000E+01    0.81399E+00
 ARIEXC: peak, lower, upper, distance   20    0.20000E+01    0.50000E+01    0.82868E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.47000E+01    0.81426E+00
 ARIEXC: peak, lower, upper, distance   22    0.16000E+01    0.28000E+01    0.87118E+00
 ARIEXC: peak, lower, upper, distance   23    0.19000E+01    0.53000E+01    0.80924E+00
 ARIEXC: peak, lower, upper, distance   25    0.18000E+01    0.60000E+01    0.76602E+00
 ARIEXC: peak, lower, upper, distance   27    0.20000E+01    0.60000E+01    0.77494E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.60000E+01    0.80836E+00
 ARIEXC: peak, lower, upper, distance   29    0.20000E+01    0.60000E+01    0.78574E+00
 ARIEXC: peak, lower, upper, distance   30    0.20000E+01    0.60000E+01    0.79632E+00
 ARIEXC: peak, lower, upper, distance   33    0.16000E+01    0.30000E+01    0.87534E+00
 ARIEXC: peak, lower, upper, distance   34    0.20000E+01    0.50000E+01    0.83609E+00
 ARIEXC: peak, lower, upper, distance   35    0.20000E+01    0.60000E+01    0.80332E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.60000E+01    0.78805E+00
 ARIEXC: peak, lower, upper, distance   37    0.20000E+01    0.48000E+01    0.83286E+00
 ARIEXC: peak, lower, upper, distance   38    0.20000E+01    0.58000E+01    0.78854E+00
 ARIEXC: peak, lower, upper, distance   39    0.19000E+01    0.47000E+01    0.79800E+00
 ARIEXC: peak, lower, upper, distance   40    0.20000E+01    0.60000E+01    0.78251E+00
 ARIEXC: peak, lower, upper, distance   41    0.19000E+01    0.60000E+01    0.78076E+00
 ARIEXC: peak, lower, upper, distance   43    0.15000E+01    0.27000E+01    0.86913E+00
 ARIEXC: peak, lower, upper, distance   44    0.18000E+01    0.38000E+01    0.83706E+00
 ARIEXC: peak, lower, upper, distance   45    0.19000E+01    0.60000E+01    0.79814E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.60000E+01    0.79390E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.77773E+00
 ARIEXC: peak, lower, upper, distance   49    0.19000E+01    0.41000E+01    0.84731E+00
 ARIEXC: peak, lower, upper, distance   50    0.15000E+01    0.23000E+01    0.87934E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.50000E+01    0.78983E+00
 ARIEXC: peak, lower, upper, distance   53    0.20000E+01    0.50000E+01    0.80662E+00
 ARIEXC: peak, lower, upper, distance   54    0.20000E+01    0.46000E+01    0.84397E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.60000E+01    0.78195E+00
 ARIEXC: peak, lower, upper, distance   56    0.19000E+01    0.60000E+01    0.78125E+00
 ARIEXC: peak, lower, upper, distance   57    0.18000E+01    0.38000E+01    0.83521E+00
 ARIEXC: peak, lower, upper, distance   58    0.16000E+01    0.28000E+01    0.86686E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.60000E+01    0.80541E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.60000E+01    0.82192E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.48000E+01    0.88785E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.43000E+01    0.80229E+00
 ARIEXC: peak, lower, upper, distance   65    0.12000E+01    0.22000E+01    0.91311E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.60000E+01    0.82169E+00
 ARIEXC: peak, lower, upper, distance   68    0.19000E+01    0.51000E+01    0.89288E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.48000E+01    0.83650E+00
 ARIEXC: peak, lower, upper, distance   71    0.20000E+01    0.58000E+01    0.81145E+00
 ARIEXC: peak, lower, upper, distance   72    0.13000E+01    0.22000E+01    0.91298E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.60000E+01    0.82434E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.43000E+01    0.84245E+00
 ARIEXC: peak, lower, upper, distance   78    0.19000E+01    0.60000E+01    0.75394E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.60000E+01    0.81131E+00
 ARIEXC: peak, lower, upper, distance   80    0.19000E+01    0.60000E+01    0.81543E+00
 ARIEXC: peak, lower, upper, distance   81    0.20000E+01    0.54000E+01    0.77186E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.60000E+01    0.79997E+00
 ARIEXC: peak, lower, upper, distance   83    0.17000E+01    0.31000E+01    0.87294E+00
 ARIEXC: peak, lower, upper, distance   84    0.20000E+01    0.50000E+01    0.82976E+00
 ARIEXC: peak, lower, upper, distance   85    0.20000E+01    0.56000E+01    0.80247E+00
 ARIEXC: peak, lower, upper, distance   87    0.15000E+01    0.25000E+01    0.88067E+00
 ARIEXC: peak, lower, upper, distance   88    0.19000E+01    0.39000E+01    0.83662E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.46000E+01    0.83349E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.40000E+01    0.80746E+00
 ARIEXC: peak, lower, upper, distance   92    0.20000E+01    0.60000E+01    0.78670E+00
 ARIEXC: peak, lower, upper, distance   93    0.20000E+01    0.60000E+01    0.85627E+00
 ARIEXC: peak, lower, upper, distance   94    0.19000E+01    0.45000E+01    0.85674E+00
 ARIEXC: peak, lower, upper, distance   95    0.20000E+01    0.56000E+01    0.84026E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.50000E+01    0.81226E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.56000E+01    0.88144E+00
 ARIEXC: peak, lower, upper, distance   98    0.20000E+01    0.48000E+01    0.85552E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.77753E+00
 ARIEXC: peak, lower, upper, distance  101    0.20000E+01    0.60000E+01    0.78708E+00
 ARIEXC: peak, lower, upper, distance  103    0.18000E+01    0.42000E+01    0.84003E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.56000E+01    0.81488E+00
 ARIEXC: peak, lower, upper, distance  105    0.17000E+01    0.60000E+01    0.76852E+00
 ARIEXC: peak, lower, upper, distance  106    0.20000E+01    0.60000E+01    0.79200E+00
 ARIEXC: peak, lower, upper, distance  107    0.20000E+01    0.60000E+01    0.78863E+00
 ARIEXC: peak, lower, upper, distance  108    0.17000E+01    0.31000E+01    0.86162E+00
 ARIEXC: peak, lower, upper, distance  109    0.18000E+01    0.36000E+01    0.86596E+00
 ARIEXC: peak, lower, upper, distance  110    0.20000E+01    0.48000E+01    0.82875E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.78388E+00
 ARIEXC: peak, lower, upper, distance  113    0.16000E+01    0.28000E+01    0.85628E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.75514E+00
 ARIEXC: peak, lower, upper, distance  115    0.19000E+01    0.47000E+01    0.81141E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.83487E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.86285E+00
 ARIEXC: peak, lower, upper, distance  118    0.19000E+01    0.60000E+01    0.75899E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.43000E+01    0.83940E+00
 ARIEXC: peak, lower, upper, distance  120    0.20000E+01    0.60000E+01    0.80002E+00
 ARIEXC: peak, lower, upper, distance  122    0.16000E+01    0.60000E+01    0.74679E+00
 ARIEXC: peak, lower, upper, distance  123    0.14000E+01    0.24000E+01    0.91288E+00
 ARIEXC: peak, lower, upper, distance  124    0.19000E+01    0.60000E+01    0.74360E+00
 ARIEXC: peak, lower, upper, distance  125    0.20000E+01    0.50000E+01    0.80211E+00
 ARIEXC: peak, lower, upper, distance  126    0.20000E+01    0.52000E+01    0.81200E+00
 ARIEXC: peak, lower, upper, distance  127    0.20000E+01    0.56000E+01    0.77551E+00
 ARIEXC: peak, lower, upper, distance  128    0.17000E+01    0.33000E+01    0.85815E+00
 ARIEXC: peak, lower, upper, distance  130    0.18000E+01    0.40000E+01    0.83766E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.82961E+00
 ARIEXC: peak, lower, upper, distance  132    0.20000E+01    0.50000E+01    0.81436E+00
 ARIEXC: peak, lower, upper, distance  133    0.17000E+01    0.35000E+01    0.84577E+00
 ARIEXC: peak, lower, upper, distance  134    0.19000E+01    0.51000E+01    0.80611E+00
 ARIEXC: peak, lower, upper, distance  135    0.19000E+01    0.39000E+01    0.84781E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.43000E+01    0.82309E+00
 ARIEXC: peak, lower, upper, distance  137    0.19000E+01    0.41000E+01    0.84431E+00
 ARIEXC: peak, lower, upper, distance  138    0.16000E+01    0.28000E+01    0.88160E+00
 ARIEXC: peak, lower, upper, distance  139    0.18000E+01    0.34000E+01    0.84938E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.60000E+01    0.78151E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.56000E+01    0.80613E+00
 ARIEXC: peak, lower, upper, distance  142    0.19000E+01    0.60000E+01    0.76165E+00
 ARIEXC: peak, lower, upper, distance  143    0.20000E+01    0.60000E+01    0.77787E+00
 ARIEXC: peak, lower, upper, distance  144    0.19000E+01    0.45000E+01    0.79080E+00
 ARIEXC: peak, lower, upper, distance  145    0.19000E+01    0.60000E+01    0.76785E+00
 ARIEXC: peak, lower, upper, distance  146    0.19000E+01    0.41000E+01    0.84576E+00
 ARIEXC: peak, lower, upper, distance  147    0.15000E+01    0.25000E+01    0.88066E+00
 ARIEXC: peak, lower, upper, distance  148    0.18000E+01    0.38000E+01    0.83581E+00
 ARIEXC: peak, lower, upper, distance  149    0.19000E+01    0.60000E+01    0.78271E+00
 ARIEXC: peak, lower, upper, distance  150    0.19000E+01    0.60000E+01    0.80426E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.45000E+01    0.84927E+00
 ARIEXC: peak, lower, upper, distance  152    0.20000E+01    0.60000E+01    0.74840E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.56000E+01    0.77497E+00
 ARIEXC: peak, lower, upper, distance  155    0.19000E+01    0.41000E+01    0.83941E+00
 ARIEXC: peak, lower, upper, distance  156    0.19000E+01    0.41000E+01    0.83580E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.60000E+01    0.76711E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.84631E+00
 ARIEXC: peak, lower, upper, distance  159    0.18000E+01    0.40000E+01    0.79660E+00
 ARIEXC: peak, lower, upper, distance  160    0.19000E+01    0.47000E+01    0.83413E+00
 ARIEXC: peak, lower, upper, distance  161    0.20000E+01    0.48000E+01    0.80759E+00
 ARIEXC: peak, lower, upper, distance  162    0.19000E+01    0.60000E+01    0.75084E+00
 ARIEXC: peak, lower, upper, distance  163    0.19000E+01    0.43000E+01    0.83878E+00
 ARIEXC: peak, lower, upper, distance  166    0.16000E+01    0.28000E+01    0.87068E+00
 ARIEXC: peak, lower, upper, distance  167    0.19000E+01    0.45000E+01    0.83546E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.60000E+01    0.78924E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.56000E+01    0.84256E+00
 ARIEXC: peak, lower, upper, distance  170    0.20000E+01    0.52000E+01    0.80795E+00
 ARIEXC: peak, lower, upper, distance  171    0.20000E+01    0.60000E+01    0.74899E+00
 ARIEXC: peak, lower, upper, distance  172    0.19000E+01    0.45000E+01    0.82344E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.56000E+01    0.77233E+00
 ARIEXC: peak, lower, upper, distance  175    0.20000E+01    0.60000E+01    0.81113E+00
 ARIEXC: peak, lower, upper, distance  176    0.16000E+01    0.26000E+01    0.87439E+00
 ARIEXC: peak, lower, upper, distance  177    0.18000E+01    0.40000E+01    0.83532E+00
 ARIEXC: peak, lower, upper, distance  179    0.18000E+01    0.36000E+01    0.83926E+00
 ARIEXC: peak, lower, upper, distance  180    0.20000E+01    0.60000E+01    0.79440E+00
 ARIEXC: peak, lower, upper, distance  181    0.18000E+01    0.60000E+01    0.78421E+00
 ARIEXC: peak, lower, upper, distance  182    0.18000E+01    0.38000E+01    0.85139E+00
 ARIEXC: peak, lower, upper, distance  183    0.19000E+01    0.39000E+01    0.85318E+00
 ARIEXC: peak, lower, upper, distance  184    0.18000E+01    0.34000E+01    0.87844E+00
 ARIEXC: peak, lower, upper, distance  185    0.20000E+01    0.50000E+01    0.83813E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.54000E+01    0.80795E+00
 ARIEXC: peak, lower, upper, distance  187    0.18000E+01    0.34000E+01    0.85395E+00
 ARIEXC: peak, lower, upper, distance  188    0.19000E+01    0.60000E+01    0.82655E+00
 ARIEXC: peak, lower, upper, distance  189    0.19000E+01    0.60000E+01    0.80771E+00
 ARIEXC: peak, lower, upper, distance  190    0.20000E+01    0.52000E+01    0.81743E+00
 ARIEXC: peak, lower, upper, distance  191    0.19000E+01    0.39000E+01    0.83777E+00
 ARIEXC: peak, lower, upper, distance  192    0.18000E+01    0.40000E+01    0.81633E+00
 ARIEXC: peak, lower, upper, distance  196    0.19000E+01    0.43000E+01    0.83552E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.80860E+00
 ARIEXC: peak, lower, upper, distance  198    0.19000E+01    0.45000E+01    0.85618E+00
 ARIEXC: peak, lower, upper, distance  199    0.19000E+01    0.43000E+01    0.83629E+00
 ARIEXC: peak, lower, upper, distance  200    0.20000E+01    0.54000E+01    0.86879E+00
 ARIEXC: peak, lower, upper, distance  201    0.20000E+01    0.56000E+01    0.82018E+00
 ARIEXC: peak, lower, upper, distance  202    0.19000E+01    0.43000E+01    0.84737E+00
 ARIEXC: peak, lower, upper, distance  203    0.20000E+01    0.56000E+01    0.82169E+00
 ARIEXC: peak, lower, upper, distance  204    0.20000E+01    0.56000E+01    0.80519E+00
 ARIEXC: peak, lower, upper, distance  205    0.16000E+01    0.28000E+01    0.87170E+00
 ARIEXC: peak, lower, upper, distance  206    0.19000E+01    0.60000E+01    0.75472E+00
 ARIEXC: peak, lower, upper, distance  207    0.20000E+01    0.60000E+01    0.76630E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.46000E+01    0.81423E+00
 ARIEXC: peak, lower, upper, distance  209    0.19000E+01    0.47000E+01    0.81781E+00
 ARIEXC: peak, lower, upper, distance  211    0.19000E+01    0.41000E+01    0.83602E+00
 ARIEXC: peak, lower, upper, distance  212    0.18000E+01    0.34000E+01    0.83448E+00
 ARIEXC: peak, lower, upper, distance  213    0.20000E+01    0.60000E+01    0.79485E+00
 ARIEXC: peak, lower, upper, distance  214    0.20000E+01    0.60000E+01    0.77590E+00
 ARIEXC: peak, lower, upper, distance  215    0.20000E+01    0.50000E+01    0.86449E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.60000E+01    0.77730E+00
 ARIEXC: peak, lower, upper, distance  217    0.19000E+01    0.60000E+01    0.77786E+00
 ARIEXC: peak, lower, upper, distance  218    0.20000E+01    0.46000E+01    0.83536E+00
 ARIEXC: peak, lower, upper, distance  219    0.16000E+01    0.30000E+01    0.87814E+00
 ARIEXC: peak, lower, upper, distance  220    0.20000E+01    0.48000E+01    0.80343E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.43000E+01    0.83749E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.47000E+01    0.82427E+00
 ARIEXC: peak, lower, upper, distance  224    0.17000E+01    0.33000E+01    0.87038E+00
 ARIEXC: peak, lower, upper, distance  225    0.19000E+01    0.47000E+01    0.84707E+00
 ARIEXC: peak, lower, upper, distance  226    0.19000E+01    0.60000E+01    0.77733E+00
 ARIEXC: peak, lower, upper, distance  227    0.19000E+01    0.47000E+01    0.81757E+00
 ARIEXC: peak, lower, upper, distance  228    0.20000E+01    0.60000E+01    0.77739E+00
 ARIEXC: peak, lower, upper, distance  230    0.19000E+01    0.41000E+01    0.84143E+00
 ARIEXC: peak, lower, upper, distance  231    0.19000E+01    0.51000E+01    0.87643E+00
 ARIEXC: peak, lower, upper, distance  232    0.20000E+01    0.52000E+01    0.83690E+00
 ARIEXC: peak, lower, upper, distance  233    0.19000E+01    0.60000E+01    0.78589E+00
 ARIEXC: peak, lower, upper, distance  234    0.19000E+01    0.60000E+01    0.82335E+00
 ARIEXC: peak, lower, upper, distance  237    0.17000E+01    0.35000E+01    0.84993E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.75610E+00
 ARIEXC: peak, lower, upper, distance  239    0.18000E+01    0.36000E+01    0.84081E+00
 ARIEXC: peak, lower, upper, distance  240    0.20000E+01    0.50000E+01    0.84354E+00
 ARIEXC: peak, lower, upper, distance  241    0.19000E+01    0.43000E+01    0.79165E+00
 ARIEXC: peak, lower, upper, distance  242    0.17000E+01    0.33000E+01    0.87342E+00
 ARIEXC: peak, lower, upper, distance  243    0.20000E+01    0.60000E+01    0.78080E+00
 ARIEXC: peak, lower, upper, distance  245    0.19000E+01    0.49000E+01    0.78169E+00
 ARIEXC: peak, lower, upper, distance  246    0.17000E+01    0.31000E+01    0.87479E+00
 ARIEXC: peak, lower, upper, distance  247    0.18000E+01    0.60000E+01    0.76530E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.47000E+01    0.84163E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.36000E+01    0.85539E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.78373E+00
 ARIEXC: peak, lower, upper, distance  253    0.15000E+01    0.27000E+01    0.87930E+00
 ARIEXC: peak, lower, upper, distance  255    0.19000E+01    0.45000E+01    0.80827E+00
 ARIEXC: peak, lower, upper, distance  256    0.20000E+01    0.50000E+01    0.79635E+00
 ARIEXC: peak, lower, upper, distance  257    0.18000E+01    0.34000E+01    0.84003E+00
 ARIEXC: peak, lower, upper, distance  258    0.20000E+01    0.58000E+01    0.80225E+00
 ARIEXC: peak, lower, upper, distance  259    0.20000E+01    0.56000E+01    0.89402E+00
 ARIEXC: peak, lower, upper, distance  260    0.19000E+01    0.43000E+01    0.80752E+00
 ARIEXC: peak, lower, upper, distance  262    0.18000E+01    0.38000E+01    0.83805E+00
 ARIEXC: peak, lower, upper, distance  264    0.18000E+01    0.36000E+01    0.83302E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.60000E+01    0.77599E+00
 ARIEXC: peak, lower, upper, distance  266    0.17000E+01    0.60000E+01    0.78782E+00
 ARIEXC: peak, lower, upper, distance    1    0.20000E+01    0.52000E+01    0.84109E+00
 ARIEXC: peak, lower, upper, distance    2    0.16000E+01    0.30000E+01    0.86117E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.60000E+01    0.78540E+00
 ARIEXC: peak, lower, upper, distance    4    0.11000E+01    0.60000E+01    0.74092E+00
 ARIEXC: peak, lower, upper, distance    5    0.20000E+01    0.58000E+01    0.79075E+00
 ARIEXC: peak, lower, upper, distance    6    0.20000E+01    0.60000E+01    0.75114E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.50000E+01    0.80987E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.60000E+01    0.75981E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.56000E+01    0.84114E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.60000E+01    0.76779E+00
 ARIEXC: peak, lower, upper, distance   12    0.19000E+01    0.60000E+01    0.79274E+00
 ARIEXC: peak, lower, upper, distance   13    0.18000E+01    0.36000E+01    0.83979E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.75038E+00
 ARIEXC: peak, lower, upper, distance   16    0.18000E+01    0.60000E+01    0.79055E+00
 ARIEXC: peak, lower, upper, distance   17    0.17000E+01    0.35000E+01    0.81526E+00
 ARIEXC: peak, lower, upper, distance   20    0.19000E+01    0.60000E+01    0.76942E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.60000E+01    0.77579E+00
 ARIEXC: peak, lower, upper, distance   24    0.19000E+01    0.49000E+01    0.82087E+00
 ARIEXC: peak, lower, upper, distance   25    0.14000E+01    0.24000E+01    0.84471E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.85045E+00
 ARIEXC: peak, lower, upper, distance   42    0.20000E+01    0.58000E+01    0.79813E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.60000E+01    0.74690E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.43000E+01    0.80448E+00
 ARIEXC: peak, lower, upper, distance   56    0.20000E+01    0.60000E+01    0.75764E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.58000E+01    0.76532E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.58000E+01    0.76612E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.80039E+00
 ARIEXC: peak, lower, upper, distance   66    0.20000E+01    0.46000E+01    0.82451E+00
 ARIEXC: peak, lower, upper, distance   67    0.20000E+01    0.52000E+01    0.80195E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.33000E+01    0.86066E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.47000E+01    0.81710E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.60000E+01    0.79117E+00
 ARIEXC: peak, lower, upper, distance   71    0.17000E+01    0.33000E+01    0.86935E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.79439E+00
 ARIEXC: peak, lower, upper, distance   73    0.16000E+01    0.26000E+01    0.85729E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.52000E+01    0.83830E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.60000E+01    0.76246E+00
 ARIEXC: peak, lower, upper, distance   77    0.16000E+01    0.28000E+01    0.86181E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.58000E+01    0.80224E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.56000E+01    0.79198E+00
 ARIEXC: peak, lower, upper, distance   80    0.17000E+01    0.33000E+01    0.81521E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.50000E+01    0.80287E+00
 ARIEXC: peak, lower, upper, distance   83    0.19000E+01    0.60000E+01    0.73537E+00
 ARIEXC: peak, lower, upper, distance   84    0.17000E+01    0.35000E+01    0.86174E+00
 ARIEXC: peak, lower, upper, distance   85    0.19000E+01    0.41000E+01    0.78082E+00
 ARIEXC: peak, lower, upper, distance   86    0.20000E+01    0.54000E+01    0.84534E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.54000E+01    0.77000E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.78460E+00
 ARIEXC: peak, lower, upper, distance   91    0.18000E+01    0.40000E+01    0.86697E+00
 ARIEXC: peak, lower, upper, distance   93    0.19000E+01    0.39000E+01    0.85420E+00
 ARIEXC: peak, lower, upper, distance   95    0.19000E+01    0.39000E+01    0.83435E+00
 ARIEXC: peak, lower, upper, distance   96    0.18000E+01    0.60000E+01    0.78215E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.60000E+01    0.75707E+00
 ARIEXC: peak, lower, upper, distance   98    0.17000E+01    0.33000E+01    0.84729E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.79922E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.45000E+01    0.90317E+00
 ARIEXC: peak, lower, upper, distance  102    0.18000E+01    0.38000E+01    0.80157E+00
 ARIEXC: peak, lower, upper, distance  103    0.19000E+01    0.60000E+01    0.76207E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.46000E+01    0.85432E+00
 ARIEXC: peak, lower, upper, distance  105    0.20000E+01    0.60000E+01    0.77449E+00
 ARIEXC: peak, lower, upper, distance  106    0.19000E+01    0.43000E+01    0.85596E+00
 ARIEXC: peak, lower, upper, distance  107    0.18000E+01    0.40000E+01    0.81042E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.74110E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.78648E+00
 ARIEXC: peak, lower, upper, distance  112    0.19000E+01    0.60000E+01    0.82912E+00
 ARIEXC: peak, lower, upper, distance  113    0.20000E+01    0.54000E+01    0.76272E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.78508E+00
 ARIEXC: peak, lower, upper, distance  115    0.18000E+01    0.40000E+01    0.86089E+00
 ARIEXC: peak, lower, upper, distance  116    0.20000E+01    0.50000E+01    0.78402E+00
 ARIEXC: peak, lower, upper, distance  117    0.20000E+01    0.60000E+01    0.83346E+00
 COUNTV:  839 violations above         0.10000
 ARIA>      end 
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_10.float opened.
 ARIA> REVE ((segid "    " and resid 3    and name HG1 ) OR   ( segid "    " and resid 3    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HB1 ) OR   ( segid "    " and resid 6    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HB1 ) OR   ( segid "    " and resid 7    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HG1 ) OR   ( segid "    " and resid 7    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HD1 ) OR   ( segid "    " and resid 7    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HB1 ) OR   ( segid "    " and resid 8    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HD1 ) OR   ( segid "    " and resid 8    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 9    and name HA1 ) OR   ( segid "    " and resid 9    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HB1 ) OR   ( segid "    " and resid 11   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH11) OR   ( segid "    " and resid 13   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 15   and name HB1 ) OR   ( segid "    " and resid 15   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HB1 ) OR   ( segid "    " and resid 19   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HD1 ) OR   ( segid "    " and resid 19   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HH11) OR   ( segid "    " and resid 19   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 24   and name HD21) OR   ( segid "    " and resid 24   and name HD22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 27   and name HB1 ) OR   ( segid "    " and resid 27   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HG1 ) OR   ( segid "    " and resid 28   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH21) OR   ( segid "    " and resid 28   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 32   and name HB1 ) OR   ( segid "    " and resid 32   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HB1 ) OR   ( segid "    " and resid 33   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HG1 ) OR   ( segid "    " and resid 33   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HE1 ) OR   ( segid "    " and resid 33   and name HE2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HG1 ) OR   ( segid "    " and resid 34   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH11) OR   ( segid "    " and resid 34   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HB1 ) OR   ( segid "    " and resid 38   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HG1 ) OR   ( segid "    " and resid 38   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($count=$count+1) 
 EVALUATE: symbol $COUNT set to    6.00000     (real)
 CNSsolve>end loop main 
 CNSsolve>while ($count le $Iterations.Assignstruct) loop main 
 NEXTCD: condition evaluated as true
 CNSsolve>   evaluate ($file = $filenames.bestfile_$count) 
 EVALUATE: symbol $FILE set to "PREVIT:ww1_6.pdb" (string)
 CNSsolve>   display $file 
PREVIT:ww1_6.pdb
 CNSsolve>   coor init end 
 COOR: selected main coordinates initialized
 CNSsolve>   if ($file ne "") then 
 NEXTCD: condition evaluated as true
 CNSsolve>      coor @@$file 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_6.pdb opened.
 COOR>REMARK FILENAME="/usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_6.pdb" 
 COOR>REMARK =============================================================== 
 COOR>REMARK            overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK energies: 248.14, 2.50939, 19.5914, 3.12278, 178.822, 30.785, 0, 11.0822, 2.22776, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK            bonds,angles,impropers,dihe,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK rms-dev.: 1.98948E-03,0.335465,0.242727,41.6654,1.567955E-02,0.808068,0,0,0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK               noe,cdih,coup,sani,dani,vean 
 COOR>REMARK               >0.3,>5,>1,>0,>5 
 COOR>REMARK violations.: 0, 0, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK DATE:02-Mar-2010  14:01:05       created by user: fkieken 
 COOR>REMARK VERSION:1.1 
 COOR>ATOM      1  HA1 GLY     1       1.878   7.144  11.211  1.00  0.00 
 COOR>ATOM      2  HA2 GLY     1       0.192   7.408  11.629  1.00  0.00 
 CNSsolve>      eval ($floatfile = $file - ".pdb" + ".float") 
 EVALUATE: symbol $FLOATFILE set to "PREVIT:ww1_6.float" (string)
 CNSsolve>      fileexist $floatfile end  eval ($qfloatfile = $result) 
 MISCOM: file exists
 EVALUATE: symbol $QFLOATFILE set to TRUE (logical)
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_6.float opened.
 ARIA> REVE ((segid "    " and resid 2    and name HB1 ) OR   ( segid "    " and resid 2    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HB1 ) OR   ( segid "    " and resid 3    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 4    and name HB1 ) OR   ( segid "    " and resid 4    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HB1 ) OR   ( segid "    " and resid 5    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HD11) OR   ( segid "    " and resid 6    and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HB1 ) OR   ( segid "    " and resid 7    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HG1 ) OR   ( segid "    " and resid 7    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HD1 ) OR   ( segid "    " and resid 7    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HB1 ) OR   ( segid "    " and resid 8    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HG1 ) OR   ( segid "    " and resid 11   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HB1 ) OR   ( segid "    " and resid 12   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HG1 ) OR   ( segid "    " and resid 12   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH11) OR   ( segid "    " and resid 13   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH21) OR   ( segid "    " and resid 13   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 15   and name HB1 ) OR   ( segid "    " and resid 15   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 16   and name HG11) OR   ( segid "    " and resid 16   and name HG21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HB1 ) OR   ( segid "    " and resid 19   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HD1 ) OR   ( segid "    " and resid 19   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HH11) OR   ( segid "    " and resid 19   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HH21) OR   ( segid "    " and resid 19   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 24   and name HD21) OR   ( segid "    " and resid 24   and name HD22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HG1 ) OR   ( segid "    " and resid 26   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 27   and name HB1 ) OR   ( segid "    " and resid 27   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HD1 ) OR   ( segid "    " and resid 28   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH21) OR   ( segid "    " and resid 28   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 32   and name HB1 ) OR   ( segid "    " and resid 32   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HG1 ) OR   ( segid "    " and resid 33   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HB1 ) OR   ( segid "    " and resid 34   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HG1 ) OR   ( segid "    " and resid 34   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HD1 ) OR   ( segid "    " and resid 34   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH11) OR   ( segid "    " and resid 34   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 36   and name HB1 ) OR   ( segid "    " and resid 36   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HB1 ) OR   ( segid "    " and resid 38   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HG1 ) OR   ( segid "    " and resid 38   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>      aria 
 ARIA>         analyse_restraints aver end 
DISACC: accumulating distance matrix with dimension  269
 AMBVAC: read in   990 distances in mode ACCU
 ARIA>         countvio threshold $Iterations.violtoler end 
 ARIEXC: peak, lower, upper, distance    1    0.18000E+01    0.36000E+01    0.84315E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.48000E+01    0.86404E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.45000E+01    0.83915E+00
 ARIEXC: peak, lower, upper, distance    5    0.19000E+01    0.47000E+01    0.83148E+00
 ARIEXC: peak, lower, upper, distance    6    0.18000E+01    0.36000E+01    0.85998E+00
 ARIEXC: peak, lower, upper, distance    7    0.19000E+01    0.53000E+01    0.81402E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.43000E+01    0.83043E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.54000E+01    0.75566E+00
 ARIEXC: peak, lower, upper, distance   13    0.20000E+01    0.58000E+01    0.83963E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.86792E+00
 ARIEXC: peak, lower, upper, distance   15    0.18000E+01    0.36000E+01    0.86538E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.45000E+01    0.85719E+00
 ARIEXC: peak, lower, upper, distance   17    0.19000E+01    0.60000E+01    0.80772E+00
 ARIEXC: peak, lower, upper, distance   21    0.13000E+01    0.22000E+01    0.91038E+00
 ARIEXC: peak, lower, upper, distance   23    0.13000E+01    0.60000E+01    0.89338E+00
 ARIEXC: peak, lower, upper, distance   24    0.20000E+01    0.60000E+01    0.80256E+00
 ARIEXC: peak, lower, upper, distance   26    0.15000E+01    0.27000E+01    0.87596E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.43000E+01    0.84786E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.87312E+00
 ARIEXC: peak, lower, upper, distance   30    0.18000E+01    0.38000E+01    0.80014E+00
 ARIEXC: peak, lower, upper, distance   31    0.18000E+01    0.36000E+01    0.87009E+00
 ARIEXC: peak, lower, upper, distance   33    0.18000E+01    0.60000E+01    0.83936E+00
 ARIEXC: peak, lower, upper, distance   34    0.19000E+01    0.49000E+01    0.79519E+00
 ARIEXC: peak, lower, upper, distance   35    0.19000E+01    0.60000E+01    0.83419E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.41000E+01    0.79220E+00
 ARIEXC: peak, lower, upper, distance   43    0.13000E+01    0.22000E+01    0.91067E+00
 ARIEXC: peak, lower, upper, distance   44    0.16000E+01    0.30000E+01    0.87784E+00
 ARIEXC: peak, lower, upper, distance   45    0.17000E+01    0.33000E+01    0.84285E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.43000E+01    0.78498E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.78672E+00
 ARIEXC: peak, lower, upper, distance   52    0.18000E+01    0.34000E+01    0.85644E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.41000E+01    0.87126E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.46000E+01    0.83177E+00
 ARIEXC: peak, lower, upper, distance   57    0.19000E+01    0.51000E+01    0.79118E+00
 ARIEXC: peak, lower, upper, distance   59    0.17000E+01    0.31000E+01    0.86619E+00
 ARIEXC: peak, lower, upper, distance   60    0.18000E+01    0.40000E+01    0.80429E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.85629E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.60000E+01    0.88173E+00
 ARIEXC: peak, lower, upper, distance   63    0.20000E+01    0.58000E+01    0.80641E+00
 ARIEXC: peak, lower, upper, distance   64    0.19000E+01    0.53000E+01    0.83800E+00
 ARIEXC: peak, lower, upper, distance   65    0.16000E+01    0.28000E+01    0.85117E+00
 ARIEXC: peak, lower, upper, distance   66    0.16000E+01    0.28000E+01    0.87652E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.41000E+01    0.83209E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.31000E+01    0.85643E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.60000E+01    0.86156E+00
 ARIEXC: peak, lower, upper, distance   71    0.19000E+01    0.45000E+01    0.86714E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.80842E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.41000E+01    0.83278E+00
 ARIEXC: peak, lower, upper, distance   76    0.20000E+01    0.52000E+01    0.87924E+00
 ARIEXC: peak, lower, upper, distance   77    0.13000E+01    0.22000E+01    0.91071E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.48000E+01    0.84423E+00
 ARIEXC: peak, lower, upper, distance   82    0.19000E+01    0.60000E+01    0.76535E+00
 ARIEXC: peak, lower, upper, distance   86    0.19000E+01    0.60000E+01    0.76620E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.79381E+00
 ARIEXC: peak, lower, upper, distance   91    0.19000E+01    0.60000E+01    0.82495E+00
 ARIEXC: peak, lower, upper, distance   93    0.16000E+01    0.26000E+01    0.87056E+00
 ARIEXC: peak, lower, upper, distance   95    0.11000E+01    0.60000E+01    0.84416E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.60000E+01    0.76647E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.41000E+01    0.82007E+00
 ARIEXC: peak, lower, upper, distance  100    0.20000E+01    0.56000E+01    0.74810E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.41000E+01    0.80230E+00
 ARIEXC: peak, lower, upper, distance  102    0.15000E+01    0.25000E+01    0.87007E+00
 ARIEXC: peak, lower, upper, distance  103    0.20000E+01    0.60000E+01    0.79662E+00
 ARIEXC: peak, lower, upper, distance  104    0.18000E+01    0.42000E+01    0.85323E+00
 ARIEXC: peak, lower, upper, distance  105    0.19000E+01    0.53000E+01    0.80463E+00
 ARIEXC: peak, lower, upper, distance  108    0.18000E+01    0.36000E+01    0.85795E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.82730E+00
 ARIEXC: peak, lower, upper, distance  110    0.17000E+01    0.29000E+01    0.85485E+00
 ARIEXC: peak, lower, upper, distance  112    0.20000E+01    0.60000E+01    0.79619E+00
 ARIEXC: peak, lower, upper, distance  113    0.19000E+01    0.43000E+01    0.85655E+00
 ARIEXC: peak, lower, upper, distance  114    0.20000E+01    0.58000E+01    0.78784E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.85480E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.84785E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.60000E+01    0.74783E+00
 ARIEXC: peak, lower, upper, distance  120    0.17000E+01    0.31000E+01    0.85477E+00
 ARIEXC: peak, lower, upper, distance  121    0.20000E+01    0.60000E+01    0.79233E+00
 ARIEXC: peak, lower, upper, distance  122    0.19000E+01    0.60000E+01    0.84313E+00
 ARIEXC: peak, lower, upper, distance  123    0.20000E+01    0.50000E+01    0.81529E+00
 ARIEXC: peak, lower, upper, distance  124    0.17000E+01    0.33000E+01    0.83172E+00
 ARIEXC: peak, lower, upper, distance  126    0.19000E+01    0.49000E+01    0.85550E+00
 ARIEXC: peak, lower, upper, distance  127    0.19000E+01    0.43000E+01    0.83529E+00
 ARIEXC: peak, lower, upper, distance  128    0.19000E+01    0.51000E+01    0.79361E+00
 ARIEXC: peak, lower, upper, distance  129    0.19000E+01    0.43000E+01    0.80366E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.75908E+00
 ARIEXC: peak, lower, upper, distance  132    0.19000E+01    0.45000E+01    0.80831E+00
 ARIEXC: peak, lower, upper, distance  133    0.19000E+01    0.60000E+01    0.85910E+00
 ARIEXC: peak, lower, upper, distance  134    0.20000E+01    0.48000E+01    0.82048E+00
 ARIEXC: peak, lower, upper, distance  135    0.17000E+01    0.60000E+01    0.78461E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.39000E+01    0.83652E+00
 ARIEXC: peak, lower, upper, distance  137    0.17000E+01    0.31000E+01    0.87249E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.52000E+01    0.82843E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.54000E+01    0.81425E+00
 ARIEXC: peak, lower, upper, distance  143    0.13000E+01    0.22000E+01    0.91034E+00
 ARIEXC: peak, lower, upper, distance  146    0.18000E+01    0.36000E+01    0.83430E+00
 ARIEXC: peak, lower, upper, distance  148    0.14000E+01    0.60000E+01    0.76778E+00
 ARIEXC: peak, lower, upper, distance  149    0.18000E+01    0.38000E+01    0.85867E+00
 ARIEXC: peak, lower, upper, distance  150    0.20000E+01    0.50000E+01    0.81418E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.60000E+01    0.75171E+00
 ARIEXC: peak, lower, upper, distance  153    0.19000E+01    0.60000E+01    0.76975E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.60000E+01    0.77592E+00
 ARIEXC: peak, lower, upper, distance  155    0.15000E+01    0.25000E+01    0.87680E+00
 ARIEXC: peak, lower, upper, distance  156    0.18000E+01    0.36000E+01    0.83716E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.43000E+01    0.83324E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.85050E+00
 ARIEXC: peak, lower, upper, distance  160    0.20000E+01    0.58000E+01    0.80633E+00
 ARIEXC: peak, lower, upper, distance  162    0.17000E+01    0.60000E+01    0.76693E+00
 ARIEXC: peak, lower, upper, distance  164    0.19000E+01    0.60000E+01    0.78656E+00
 ARIEXC: peak, lower, upper, distance  165    0.20000E+01    0.46000E+01    0.83015E+00
 ARIEXC: peak, lower, upper, distance  166    0.20000E+01    0.50000E+01    0.81034E+00
 ARIEXC: peak, lower, upper, distance  167    0.17000E+01    0.33000E+01    0.87333E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.39000E+01    0.85021E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.60000E+01    0.80073E+00
 ARIEXC: peak, lower, upper, distance  170    0.18000E+01    0.60000E+01    0.76595E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.46000E+01    0.78870E+00
 ARIEXC: peak, lower, upper, distance  174    0.20000E+01    0.52000E+01    0.78908E+00
 ARIEXC: peak, lower, upper, distance  175    0.19000E+01    0.43000E+01    0.84038E+00
 ARIEXC: peak, lower, upper, distance  177    0.20000E+01    0.52000E+01    0.75963E+00
 ARIEXC: peak, lower, upper, distance  178    0.20000E+01    0.60000E+01    0.75992E+00
 ARIEXC: peak, lower, upper, distance  180    0.19000E+01    0.45000E+01    0.86549E+00
 ARIEXC: peak, lower, upper, distance  181    0.14000E+01    0.60000E+01    0.80758E+00
 ARIEXC: peak, lower, upper, distance  183    0.20000E+01    0.60000E+01    0.79831E+00
 ARIEXC: peak, lower, upper, distance  184    0.20000E+01    0.48000E+01    0.81441E+00
 ARIEXC: peak, lower, upper, distance  185    0.18000E+01    0.60000E+01    0.79325E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.58000E+01    0.82927E+00
 ARIEXC: peak, lower, upper, distance  188    0.20000E+01    0.60000E+01    0.75913E+00
 ARIEXC: peak, lower, upper, distance  189    0.20000E+01    0.60000E+01    0.85269E+00
 ARIEXC: peak, lower, upper, distance  190    0.19000E+01    0.60000E+01    0.78160E+00
 ARIEXC: peak, lower, upper, distance  191    0.18000E+01    0.60000E+01    0.80450E+00
 ARIEXC: peak, lower, upper, distance  193    0.17000E+01    0.33000E+01    0.83801E+00
 ARIEXC: peak, lower, upper, distance  194    0.19000E+01    0.60000E+01    0.79487E+00
 ARIEXC: peak, lower, upper, distance  195    0.17000E+01    0.60000E+01    0.82921E+00
 ARIEXC: peak, lower, upper, distance  196    0.17000E+01    0.31000E+01    0.86036E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.77083E+00
 ARIEXC: peak, lower, upper, distance  198    0.18000E+01    0.36000E+01    0.85119E+00
 ARIEXC: peak, lower, upper, distance  199    0.15000E+01    0.23000E+01    0.88067E+00
 ARIEXC: peak, lower, upper, distance  200    0.17000E+01    0.31000E+01    0.84952E+00
 ARIEXC: peak, lower, upper, distance  201    0.19000E+01    0.60000E+01    0.78668E+00
 ARIEXC: peak, lower, upper, distance  203    0.19000E+01    0.41000E+01    0.83393E+00
 ARIEXC: peak, lower, upper, distance  205    0.20000E+01    0.52000E+01    0.79247E+00
 ARIEXC: peak, lower, upper, distance  206    0.20000E+01    0.56000E+01    0.75914E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.60000E+01    0.78022E+00
 ARIEXC: peak, lower, upper, distance  209    0.18000E+01    0.40000E+01    0.82476E+00
 ARIEXC: peak, lower, upper, distance  212    0.19000E+01    0.41000E+01    0.82563E+00
 ARIEXC: peak, lower, upper, distance  213    0.17000E+01    0.33000E+01    0.83678E+00
 ARIEXC: peak, lower, upper, distance  214    0.18000E+01    0.40000E+01    0.83551E+00
 ARIEXC: peak, lower, upper, distance  215    0.19000E+01    0.43000E+01    0.83777E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.47000E+01    0.88476E+00
 ARIEXC: peak, lower, upper, distance  217    0.15000E+01    0.60000E+01    0.77247E+00
 ARIEXC: peak, lower, upper, distance  219    0.17000E+01    0.31000E+01    0.85513E+00
 ARIEXC: peak, lower, upper, distance  220    0.18000E+01    0.36000E+01    0.83198E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.49000E+01    0.80221E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.51000E+01    0.86166E+00
 ARIEXC: peak, lower, upper, distance  223    0.19000E+01    0.49000E+01    0.80249E+00
 ARIEXC: peak, lower, upper, distance  224    0.20000E+01    0.58000E+01    0.85207E+00
 ARIEXC: peak, lower, upper, distance  226    0.20000E+01    0.52000E+01    0.78137E+00
 ARIEXC: peak, lower, upper, distance  227    0.20000E+01    0.60000E+01    0.80130E+00
 ARIEXC: peak, lower, upper, distance  230    0.20000E+01    0.56000E+01    0.86431E+00
 ARIEXC: peak, lower, upper, distance  231    0.20000E+01    0.56000E+01    0.82628E+00
 ARIEXC: peak, lower, upper, distance  232    0.13000E+01    0.22000E+01    0.91010E+00
 ARIEXC: peak, lower, upper, distance  236    0.20000E+01    0.56000E+01    0.81910E+00
 ARIEXC: peak, lower, upper, distance  237    0.19000E+01    0.60000E+01    0.78065E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.77308E+00
 ARIEXC: peak, lower, upper, distance  239    0.19000E+01    0.60000E+01    0.77231E+00
 ARIEXC: peak, lower, upper, distance  241    0.17000E+01    0.60000E+01    0.75383E+00
 ARIEXC: peak, lower, upper, distance  242    0.20000E+01    0.60000E+01    0.80373E+00
 ARIEXC: peak, lower, upper, distance  243    0.19000E+01    0.51000E+01    0.83720E+00
 ARIEXC: peak, lower, upper, distance  244    0.18000E+01    0.34000E+01    0.85765E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.41000E+01    0.82391E+00
 ARIEXC: peak, lower, upper, distance  249    0.19000E+01    0.39000E+01    0.84414E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.38000E+01    0.86011E+00
 ARIEXC: peak, lower, upper, distance  251    0.18000E+01    0.38000E+01    0.86447E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.80397E+00
 ARIEXC: peak, lower, upper, distance  253    0.19000E+01    0.60000E+01    0.81781E+00
 ARIEXC: peak, lower, upper, distance  258    0.17000E+01    0.33000E+01    0.86506E+00
 ARIEXC: peak, lower, upper, distance  259    0.17000E+01    0.31000E+01    0.83218E+00
 ARIEXC: peak, lower, upper, distance  260    0.20000E+01    0.60000E+01    0.75843E+00
 ARIEXC: peak, lower, upper, distance  261    0.20000E+01    0.60000E+01    0.75382E+00
 ARIEXC: peak, lower, upper, distance  262    0.19000E+01    0.45000E+01    0.80085E+00
 ARIEXC: peak, lower, upper, distance  263    0.20000E+01    0.52000E+01    0.80642E+00
 ARIEXC: peak, lower, upper, distance  264    0.15000E+01    0.25000E+01    0.88079E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.43000E+01    0.87175E+00
 ARIEXC: peak, lower, upper, distance  266    0.19000E+01    0.43000E+01    0.83554E+00
 ARIEXC: peak, lower, upper, distance  269    0.20000E+01    0.52000E+01    0.78936E+00
 ARIEXC: peak, lower, upper, distance  270    0.16000E+01    0.30000E+01    0.85953E+00
 ARIEXC: peak, lower, upper, distance  271    0.20000E+01    0.60000E+01    0.80944E+00
 ARIEXC: peak, lower, upper, distance  272    0.19000E+01    0.43000E+01    0.80857E+00
 ARIEXC: peak, lower, upper, distance  273    0.20000E+01    0.60000E+01    0.81933E+00
 ARIEXC: peak, lower, upper, distance  274    0.19000E+01    0.60000E+01    0.78544E+00
 ARIEXC: peak, lower, upper, distance  275    0.19000E+01    0.47000E+01    0.82690E+00
 ARIEXC: peak, lower, upper, distance  276    0.20000E+01    0.56000E+01    0.79901E+00
 ARIEXC: peak, lower, upper, distance  277    0.18000E+01    0.36000E+01    0.86326E+00
 ARIEXC: peak, lower, upper, distance  279    0.20000E+01    0.54000E+01    0.78168E+00
 ARIEXC: peak, lower, upper, distance  280    0.20000E+01    0.60000E+01    0.74128E+00
 ARIEXC: peak, lower, upper, distance  282    0.18000E+01    0.60000E+01    0.81958E+00
 ARIEXC: peak, lower, upper, distance  283    0.20000E+01    0.60000E+01    0.86857E+00
 ARIEXC: peak, lower, upper, distance  284    0.17000E+01    0.60000E+01    0.87127E+00
 ARIEXC: peak, lower, upper, distance  288    0.19000E+01    0.47000E+01    0.83823E+00
 ARIEXC: peak, lower, upper, distance  289    0.19000E+01    0.51000E+01    0.86844E+00
 ARIEXC: peak, lower, upper, distance  291    0.17000E+01    0.31000E+01    0.86828E+00
 ARIEXC: peak, lower, upper, distance  292    0.17000E+01    0.35000E+01    0.85287E+00
 ARIEXC: peak, lower, upper, distance  293    0.17000E+01    0.60000E+01    0.76674E+00
 ARIEXC: peak, lower, upper, distance  294    0.17000E+01    0.60000E+01    0.75109E+00
 ARIEXC: peak, lower, upper, distance  296    0.19000E+01    0.49000E+01    0.83420E+00
 ARIEXC: peak, lower, upper, distance  297    0.18000E+01    0.40000E+01    0.80944E+00
 ARIEXC: peak, lower, upper, distance  298    0.19000E+01    0.60000E+01    0.85198E+00
 ARIEXC: peak, lower, upper, distance  299    0.20000E+01    0.60000E+01    0.80627E+00
 ARIEXC: peak, lower, upper, distance  300    0.19000E+01    0.60000E+01    0.79487E+00
 ARIEXC: peak, lower, upper, distance  307    0.13000E+01    0.22000E+01    0.91003E+00
 ARIEXC: peak, lower, upper, distance  310    0.20000E+01    0.60000E+01    0.74178E+00
 ARIEXC: peak, lower, upper, distance  311    0.18000E+01    0.60000E+01    0.76364E+00
 ARIEXC: peak, lower, upper, distance  312    0.20000E+01    0.60000E+01    0.77331E+00
 ARIEXC: peak, lower, upper, distance  313    0.20000E+01    0.60000E+01    0.85293E+00
 ARIEXC: peak, lower, upper, distance  314    0.19000E+01    0.60000E+01    0.74086E+00
 ARIEXC: peak, lower, upper, distance  316    0.16000E+01    0.28000E+01    0.85530E+00
 ARIEXC: peak, lower, upper, distance  318    0.19000E+01    0.43000E+01    0.84008E+00
 ARIEXC: peak, lower, upper, distance  319    0.20000E+01    0.60000E+01    0.81006E+00
 ARIEXC: peak, lower, upper, distance  320    0.19000E+01    0.60000E+01    0.78343E+00
 ARIEXC: peak, lower, upper, distance  322    0.15000E+01    0.27000E+01    0.86316E+00
 ARIEXC: peak, lower, upper, distance  324    0.20000E+01    0.48000E+01    0.85631E+00
 ARIEXC: peak, lower, upper, distance  325    0.19000E+01    0.60000E+01    0.80370E+00
 ARIEXC: peak, lower, upper, distance  326    0.20000E+01    0.56000E+01    0.80775E+00
 ARIEXC: peak, lower, upper, distance  327    0.17000E+01    0.33000E+01    0.85349E+00
 ARIEXC: peak, lower, upper, distance  328    0.20000E+01    0.56000E+01    0.84878E+00
 ARIEXC: peak, lower, upper, distance  329    0.20000E+01    0.60000E+01    0.83191E+00
 ARIEXC: peak, lower, upper, distance  331    0.20000E+01    0.58000E+01    0.80534E+00
 ARIEXC: peak, lower, upper, distance  332    0.20000E+01    0.60000E+01    0.85668E+00
 ARIEXC: peak, lower, upper, distance  333    0.19000E+01    0.43000E+01    0.84182E+00
 ARIEXC: peak, lower, upper, distance  337    0.19000E+01    0.55000E+01    0.79806E+00
 ARIEXC: peak, lower, upper, distance  340    0.20000E+01    0.60000E+01    0.84573E+00
 ARIEXC: peak, lower, upper, distance  344    0.20000E+01    0.60000E+01    0.76115E+00
 ARIEXC: peak, lower, upper, distance  345    0.17000E+01    0.31000E+01    0.87687E+00
 ARIEXC: peak, lower, upper, distance  346    0.20000E+01    0.54000E+01    0.76201E+00
 ARIEXC: peak, lower, upper, distance  347    0.18000E+01    0.42000E+01    0.81089E+00
 ARIEXC: peak, lower, upper, distance  348    0.16000E+01    0.60000E+01    0.74231E+00
 ARIEXC: peak, lower, upper, distance  351    0.17000E+01    0.29000E+01    0.85418E+00
 ARIEXC: peak, lower, upper, distance  352    0.20000E+01    0.60000E+01    0.76777E+00
 ARIEXC: peak, lower, upper, distance  353    0.18000E+01    0.36000E+01    0.82890E+00
 ARIEXC: peak, lower, upper, distance  354    0.19000E+01    0.60000E+01    0.78621E+00
 ARIEXC: peak, lower, upper, distance  355    0.20000E+01    0.54000E+01    0.77702E+00
 ARIEXC: peak, lower, upper, distance  356    0.20000E+01    0.60000E+01    0.77229E+00
 ARIEXC: peak, lower, upper, distance  357    0.20000E+01    0.60000E+01    0.74460E+00
 ARIEXC: peak, lower, upper, distance  360    0.18000E+01    0.34000E+01    0.83599E+00
 ARIEXC: peak, lower, upper, distance  363    0.20000E+01    0.50000E+01    0.86745E+00
 ARIEXC: peak, lower, upper, distance  365    0.19000E+01    0.60000E+01    0.76834E+00
 ARIEXC: peak, lower, upper, distance  367    0.16000E+01    0.30000E+01    0.86338E+00
 ARIEXC: peak, lower, upper, distance  368    0.18000E+01    0.38000E+01    0.83651E+00
 ARIEXC: peak, lower, upper, distance  369    0.20000E+01    0.60000E+01    0.77577E+00
 ARIEXC: peak, lower, upper, distance  370    0.20000E+01    0.56000E+01    0.77888E+00
 ARIEXC: peak, lower, upper, distance  372    0.18000E+01    0.34000E+01    0.86589E+00
 ARIEXC: peak, lower, upper, distance  373    0.17000E+01    0.33000E+01    0.83207E+00
 ARIEXC: peak, lower, upper, distance  377    0.20000E+01    0.60000E+01    0.79430E+00
 ARIEXC: peak, lower, upper, distance  378    0.18000E+01    0.60000E+01    0.83293E+00
 ARIEXC: peak, lower, upper, distance  379    0.20000E+01    0.52000E+01    0.81710E+00
 ARIEXC: peak, lower, upper, distance  380    0.17000E+01    0.60000E+01    0.77835E+00
 ARIEXC: peak, lower, upper, distance  381    0.20000E+01    0.54000E+01    0.85983E+00
 ARIEXC: peak, lower, upper, distance  382    0.18000E+01    0.38000E+01    0.80519E+00
 ARIEXC: peak, lower, upper, distance  383    0.20000E+01    0.48000E+01    0.84834E+00
 ARIEXC: peak, lower, upper, distance  384    0.17000E+01    0.33000E+01    0.83230E+00
 ARIEXC: peak, lower, upper, distance  385    0.18000E+01    0.34000E+01    0.86465E+00
 ARIEXC: peak, lower, upper, distance  387    0.16000E+01    0.26000E+01    0.84069E+00
 ARIEXC: peak, lower, upper, distance  390    0.19000E+01    0.60000E+01    0.75158E+00
 ARIEXC: peak, lower, upper, distance  391    0.20000E+01    0.60000E+01    0.74094E+00
 ARIEXC: peak, lower, upper, distance  394    0.17000E+01    0.60000E+01    0.75514E+00
 ARIEXC: peak, lower, upper, distance  395    0.19000E+01    0.60000E+01    0.76506E+00
 ARIEXC: peak, lower, upper, distance  396    0.17000E+01    0.60000E+01    0.79740E+00
 ARIEXC: peak, lower, upper, distance  397    0.19000E+01    0.43000E+01    0.83700E+00
 ARIEXC: peak, lower, upper, distance  399    0.13000E+01    0.60000E+01    0.77343E+00
 ARIEXC: peak, lower, upper, distance  400    0.19000E+01    0.49000E+01    0.79889E+00
 ARIEXC: peak, lower, upper, distance  401    0.18000E+01    0.36000E+01    0.86832E+00
 ARIEXC: peak, lower, upper, distance  402    0.17000E+01    0.33000E+01    0.86488E+00
 ARIEXC: peak, lower, upper, distance  403    0.19000E+01    0.53000E+01    0.81130E+00
 ARIEXC: peak, lower, upper, distance  404    0.18000E+01    0.38000E+01    0.83587E+00
 ARIEXC: peak, lower, upper, distance  405    0.18000E+01    0.60000E+01    0.78147E+00
 ARIEXC: peak, lower, upper, distance  406    0.16000E+01    0.60000E+01    0.74420E+00
 ARIEXC: peak, lower, upper, distance  407    0.19000E+01    0.43000E+01    0.81285E+00
 ARIEXC: peak, lower, upper, distance  408    0.18000E+01    0.60000E+01    0.79610E+00
 ARIEXC: peak, lower, upper, distance  411    0.19000E+01    0.60000E+01    0.77813E+00
 ARIEXC: peak, lower, upper, distance  414    0.19000E+01    0.41000E+01    0.83689E+00
 ARIEXC: peak, lower, upper, distance  416    0.16000E+01    0.60000E+01    0.77859E+00
 ARIEXC: peak, lower, upper, distance  417    0.19000E+01    0.43000E+01    0.84572E+00
 ARIEXC: peak, lower, upper, distance  418    0.20000E+01    0.60000E+01    0.77246E+00
 ARIEXC: peak, lower, upper, distance  422    0.20000E+01    0.60000E+01    0.79921E+00
 ARIEXC: peak, lower, upper, distance  423    0.18000E+01    0.60000E+01    0.73395E+00
 ARIEXC: peak, lower, upper, distance  427    0.20000E+01    0.60000E+01    0.86654E+00
 ARIEXC: peak, lower, upper, distance  428    0.17000E+01    0.31000E+01    0.85551E+00
 ARIEXC: peak, lower, upper, distance  429    0.20000E+01    0.60000E+01    0.77198E+00
 ARIEXC: peak, lower, upper, distance  431    0.20000E+01    0.60000E+01    0.77272E+00
 ARIEXC: peak, lower, upper, distance  432    0.20000E+01    0.50000E+01    0.84632E+00
 ARIEXC: peak, lower, upper, distance  442    0.19000E+01    0.60000E+01    0.76918E+00
 ARIEXC: peak, lower, upper, distance  444    0.18000E+01    0.36000E+01    0.85505E+00
 ARIEXC: peak, lower, upper, distance  446    0.20000E+01    0.60000E+01    0.80553E+00
 ARIEXC: peak, lower, upper, distance  447    0.18000E+01    0.36000E+01    0.83511E+00
 ARIEXC: peak, lower, upper, distance  448    0.20000E+01    0.60000E+01    0.77567E+00
 ARIEXC: peak, lower, upper, distance  449    0.16000E+01    0.60000E+01    0.74953E+00
 ARIEXC: peak, lower, upper, distance  450    0.17000E+01    0.33000E+01    0.85330E+00
 ARIEXC: peak, lower, upper, distance  452    0.19000E+01    0.41000E+01    0.85397E+00
 ARIEXC: peak, lower, upper, distance  453    0.20000E+01    0.60000E+01    0.78431E+00
 ARIEXC: peak, lower, upper, distance  454    0.18000E+01    0.40000E+01    0.83206E+00
 ARIEXC: peak, lower, upper, distance  455    0.19000E+01    0.39000E+01    0.84400E+00
 ARIEXC: peak, lower, upper, distance  457    0.20000E+01    0.60000E+01    0.79555E+00
 ARIEXC: peak, lower, upper, distance  458    0.20000E+01    0.54000E+01    0.81199E+00
 ARIEXC: peak, lower, upper, distance  459    0.16000E+01    0.60000E+01    0.80189E+00
 ARIEXC: peak, lower, upper, distance  460    0.20000E+01    0.56000E+01    0.84446E+00
 ARIEXC: peak, lower, upper, distance  462    0.20000E+01    0.60000E+01    0.79325E+00
 ARIEXC: peak, lower, upper, distance  464    0.13000E+01    0.22000E+01    0.91004E+00
 ARIEXC: peak, lower, upper, distance  465    0.19000E+01    0.60000E+01    0.74049E+00
 ARIEXC: peak, lower, upper, distance  466    0.20000E+01    0.54000E+01    0.81860E+00
 ARIEXC: peak, lower, upper, distance  467    0.20000E+01    0.60000E+01    0.76605E+00
 ARIEXC: peak, lower, upper, distance  468    0.17000E+01    0.60000E+01    0.80404E+00
 ARIEXC: peak, lower, upper, distance  469    0.16000E+01    0.30000E+01    0.85255E+00
 ARIEXC: peak, lower, upper, distance  470    0.19000E+01    0.60000E+01    0.74327E+00
 ARIEXC: peak, lower, upper, distance  471    0.20000E+01    0.60000E+01    0.78543E+00
 ARIEXC: peak, lower, upper, distance  472    0.20000E+01    0.50000E+01    0.77508E+00
 ARIEXC: peak, lower, upper, distance  473    0.20000E+01    0.56000E+01    0.81137E+00
 ARIEXC: peak, lower, upper, distance  474    0.20000E+01    0.60000E+01    0.79520E+00
 ARIEXC: peak, lower, upper, distance  477    0.19000E+01    0.43000E+01    0.83760E+00
 ARIEXC: peak, lower, upper, distance  478    0.20000E+01    0.60000E+01    0.78239E+00
 ARIEXC: peak, lower, upper, distance  479    0.19000E+01    0.60000E+01    0.77161E+00
 ARIEXC: peak, lower, upper, distance  480    0.18000E+01    0.34000E+01    0.85482E+00
 ARIEXC: peak, lower, upper, distance  481    0.18000E+01    0.38000E+01    0.86384E+00
 ARIEXC: peak, lower, upper, distance  482    0.20000E+01    0.60000E+01    0.75688E+00
 ARIEXC: peak, lower, upper, distance  483    0.17000E+01    0.33000E+01    0.85882E+00
 ARIEXC: peak, lower, upper, distance  484    0.20000E+01    0.60000E+01    0.87787E+00
 ARIEXC: peak, lower, upper, distance  487    0.19000E+01    0.60000E+01    0.74468E+00
 ARIEXC: peak, lower, upper, distance  488    0.18000E+01    0.60000E+01    0.77415E+00
 ARIEXC: peak, lower, upper, distance  489    0.18000E+01    0.60000E+01    0.78042E+00
 ARIEXC: peak, lower, upper, distance  490    0.20000E+01    0.54000E+01    0.80592E+00
 ARIEXC: peak, lower, upper, distance  492    0.19000E+01    0.41000E+01    0.83546E+00
 ARIEXC: peak, lower, upper, distance  493    0.17000E+01    0.31000E+01    0.83146E+00
 ARIEXC: peak, lower, upper, distance  494    0.18000E+01    0.38000E+01    0.86133E+00
 ARIEXC: peak, lower, upper, distance  495    0.19000E+01    0.51000E+01    0.78824E+00
 ARIEXC: peak, lower, upper, distance  496    0.20000E+01    0.60000E+01    0.75017E+00
 ARIEXC: peak, lower, upper, distance  497    0.17000E+01    0.31000E+01    0.87188E+00
 ARIEXC: peak, lower, upper, distance  498    0.19000E+01    0.45000E+01    0.83489E+00
 ARIEXC: peak, lower, upper, distance  499    0.20000E+01    0.60000E+01    0.77243E+00
 ARIEXC: peak, lower, upper, distance  501    0.17000E+01    0.31000E+01    0.85693E+00
 ARIEXC: peak, lower, upper, distance  502    0.18000E+01    0.40000E+01    0.82920E+00
 ARIEXC: peak, lower, upper, distance  503    0.19000E+01    0.53000E+01    0.80917E+00
 ARIEXC: peak, lower, upper, distance  504    0.20000E+01    0.60000E+01    0.85280E+00
 ARIEXC: peak, lower, upper, distance  505    0.20000E+01    0.52000E+01    0.80614E+00
 ARIEXC: peak, lower, upper, distance  507    0.18000E+01    0.40000E+01    0.83183E+00
 ARIEXC: peak, lower, upper, distance  509    0.18000E+01    0.36000E+01    0.83235E+00
 ARIEXC: peak, lower, upper, distance  511    0.20000E+01    0.60000E+01    0.83344E+00
 ARIEXC: peak, lower, upper, distance  519    0.19000E+01    0.39000E+01    0.83203E+00
 ARIEXC: peak, lower, upper, distance  520    0.17000E+01    0.33000E+01    0.83206E+00
 ARIEXC: peak, lower, upper, distance  521    0.17000E+01    0.31000E+01    0.86068E+00
 ARIEXC: peak, lower, upper, distance  526    0.20000E+01    0.60000E+01    0.80450E+00
 ARIEXC: peak, lower, upper, distance  529    0.20000E+01    0.56000E+01    0.80588E+00
 ARIEXC: peak, lower, upper, distance  531    0.20000E+01    0.52000E+01    0.84622E+00
 ARIEXC: peak, lower, upper, distance  532    0.20000E+01    0.60000E+01    0.75983E+00
 ARIEXC: peak, lower, upper, distance  534    0.20000E+01    0.60000E+01    0.74020E+00
 ARIEXC: peak, lower, upper, distance  535    0.18000E+01    0.60000E+01    0.77859E+00
 ARIEXC: peak, lower, upper, distance  541    0.17000E+01    0.31000E+01    0.86858E+00
 ARIEXC: peak, lower, upper, distance  542    0.20000E+01    0.46000E+01    0.83573E+00
 ARIEXC: peak, lower, upper, distance  543    0.20000E+01    0.56000E+01    0.79876E+00
 ARIEXC: peak, lower, upper, distance  548    0.18000E+01    0.36000E+01    0.84359E+00
 ARIEXC: peak, lower, upper, distance  549    0.20000E+01    0.60000E+01    0.77601E+00
 ARIEXC: peak, lower, upper, distance  550    0.20000E+01    0.60000E+01    0.78253E+00
 ARIEXC: peak, lower, upper, distance  551    0.20000E+01    0.54000E+01    0.81960E+00
 ARIEXC: peak, lower, upper, distance  558    0.19000E+01    0.47000E+01    0.83573E+00
 ARIEXC: peak, lower, upper, distance  559    0.19000E+01    0.41000E+01    0.86737E+00
 ARIEXC: peak, lower, upper, distance  560    0.16000E+01    0.60000E+01    0.79518E+00
 ARIEXC: peak, lower, upper, distance  561    0.11000E+01    0.60000E+01    0.77266E+00
 ARIEXC: peak, lower, upper, distance  562    0.17000E+01    0.31000E+01    0.86147E+00
 ARIEXC: peak, lower, upper, distance  563    0.18000E+01    0.36000E+01    0.83239E+00
 ARIEXC: peak, lower, upper, distance  566    0.19000E+01    0.60000E+01    0.77382E+00
 ARIEXC: peak, lower, upper, distance  567    0.16000E+01    0.60000E+01    0.77229E+00
 ARIEXC: peak, lower, upper, distance  568    0.20000E+01    0.58000E+01    0.83118E+00
 ARIEXC: peak, lower, upper, distance  569    0.20000E+01    0.58000E+01    0.83620E+00
 ARIEXC: peak, lower, upper, distance  570    0.20000E+01    0.56000E+01    0.77959E+00
 ARIEXC: peak, lower, upper, distance  571    0.19000E+01    0.60000E+01    0.80694E+00
 ARIEXC: peak, lower, upper, distance  572    0.16000E+01    0.60000E+01    0.77583E+00
 ARIEXC: peak, lower, upper, distance  573    0.20000E+01    0.60000E+01    0.82112E+00
 ARIEXC: peak, lower, upper, distance  574    0.17000E+01    0.33000E+01    0.91632E+00
 ARIEXC: peak, lower, upper, distance  575    0.18000E+01    0.34000E+01    0.83961E+00
 ARIEXC: peak, lower, upper, distance  576    0.20000E+01    0.52000E+01    0.87306E+00
 ARIEXC: peak, lower, upper, distance  577    0.19000E+01    0.57000E+01    0.79080E+00
 ARIEXC: peak, lower, upper, distance  578    0.20000E+01    0.56000E+01    0.80229E+00
 ARIEXC: peak, lower, upper, distance  579    0.19000E+01    0.60000E+01    0.81195E+00
 ARIEXC: peak, lower, upper, distance  580    0.20000E+01    0.60000E+01    0.77915E+00
 ARIEXC: peak, lower, upper, distance  581    0.19000E+01    0.60000E+01    0.77258E+00
 ARIEXC: peak, lower, upper, distance  582    0.18000E+01    0.60000E+01    0.76881E+00
 ARIEXC: peak, lower, upper, distance  583    0.16000E+01    0.60000E+01    0.74098E+00
 ARIEXC: peak, lower, upper, distance  584    0.20000E+01    0.60000E+01    0.80179E+00
 ARIEXC: peak, lower, upper, distance  586    0.20000E+01    0.58000E+01    0.81397E+00
 ARIEXC: peak, lower, upper, distance  587    0.20000E+01    0.50000E+01    0.80218E+00
 ARIEXC: peak, lower, upper, distance  588    0.18000E+01    0.38000E+01    0.83152E+00
 ARIEXC: peak, lower, upper, distance  589    0.18000E+01    0.40000E+01    0.85700E+00
 ARIEXC: peak, lower, upper, distance  590    0.20000E+01    0.56000E+01    0.77475E+00
 ARIEXC: peak, lower, upper, distance  591    0.15000E+01    0.60000E+01    0.85231E+00
 ARIEXC: peak, lower, upper, distance  592    0.20000E+01    0.60000E+01    0.84304E+00
 ARIEXC: peak, lower, upper, distance  593    0.20000E+01    0.60000E+01    0.86084E+00
 ARIEXC: peak, lower, upper, distance  594    0.20000E+01    0.52000E+01    0.79343E+00
 ARIEXC: peak, lower, upper, distance  595    0.19000E+01    0.53000E+01    0.83553E+00
 ARIEXC: peak, lower, upper, distance  596    0.20000E+01    0.54000E+01    0.84377E+00
 ARIEXC: peak, lower, upper, distance  597    0.19000E+01    0.47000E+01    0.79875E+00
 ARIEXC: peak, lower, upper, distance  598    0.19000E+01    0.43000E+01    0.79548E+00
 ARIEXC: peak, lower, upper, distance  599    0.13000E+01    0.22000E+01    0.91039E+00
 ARIEXC: peak, lower, upper, distance  601    0.19000E+01    0.60000E+01    0.75989E+00
 ARIEXC: peak, lower, upper, distance  603    0.18000E+01    0.36000E+01    0.86199E+00
 ARIEXC: peak, lower, upper, distance  604    0.19000E+01    0.39000E+01    0.83537E+00
 ARIEXC: peak, lower, upper, distance  605    0.20000E+01    0.60000E+01    0.75621E+00
 ARIEXC: peak, lower, upper, distance  607    0.19000E+01    0.41000E+01    0.79988E+00
 ARIEXC: peak, lower, upper, distance  609    0.18000E+01    0.34000E+01    0.85092E+00
 ARIEXC: peak, lower, upper, distance  610    0.18000E+01    0.42000E+01    0.80354E+00
 ARIEXC: peak, lower, upper, distance  615    0.19000E+01    0.47000E+01    0.83183E+00
 ARIEXC: peak, lower, upper, distance  616    0.19000E+01    0.47000E+01    0.86403E+00
 ARIEXC: peak, lower, upper, distance  617    0.17000E+01    0.33000E+01    0.86333E+00
 ARIEXC: peak, lower, upper, distance  619    0.20000E+01    0.60000E+01    0.79748E+00
 ARIEXC: peak, lower, upper, distance  620    0.20000E+01    0.60000E+01    0.86030E+00
 ARIEXC: peak, lower, upper, distance  623    0.20000E+01    0.60000E+01    0.82256E+00
 ARIEXC: peak, lower, upper, distance  625    0.20000E+01    0.60000E+01    0.86274E+00
 ARIEXC: peak, lower, upper, distance  626    0.15000E+01    0.25000E+01    0.86233E+00
 ARIEXC: peak, lower, upper, distance  628    0.19000E+01    0.45000E+01    0.85989E+00
 ARIEXC: peak, lower, upper, distance  629    0.18000E+01    0.40000E+01    0.82741E+00
 ARIEXC: peak, lower, upper, distance  630    0.20000E+01    0.60000E+01    0.84088E+00
 ARIEXC: peak, lower, upper, distance  631    0.18000E+01    0.40000E+01    0.77615E+00
 ARIEXC: peak, lower, upper, distance  633    0.19000E+01    0.41000E+01    0.82925E+00
 ARIEXC: peak, lower, upper, distance  635    0.19000E+01    0.43000E+01    0.85959E+00
 ARIEXC: peak, lower, upper, distance  638    0.17000E+01    0.33000E+01    0.81313E+00
 ARIEXC: peak, lower, upper, distance  640    0.20000E+01    0.52000E+01    0.82647E+00
 ARIEXC: peak, lower, upper, distance  641    0.20000E+01    0.60000E+01    0.79972E+00
 ARIEXC: peak, lower, upper, distance  642    0.20000E+01    0.54000E+01    0.81602E+00
 ARIEXC: peak, lower, upper, distance  644    0.20000E+01    0.60000E+01    0.79522E+00
 ARIEXC: peak, lower, upper, distance  645    0.12000E+01    0.22000E+01    0.91021E+00
 ARIEXC: peak, lower, upper, distance  647    0.15000E+01    0.27000E+01    0.87214E+00
 ARIEXC: peak, lower, upper, distance  654    0.18000E+01    0.34000E+01    0.83191E+00
 ARIEXC: peak, lower, upper, distance  657    0.20000E+01    0.60000E+01    0.75705E+00
 ARIEXC: peak, lower, upper, distance  658    0.13000E+01    0.22000E+01    0.90974E+00
 ARIEXC: peak, lower, upper, distance  665    0.15000E+01    0.25000E+01    0.86134E+00
 ARIEXC: peak, lower, upper, distance  666    0.20000E+01    0.56000E+01    0.88035E+00
 ARIEXC: peak, lower, upper, distance  667    0.20000E+01    0.60000E+01    0.80726E+00
 ARIEXC: peak, lower, upper, distance  668    0.18000E+01    0.36000E+01    0.87078E+00
 ARIEXC: peak, lower, upper, distance  669    0.20000E+01    0.54000E+01    0.79583E+00
 ARIEXC: peak, lower, upper, distance  670    0.20000E+01    0.48000E+01    0.83355E+00
 ARIEXC: peak, lower, upper, distance  671    0.19000E+01    0.45000E+01    0.88037E+00
 ARIEXC: peak, lower, upper, distance  672    0.17000E+01    0.33000E+01    0.88038E+00
 ARIEXC: peak, lower, upper, distance  673    0.20000E+01    0.56000E+01    0.78594E+00
 ARIEXC: peak, lower, upper, distance  674    0.18000E+01    0.38000E+01    0.85440E+00
 ARIEXC: peak, lower, upper, distance  676    0.20000E+01    0.58000E+01    0.79053E+00
 ARIEXC: peak, lower, upper, distance  677    0.16000E+01    0.60000E+01    0.74445E+00
 ARIEXC: peak, lower, upper, distance  678    0.12000E+01    0.60000E+01    0.76378E+00
 ARIEXC: peak, lower, upper, distance  679    0.15000E+01    0.25000E+01    0.86987E+00
 ARIEXC: peak, lower, upper, distance  680    0.20000E+01    0.60000E+01    0.79901E+00
 ARIEXC: peak, lower, upper, distance  681    0.19000E+01    0.60000E+01    0.79229E+00
 ARIEXC: peak, lower, upper, distance  684    0.18000E+01    0.42000E+01    0.78712E+00
 ARIEXC: peak, lower, upper, distance  685    0.15000E+01    0.60000E+01    0.80034E+00
 ARIEXC: peak, lower, upper, distance  686    0.20000E+01    0.60000E+01    0.77377E+00
 ARIEXC: peak, lower, upper, distance  687    0.14000E+01    0.60000E+01    0.74186E+00
 ARIEXC: peak, lower, upper, distance  688    0.16000E+01    0.28000E+01    0.87294E+00
 ARIEXC: peak, lower, upper, distance  689    0.13000E+01    0.22000E+01    0.90886E+00
 ARIEXC: peak, lower, upper, distance  690    0.17000E+01    0.29000E+01    0.87247E+00
 ARIEXC: peak, lower, upper, distance  696    0.20000E+01    0.60000E+01    0.78186E+00
 ARIEXC: peak, lower, upper, distance  697    0.19000E+01    0.49000E+01    0.83380E+00
 ARIEXC: peak, lower, upper, distance  698    0.19000E+01    0.39000E+01    0.87067E+00
 ARIEXC: peak, lower, upper, distance  699    0.20000E+01    0.54000E+01    0.79261E+00
 ARIEXC: peak, lower, upper, distance  700    0.19000E+01    0.41000E+01    0.84619E+00
 ARIEXC: peak, lower, upper, distance  701    0.18000E+01    0.38000E+01    0.87054E+00
 ARIEXC: peak, lower, upper, distance  702    0.19000E+01    0.39000E+01    0.83261E+00
 ARIEXC: peak, lower, upper, distance  703    0.19000E+01    0.43000E+01    0.85406E+00
 ARIEXC: peak, lower, upper, distance  704    0.19000E+01    0.60000E+01    0.79133E+00
 ARIEXC: peak, lower, upper, distance  706    0.11000E+01    0.60000E+01    0.78426E+00
 ARIEXC: peak, lower, upper, distance  711    0.19000E+01    0.60000E+01    0.84132E+00
 ARIEXC: peak, lower, upper, distance  712    0.14000E+01    0.24000E+01    0.86888E+00
 ARIEXC: peak, lower, upper, distance  713    0.14000E+01    0.22000E+01    0.90892E+00
 ARIEXC: peak, lower, upper, distance  718    0.19000E+01    0.60000E+01    0.81125E+00
 ARIEXC: peak, lower, upper, distance  719    0.20000E+01    0.60000E+01    0.80811E+00
 ARIEXC: peak, lower, upper, distance  722    0.20000E+01    0.60000E+01    0.75216E+00
 ARIEXC: peak, lower, upper, distance  723    0.17000E+01    0.31000E+01    0.86971E+00
 ARIEXC: peak, lower, upper, distance  725    0.20000E+01    0.60000E+01    0.80193E+00
 ARIEXC: peak, lower, upper, distance  728    0.20000E+01    0.54000E+01    0.79303E+00
 ARIEXC: peak, lower, upper, distance  730    0.17000E+01    0.31000E+01    0.86857E+00
 ARIEXC: peak, lower, upper, distance  731    0.20000E+01    0.52000E+01    0.84247E+00
 ARIEXC: peak, lower, upper, distance  732    0.18000E+01    0.60000E+01    0.75529E+00
 ARIEXC: peak, lower, upper, distance  733    0.17000E+01    0.60000E+01    0.77370E+00
 ARIEXC: peak, lower, upper, distance  736    0.15000E+01    0.25000E+01    0.87924E+00
 ARIEXC: peak, lower, upper, distance  738    0.17000E+01    0.31000E+01    0.89065E+00
 ARIEXC: peak, lower, upper, distance  740    0.20000E+01    0.60000E+01    0.77688E+00
 ARIEXC: peak, lower, upper, distance  741    0.20000E+01    0.60000E+01    0.82581E+00
 ARIEXC: peak, lower, upper, distance  743    0.20000E+01    0.56000E+01    0.83187E+00
 ARIEXC: peak, lower, upper, distance  744    0.18000E+01    0.34000E+01    0.86947E+00
 ARIEXC: peak, lower, upper, distance  745    0.16000E+01    0.30000E+01    0.84848E+00
 ARIEXC: peak, lower, upper, distance  748    0.17000E+01    0.35000E+01    0.87553E+00
 ARIEXC: peak, lower, upper, distance  749    0.20000E+01    0.60000E+01    0.83700E+00
 ARIEXC: peak, lower, upper, distance  750    0.18000E+01    0.40000E+01    0.83153E+00
 ARIEXC: peak, lower, upper, distance  752    0.19000E+01    0.39000E+01    0.83962E+00
 ARIEXC: peak, lower, upper, distance  753    0.17000E+01    0.60000E+01    0.78084E+00
 ARIEXC: peak, lower, upper, distance  754    0.19000E+01    0.60000E+01    0.78213E+00
 ARIEXC: peak, lower, upper, distance  758    0.18000E+01    0.38000E+01    0.83345E+00
 ARIEXC: peak, lower, upper, distance  759    0.20000E+01    0.60000E+01    0.83743E+00
 ARIEXC: peak, lower, upper, distance  760    0.19000E+01    0.60000E+01    0.82312E+00
 ARIEXC: peak, lower, upper, distance  761    0.19000E+01    0.43000E+01    0.89084E+00
 ARIEXC: peak, lower, upper, distance  765    0.19000E+01    0.41000E+01    0.79820E+00
 ARIEXC: peak, lower, upper, distance  768    0.19000E+01    0.51000E+01    0.79628E+00
 ARIEXC: peak, lower, upper, distance  769    0.19000E+01    0.60000E+01    0.79244E+00
 ARIEXC: peak, lower, upper, distance  770    0.20000E+01    0.58000E+01    0.82184E+00
 ARIEXC: peak, lower, upper, distance  771    0.16000E+01    0.28000E+01    0.86906E+00
 ARIEXC: peak, lower, upper, distance  772    0.15000E+01    0.27000E+01    0.84920E+00
 ARIEXC: peak, lower, upper, distance  773    0.16000E+01    0.26000E+01    0.87022E+00
 ARIEXC: peak, lower, upper, distance  774    0.19000E+01    0.45000E+01    0.83371E+00
 ARIEXC: peak, lower, upper, distance  775    0.20000E+01    0.46000E+01    0.80257E+00
 ARIEXC: peak, lower, upper, distance  776    0.18000E+01    0.60000E+01    0.77538E+00
 ARIEXC: peak, lower, upper, distance  781    0.16000E+01    0.30000E+01    0.87177E+00
 ARIEXC: peak, lower, upper, distance  783    0.19000E+01    0.41000E+01    0.84942E+00
 ARIEXC: peak, lower, upper, distance  784    0.20000E+01    0.60000E+01    0.83597E+00
 ARIEXC: peak, lower, upper, distance  788    0.18000E+01    0.38000E+01    0.83228E+00
 ARIEXC: peak, lower, upper, distance  789    0.19000E+01    0.43000E+01    0.86209E+00
 ARIEXC: peak, lower, upper, distance  792    0.17000E+01    0.31000E+01    0.83172E+00
 ARIEXC: peak, lower, upper, distance  793    0.19000E+01    0.60000E+01    0.84045E+00
 ARIEXC: peak, lower, upper, distance  794    0.18000E+01    0.60000E+01    0.79203E+00
 ARIEXC: peak, lower, upper, distance  795    0.18000E+01    0.36000E+01    0.83215E+00
 ARIEXC: peak, lower, upper, distance  798    0.13000E+01    0.22000E+01    0.87324E+00
 ARIEXC: peak, lower, upper, distance  802    0.20000E+01    0.60000E+01    0.79149E+00
 ARIEXC: peak, lower, upper, distance  803    0.16000E+01    0.60000E+01    0.75207E+00
 ARIEXC: peak, lower, upper, distance  804    0.15000E+01    0.60000E+01    0.75843E+00
 ARIEXC: peak, lower, upper, distance  805    0.19000E+01    0.41000E+01    0.83002E+00
 ARIEXC: peak, lower, upper, distance  807    0.20000E+01    0.58000E+01    0.79215E+00
 ARIEXC: peak, lower, upper, distance  813    0.19000E+01    0.37000E+01    0.88146E+00
 ARIEXC: peak, lower, upper, distance  814    0.20000E+01    0.60000E+01    0.82273E+00
 ARIEXC: peak, lower, upper, distance  817    0.17000E+01    0.31000E+01    0.85532E+00
 ARIEXC: peak, lower, upper, distance  821    0.15000E+01    0.60000E+01    0.77902E+00
 ARIEXC: peak, lower, upper, distance  826    0.16000E+01    0.28000E+01    0.85524E+00
 ARIEXC: peak, lower, upper, distance  827    0.19000E+01    0.41000E+01    0.83231E+00
 ARIEXC: peak, lower, upper, distance  831    0.19000E+01    0.49000E+01    0.77034E+00
 ARIEXC: peak, lower, upper, distance  832    0.19000E+01    0.39000E+01    0.83769E+00
 ARIEXC: peak, lower, upper, distance  835    0.16000E+01    0.60000E+01    0.73134E+00
 ARIEXC: peak, lower, upper, distance  839    0.20000E+01    0.60000E+01    0.78328E+00
 ARIEXC: peak, lower, upper, distance  845    0.19000E+01    0.60000E+01    0.80289E+00
 ARIEXC: peak, lower, upper, distance  851    0.19000E+01    0.60000E+01    0.84542E+00
 ARIEXC: peak, lower, upper, distance  852    0.18000E+01    0.60000E+01    0.78181E+00
 ARIEXC: peak, lower, upper, distance  853    0.10000E+01    0.60000E+01    0.76074E+00
 ARIEXC: peak, lower, upper, distance  858    0.19000E+01    0.39000E+01    0.79408E+00
 ARIEXC: peak, lower, upper, distance  860    0.20000E+01    0.52000E+01    0.77523E+00
 ARIEXC: peak, lower, upper, distance  861    0.20000E+01    0.54000E+01    0.75903E+00
 ARIEXC: peak, lower, upper, distance  862    0.17000E+01    0.31000E+01    0.85525E+00
 ARIEXC: peak, lower, upper, distance  863    0.18000E+01    0.38000E+01    0.83629E+00
 ARIEXC: peak, lower, upper, distance  865    0.19000E+01    0.60000E+01    0.77569E+00
 ARIEXC: peak, lower, upper, distance  868    0.18000E+01    0.60000E+01    0.82242E+00
 ARIEXC: peak, lower, upper, distance  869    0.20000E+01    0.60000E+01    0.84027E+00
 ARIEXC: peak, lower, upper, distance  872    0.12000E+01    0.22000E+01    0.90870E+00
 ARIEXC: peak, lower, upper, distance  875    0.19000E+01    0.51000E+01    0.87296E+00
 ARIEXC: peak, lower, upper, distance  876    0.19000E+01    0.43000E+01    0.83945E+00
 ARIEXC: peak, lower, upper, distance  877    0.19000E+01    0.60000E+01    0.79628E+00
 ARIEXC: peak, lower, upper, distance  886    0.19000E+01    0.60000E+01    0.83125E+00
 ARIEXC: peak, lower, upper, distance    1    0.19000E+01    0.43000E+01    0.79325E+00
 ARIEXC: peak, lower, upper, distance    1    0.17000E+01    0.29000E+01    0.84942E+00
 ARIEXC: peak, lower, upper, distance    2    0.17000E+01    0.29000E+01    0.85882E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.43000E+01    0.86166E+00
 ARIEXC: peak, lower, upper, distance    5    0.16000E+01    0.28000E+01    0.84315E+00
 ARIEXC: peak, lower, upper, distance    6    0.17000E+01    0.60000E+01    0.75671E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.60000E+01    0.77331E+00
 ARIEXC: peak, lower, upper, distance    8    0.17000E+01    0.60000E+01    0.77267E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.50000E+01    0.80842E+00
 ARIEXC: peak, lower, upper, distance   10    0.20000E+01    0.60000E+01    0.77902E+00
 ARIEXC: peak, lower, upper, distance   11    0.19000E+01    0.60000E+01    0.78181E+00
 ARIEXC: peak, lower, upper, distance   13    0.19000E+01    0.45000E+01    0.88035E+00
 ARIEXC: peak, lower, upper, distance   14    0.20000E+01    0.60000E+01    0.83605E+00
 ARIEXC: peak, lower, upper, distance   15    0.20000E+01    0.56000E+01    0.86613E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.60000E+01    0.77633E+00
 ARIEXC: peak, lower, upper, distance   17    0.20000E+01    0.48000E+01    0.84996E+00
 ARIEXC: peak, lower, upper, distance   18    0.19000E+01    0.39000E+01    0.83716E+00
 ARIEXC: peak, lower, upper, distance   19    0.20000E+01    0.58000E+01    0.80726E+00
 ARIEXC: peak, lower, upper, distance   20    0.20000E+01    0.50000E+01    0.81425E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.47000E+01    0.82843E+00
 ARIEXC: peak, lower, upper, distance   22    0.16000E+01    0.28000E+01    0.87333E+00
 ARIEXC: peak, lower, upper, distance   23    0.19000E+01    0.53000E+01    0.81034E+00
 ARIEXC: peak, lower, upper, distance   25    0.18000E+01    0.60000E+01    0.77609E+00
 ARIEXC: peak, lower, upper, distance   27    0.20000E+01    0.60000E+01    0.86165E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.60000E+01    0.79125E+00
 ARIEXC: peak, lower, upper, distance   29    0.20000E+01    0.60000E+01    0.76990E+00
 ARIEXC: peak, lower, upper, distance   30    0.20000E+01    0.60000E+01    0.79518E+00
 ARIEXC: peak, lower, upper, distance   33    0.16000E+01    0.30000E+01    0.87680E+00
 ARIEXC: peak, lower, upper, distance   34    0.20000E+01    0.50000E+01    0.83672E+00
 ARIEXC: peak, lower, upper, distance   35    0.20000E+01    0.60000E+01    0.80553E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.60000E+01    0.78656E+00
 ARIEXC: peak, lower, upper, distance   37    0.20000E+01    0.48000E+01    0.83015E+00
 ARIEXC: peak, lower, upper, distance   38    0.20000E+01    0.58000E+01    0.85269E+00
 ARIEXC: peak, lower, upper, distance   39    0.19000E+01    0.47000E+01    0.81441E+00
 ARIEXC: peak, lower, upper, distance   40    0.20000E+01    0.60000E+01    0.77859E+00
 ARIEXC: peak, lower, upper, distance   41    0.19000E+01    0.60000E+01    0.78485E+00
 ARIEXC: peak, lower, upper, distance   43    0.15000E+01    0.27000E+01    0.87818E+00
 ARIEXC: peak, lower, upper, distance   44    0.18000E+01    0.38000E+01    0.83801E+00
 ARIEXC: peak, lower, upper, distance   45    0.19000E+01    0.60000E+01    0.78160E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.60000E+01    0.84542E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.77854E+00
 ARIEXC: peak, lower, upper, distance   49    0.19000E+01    0.41000E+01    0.87521E+00
 ARIEXC: peak, lower, upper, distance   50    0.15000E+01    0.23000E+01    0.88067E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.50000E+01    0.78668E+00
 ARIEXC: peak, lower, upper, distance   53    0.20000E+01    0.50000E+01    0.79806E+00
 ARIEXC: peak, lower, upper, distance   54    0.20000E+01    0.46000E+01    0.85207E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.60000E+01    0.78491E+00
 ARIEXC: peak, lower, upper, distance   56    0.19000E+01    0.60000E+01    0.77975E+00
 ARIEXC: peak, lower, upper, distance   57    0.18000E+01    0.38000E+01    0.83554E+00
 ARIEXC: peak, lower, upper, distance   58    0.16000E+01    0.28000E+01    0.86404E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.60000E+01    0.81781E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.60000E+01    0.81958E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.48000E+01    0.86857E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.43000E+01    0.79901E+00
 ARIEXC: peak, lower, upper, distance   65    0.12000E+01    0.22000E+01    0.91291E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.60000E+01    0.80279E+00
 ARIEXC: peak, lower, upper, distance   68    0.19000E+01    0.51000E+01    0.82580E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.48000E+01    0.87127E+00
 ARIEXC: peak, lower, upper, distance   71    0.20000E+01    0.58000E+01    0.81170E+00
 ARIEXC: peak, lower, upper, distance   72    0.13000E+01    0.22000E+01    0.91284E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.60000E+01    0.78594E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.43000E+01    0.85440E+00
 ARIEXC: peak, lower, upper, distance   78    0.19000E+01    0.60000E+01    0.75630E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.60000E+01    0.80240E+00
 ARIEXC: peak, lower, upper, distance   80    0.19000E+01    0.60000E+01    0.76271E+00
 ARIEXC: peak, lower, upper, distance   81    0.20000E+01    0.54000E+01    0.76116E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.60000E+01    0.79080E+00
 ARIEXC: peak, lower, upper, distance   83    0.17000E+01    0.31000E+01    0.83961E+00
 ARIEXC: peak, lower, upper, distance   84    0.20000E+01    0.50000E+01    0.83902E+00
 ARIEXC: peak, lower, upper, distance   85    0.20000E+01    0.56000E+01    0.79831E+00
 ARIEXC: peak, lower, upper, distance   87    0.15000E+01    0.25000E+01    0.88079E+00
 ARIEXC: peak, lower, upper, distance   88    0.19000E+01    0.39000E+01    0.83823E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.46000E+01    0.83420E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.40000E+01    0.80944E+00
 ARIEXC: peak, lower, upper, distance   92    0.20000E+01    0.60000E+01    0.78544E+00
 ARIEXC: peak, lower, upper, distance   93    0.20000E+01    0.60000E+01    0.84693E+00
 ARIEXC: peak, lower, upper, distance   94    0.19000E+01    0.45000E+01    0.86844E+00
 ARIEXC: peak, lower, upper, distance   95    0.20000E+01    0.56000E+01    0.84313E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.50000E+01    0.80627E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.56000E+01    0.85198E+00
 ARIEXC: peak, lower, upper, distance   98    0.20000E+01    0.48000E+01    0.85293E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.77784E+00
 ARIEXC: peak, lower, upper, distance  101    0.20000E+01    0.60000E+01    0.78725E+00
 ARIEXC: peak, lower, upper, distance  103    0.18000E+01    0.42000E+01    0.84008E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.56000E+01    0.81529E+00
 ARIEXC: peak, lower, upper, distance  105    0.17000E+01    0.60000E+01    0.76778E+00
 ARIEXC: peak, lower, upper, distance  106    0.20000E+01    0.60000E+01    0.79487E+00
 ARIEXC: peak, lower, upper, distance  107    0.20000E+01    0.60000E+01    0.82242E+00
 ARIEXC: peak, lower, upper, distance  108    0.17000E+01    0.31000E+01    0.85349E+00
 ARIEXC: peak, lower, upper, distance  109    0.18000E+01    0.36000E+01    0.88146E+00
 ARIEXC: peak, lower, upper, distance  110    0.20000E+01    0.48000E+01    0.77034E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.80289E+00
 ARIEXC: peak, lower, upper, distance  113    0.16000E+01    0.28000E+01    0.85460E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.75540E+00
 ARIEXC: peak, lower, upper, distance  115    0.19000E+01    0.47000E+01    0.81006E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.83430E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.85867E+00
 ARIEXC: peak, lower, upper, distance  118    0.19000E+01    0.60000E+01    0.77543E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.43000E+01    0.84243E+00
 ARIEXC: peak, lower, upper, distance  120    0.20000E+01    0.60000E+01    0.79664E+00
 ARIEXC: peak, lower, upper, distance  122    0.16000E+01    0.60000E+01    0.75103E+00
 ARIEXC: peak, lower, upper, distance  123    0.14000E+01    0.24000E+01    0.91295E+00
 ARIEXC: peak, lower, upper, distance  124    0.19000E+01    0.60000E+01    0.80032E+00
 ARIEXC: peak, lower, upper, distance  125    0.20000E+01    0.50000E+01    0.81199E+00
 ARIEXC: peak, lower, upper, distance  126    0.20000E+01    0.52000E+01    0.80189E+00
 ARIEXC: peak, lower, upper, distance  127    0.20000E+01    0.56000E+01    0.78306E+00
 ARIEXC: peak, lower, upper, distance  128    0.17000E+01    0.33000E+01    0.86769E+00
 ARIEXC: peak, lower, upper, distance  130    0.18000E+01    0.40000E+01    0.83804E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.82985E+00
 ARIEXC: peak, lower, upper, distance  132    0.20000E+01    0.50000E+01    0.81418E+00
 ARIEXC: peak, lower, upper, distance  133    0.17000E+01    0.35000E+01    0.87009E+00
 ARIEXC: peak, lower, upper, distance  134    0.19000E+01    0.51000E+01    0.80921E+00
 ARIEXC: peak, lower, upper, distance  135    0.19000E+01    0.39000E+01    0.84878E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.43000E+01    0.78498E+00
 ARIEXC: peak, lower, upper, distance  137    0.19000E+01    0.41000E+01    0.83790E+00
 ARIEXC: peak, lower, upper, distance  138    0.16000E+01    0.28000E+01    0.87596E+00
 ARIEXC: peak, lower, upper, distance  139    0.18000E+01    0.34000E+01    0.84785E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.60000E+01    0.78121E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.56000E+01    0.81782E+00
 ARIEXC: peak, lower, upper, distance  142    0.19000E+01    0.60000E+01    0.79986E+00
 ARIEXC: peak, lower, upper, distance  143    0.20000E+01    0.60000E+01    0.77668E+00
 ARIEXC: peak, lower, upper, distance  144    0.19000E+01    0.45000E+01    0.78306E+00
 ARIEXC: peak, lower, upper, distance  145    0.19000E+01    0.60000E+01    0.77657E+00
 ARIEXC: peak, lower, upper, distance  146    0.19000E+01    0.41000E+01    0.87175E+00
 ARIEXC: peak, lower, upper, distance  147    0.15000E+01    0.25000E+01    0.87924E+00
 ARIEXC: peak, lower, upper, distance  148    0.18000E+01    0.38000E+01    0.83495E+00
 ARIEXC: peak, lower, upper, distance  149    0.19000E+01    0.60000E+01    0.78388E+00
 ARIEXC: peak, lower, upper, distance  150    0.19000E+01    0.60000E+01    0.80191E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.45000E+01    0.84459E+00
 ARIEXC: peak, lower, upper, distance  152    0.20000E+01    0.60000E+01    0.74767E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.56000E+01    0.77696E+00
 ARIEXC: peak, lower, upper, distance  155    0.19000E+01    0.41000E+01    0.84897E+00
 ARIEXC: peak, lower, upper, distance  156    0.19000E+01    0.41000E+01    0.83651E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.60000E+01    0.77452E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.87687E+00
 ARIEXC: peak, lower, upper, distance  159    0.18000E+01    0.40000E+01    0.80519E+00
 ARIEXC: peak, lower, upper, distance  160    0.19000E+01    0.47000E+01    0.84834E+00
 ARIEXC: peak, lower, upper, distance  161    0.20000E+01    0.48000E+01    0.78621E+00
 ARIEXC: peak, lower, upper, distance  162    0.19000E+01    0.60000E+01    0.74442E+00
 ARIEXC: peak, lower, upper, distance  163    0.19000E+01    0.43000E+01    0.83785E+00
 ARIEXC: peak, lower, upper, distance  166    0.16000E+01    0.28000E+01    0.86338E+00
 ARIEXC: peak, lower, upper, distance  167    0.19000E+01    0.45000E+01    0.83700E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.60000E+01    0.79487E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.56000E+01    0.85983E+00
 ARIEXC: peak, lower, upper, distance  170    0.20000E+01    0.52000E+01    0.81710E+00
 ARIEXC: peak, lower, upper, distance  171    0.20000E+01    0.60000E+01    0.75643E+00
 ARIEXC: peak, lower, upper, distance  172    0.19000E+01    0.45000E+01    0.81285E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.56000E+01    0.77272E+00
 ARIEXC: peak, lower, upper, distance  175    0.20000E+01    0.60000E+01    0.79898E+00
 ARIEXC: peak, lower, upper, distance  176    0.16000E+01    0.26000E+01    0.87555E+00
 ARIEXC: peak, lower, upper, distance  177    0.18000E+01    0.40000E+01    0.83511E+00
 ARIEXC: peak, lower, upper, distance  179    0.18000E+01    0.36000E+01    0.84400E+00
 ARIEXC: peak, lower, upper, distance  180    0.20000E+01    0.60000E+01    0.79610E+00
 ARIEXC: peak, lower, upper, distance  181    0.18000E+01    0.60000E+01    0.76374E+00
 ARIEXC: peak, lower, upper, distance  182    0.18000E+01    0.38000E+01    0.84632E+00
 ARIEXC: peak, lower, upper, distance  183    0.19000E+01    0.39000E+01    0.84446E+00
 ARIEXC: peak, lower, upper, distance  184    0.18000E+01    0.34000E+01    0.87671E+00
 ARIEXC: peak, lower, upper, distance  185    0.20000E+01    0.50000E+01    0.83834E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.54000E+01    0.80956E+00
 ARIEXC: peak, lower, upper, distance  187    0.18000E+01    0.34000E+01    0.85251E+00
 ARIEXC: peak, lower, upper, distance  188    0.19000E+01    0.60000E+01    0.79262E+00
 ARIEXC: peak, lower, upper, distance  189    0.19000E+01    0.60000E+01    0.80548E+00
 ARIEXC: peak, lower, upper, distance  190    0.20000E+01    0.52000E+01    0.81860E+00
 ARIEXC: peak, lower, upper, distance  191    0.19000E+01    0.39000E+01    0.83760E+00
 ARIEXC: peak, lower, upper, distance  192    0.18000E+01    0.40000E+01    0.81137E+00
 ARIEXC: peak, lower, upper, distance  196    0.19000E+01    0.43000E+01    0.83546E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.80844E+00
 ARIEXC: peak, lower, upper, distance  198    0.19000E+01    0.45000E+01    0.85550E+00
 ARIEXC: peak, lower, upper, distance  199    0.19000E+01    0.43000E+01    0.83529E+00
 ARIEXC: peak, lower, upper, distance  200    0.20000E+01    0.54000E+01    0.87787E+00
 ARIEXC: peak, lower, upper, distance  201    0.20000E+01    0.56000E+01    0.82259E+00
 ARIEXC: peak, lower, upper, distance  202    0.19000E+01    0.43000E+01    0.84875E+00
 ARIEXC: peak, lower, upper, distance  203    0.20000E+01    0.56000E+01    0.82154E+00
 ARIEXC: peak, lower, upper, distance  204    0.20000E+01    0.56000E+01    0.80334E+00
 ARIEXC: peak, lower, upper, distance  205    0.16000E+01    0.28000E+01    0.87188E+00
 ARIEXC: peak, lower, upper, distance  206    0.19000E+01    0.60000E+01    0.75621E+00
 ARIEXC: peak, lower, upper, distance  207    0.20000E+01    0.60000E+01    0.76917E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.46000E+01    0.83344E+00
 ARIEXC: peak, lower, upper, distance  209    0.19000E+01    0.47000E+01    0.82115E+00
 ARIEXC: peak, lower, upper, distance  211    0.19000E+01    0.41000E+01    0.83700E+00
 ARIEXC: peak, lower, upper, distance  212    0.18000E+01    0.34000E+01    0.83489E+00
 ARIEXC: peak, lower, upper, distance  213    0.20000E+01    0.60000E+01    0.79555E+00
 ARIEXC: peak, lower, upper, distance  214    0.20000E+01    0.60000E+01    0.77659E+00
 ARIEXC: peak, lower, upper, distance  215    0.20000E+01    0.50000E+01    0.84717E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.60000E+01    0.77693E+00
 ARIEXC: peak, lower, upper, distance  217    0.19000E+01    0.60000E+01    0.77641E+00
 ARIEXC: peak, lower, upper, distance  218    0.20000E+01    0.46000E+01    0.83573E+00
 ARIEXC: peak, lower, upper, distance  219    0.16000E+01    0.30000E+01    0.87553E+00
 ARIEXC: peak, lower, upper, distance  220    0.20000E+01    0.48000E+01    0.80463E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.43000E+01    0.84622E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.47000E+01    0.81960E+00
 ARIEXC: peak, lower, upper, distance  224    0.17000E+01    0.33000E+01    0.86858E+00
 ARIEXC: peak, lower, upper, distance  225    0.19000E+01    0.47000E+01    0.85323E+00
 ARIEXC: peak, lower, upper, distance  226    0.19000E+01    0.60000E+01    0.77382E+00
 ARIEXC: peak, lower, upper, distance  227    0.19000E+01    0.47000E+01    0.83118E+00
 ARIEXC: peak, lower, upper, distance  228    0.20000E+01    0.60000E+01    0.78253E+00
 ARIEXC: peak, lower, upper, distance  230    0.19000E+01    0.41000E+01    0.83536E+00
 ARIEXC: peak, lower, upper, distance  231    0.19000E+01    0.51000E+01    0.85231E+00
 ARIEXC: peak, lower, upper, distance  232    0.20000E+01    0.52000E+01    0.84304E+00
 ARIEXC: peak, lower, upper, distance  233    0.19000E+01    0.60000E+01    0.81390E+00
 ARIEXC: peak, lower, upper, distance  234    0.19000E+01    0.60000E+01    0.84417E+00
 ARIEXC: peak, lower, upper, distance  237    0.17000E+01    0.35000E+01    0.89513E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.76883E+00
 ARIEXC: peak, lower, upper, distance  239    0.18000E+01    0.36000E+01    0.83537E+00
 ARIEXC: peak, lower, upper, distance  240    0.20000E+01    0.50000E+01    0.83553E+00
 ARIEXC: peak, lower, upper, distance  241    0.19000E+01    0.43000E+01    0.79548E+00
 ARIEXC: peak, lower, upper, distance  242    0.17000E+01    0.33000E+01    0.91632E+00
 ARIEXC: peak, lower, upper, distance  243    0.20000E+01    0.60000E+01    0.80694E+00
 ARIEXC: peak, lower, upper, distance  245    0.19000E+01    0.49000E+01    0.86030E+00
 ARIEXC: peak, lower, upper, distance  246    0.17000E+01    0.31000E+01    0.86199E+00
 ARIEXC: peak, lower, upper, distance  247    0.18000E+01    0.60000E+01    0.79004E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.47000E+01    0.84088E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.36000E+01    0.86209E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.80153E+00
 ARIEXC: peak, lower, upper, distance  253    0.15000E+01    0.27000E+01    0.88038E+00
 ARIEXC: peak, lower, upper, distance  255    0.19000E+01    0.45000E+01    0.80811E+00
 ARIEXC: peak, lower, upper, distance  256    0.20000E+01    0.50000E+01    0.79650E+00
 ARIEXC: peak, lower, upper, distance  257    0.18000E+01    0.34000E+01    0.83963E+00
 ARIEXC: peak, lower, upper, distance  258    0.20000E+01    0.58000E+01    0.79993E+00
 ARIEXC: peak, lower, upper, distance  259    0.20000E+01    0.56000E+01    0.89338E+00
 ARIEXC: peak, lower, upper, distance  260    0.19000E+01    0.43000E+01    0.80772E+00
 ARIEXC: peak, lower, upper, distance  262    0.18000E+01    0.38000E+01    0.83915E+00
 ARIEXC: peak, lower, upper, distance  264    0.18000E+01    0.36000E+01    0.83043E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.60000E+01    0.77644E+00
 ARIEXC: peak, lower, upper, distance  266    0.17000E+01    0.60000E+01    0.78805E+00
 ARIEXC: peak, lower, upper, distance    1    0.20000E+01    0.52000E+01    0.84067E+00
 ARIEXC: peak, lower, upper, distance    2    0.16000E+01    0.30000E+01    0.86103E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.60000E+01    0.78527E+00
 ARIEXC: peak, lower, upper, distance    4    0.11000E+01    0.60000E+01    0.74107E+00
 ARIEXC: peak, lower, upper, distance    5    0.20000E+01    0.58000E+01    0.79828E+00
 ARIEXC: peak, lower, upper, distance    6    0.20000E+01    0.60000E+01    0.75983E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.50000E+01    0.79966E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.60000E+01    0.76548E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.56000E+01    0.84108E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.60000E+01    0.78928E+00
 ARIEXC: peak, lower, upper, distance   12    0.19000E+01    0.60000E+01    0.80404E+00
 ARIEXC: peak, lower, upper, distance   13    0.18000E+01    0.36000E+01    0.83575E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.84195E+00
 ARIEXC: peak, lower, upper, distance   16    0.18000E+01    0.60000E+01    0.75749E+00
 ARIEXC: peak, lower, upper, distance   17    0.17000E+01    0.35000E+01    0.88322E+00
 ARIEXC: peak, lower, upper, distance   20    0.19000E+01    0.60000E+01    0.77258E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.60000E+01    0.79616E+00
 ARIEXC: peak, lower, upper, distance   24    0.19000E+01    0.49000E+01    0.80690E+00
 ARIEXC: peak, lower, upper, distance   25    0.14000E+01    0.24000E+01    0.84467E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.84069E+00
 ARIEXC: peak, lower, upper, distance   42    0.20000E+01    0.58000E+01    0.78297E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.60000E+01    0.73281E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.43000E+01    0.78137E+00
 ARIEXC: peak, lower, upper, distance   56    0.20000E+01    0.60000E+01    0.78093E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.58000E+01    0.76648E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.58000E+01    0.76472E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.78560E+00
 ARIEXC: peak, lower, upper, distance   66    0.20000E+01    0.46000E+01    0.84142E+00
 ARIEXC: peak, lower, upper, distance   67    0.20000E+01    0.52000E+01    0.81487E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.33000E+01    0.86043E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.47000E+01    0.82772E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.60000E+01    0.79037E+00
 ARIEXC: peak, lower, upper, distance   71    0.17000E+01    0.33000E+01    0.83230E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.80303E+00
 ARIEXC: peak, lower, upper, distance   73    0.16000E+01    0.26000E+01    0.85419E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.52000E+01    0.82096E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.60000E+01    0.76949E+00
 ARIEXC: peak, lower, upper, distance   77    0.16000E+01    0.28000E+01    0.86175E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.58000E+01    0.79876E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.56000E+01    0.79889E+00
 ARIEXC: peak, lower, upper, distance   80    0.17000E+01    0.33000E+01    0.83930E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.50000E+01    0.85989E+00
 ARIEXC: peak, lower, upper, distance   83    0.19000E+01    0.60000E+01    0.74020E+00
 ARIEXC: peak, lower, upper, distance   84    0.17000E+01    0.35000E+01    0.86160E+00
 ARIEXC: peak, lower, upper, distance   85    0.19000E+01    0.41000E+01    0.79220E+00
 ARIEXC: peak, lower, upper, distance   86    0.20000E+01    0.54000E+01    0.79519E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.54000E+01    0.78784E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.77349E+00
 ARIEXC: peak, lower, upper, distance   91    0.18000E+01    0.40000E+01    0.89953E+00
 ARIEXC: peak, lower, upper, distance   93    0.19000E+01    0.39000E+01    0.85393E+00
 ARIEXC: peak, lower, upper, distance   95    0.19000E+01    0.39000E+01    0.82234E+00
 ARIEXC: peak, lower, upper, distance   96    0.18000E+01    0.60000E+01    0.74344E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.60000E+01    0.75581E+00
 ARIEXC: peak, lower, upper, distance   98    0.17000E+01    0.33000E+01    0.85021E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.80073E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.45000E+01    0.89952E+00
 ARIEXC: peak, lower, upper, distance  102    0.18000E+01    0.38000E+01    0.80257E+00
 ARIEXC: peak, lower, upper, distance  103    0.19000E+01    0.60000E+01    0.76938E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.46000E+01    0.85445E+00
 ARIEXC: peak, lower, upper, distance  105    0.20000E+01    0.60000E+01    0.76767E+00
 ARIEXC: peak, lower, upper, distance  106    0.19000E+01    0.43000E+01    0.84377E+00
 ARIEXC: peak, lower, upper, distance  107    0.18000E+01    0.40000E+01    0.79875E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.73949E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.79343E+00
 ARIEXC: peak, lower, upper, distance  112    0.19000E+01    0.60000E+01    0.86084E+00
 ARIEXC: peak, lower, upper, distance  113    0.20000E+01    0.54000E+01    0.74815E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.78545E+00
 ARIEXC: peak, lower, upper, distance  115    0.18000E+01    0.40000E+01    0.86090E+00
 ARIEXC: peak, lower, upper, distance  116    0.20000E+01    0.50000E+01    0.83419E+00
 ARIEXC: peak, lower, upper, distance  117    0.20000E+01    0.60000E+01    0.83936E+00
 COUNTV:  839 violations above         0.10000
 ARIA>      end 
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_6.float opened.
 ARIA> REVE ((segid "    " and resid 2    and name HB1 ) OR   ( segid "    " and resid 2    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HB1 ) OR   ( segid "    " and resid 3    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 4    and name HB1 ) OR   ( segid "    " and resid 4    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HB1 ) OR   ( segid "    " and resid 5    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HD11) OR   ( segid "    " and resid 6    and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HB1 ) OR   ( segid "    " and resid 7    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HG1 ) OR   ( segid "    " and resid 7    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HD1 ) OR   ( segid "    " and resid 7    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HB1 ) OR   ( segid "    " and resid 8    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HG1 ) OR   ( segid "    " and resid 11   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HB1 ) OR   ( segid "    " and resid 12   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 12   and name HG1 ) OR   ( segid "    " and resid 12   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH11) OR   ( segid "    " and resid 13   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH21) OR   ( segid "    " and resid 13   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 15   and name HB1 ) OR   ( segid "    " and resid 15   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 16   and name HG11) OR   ( segid "    " and resid 16   and name HG21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 17   and name HD11) OR   ( segid "    " and resid 17   and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HB1 ) OR   ( segid "    " and resid 19   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HD1 ) OR   ( segid "    " and resid 19   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HH11) OR   ( segid "    " and resid 19   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HH21) OR   ( segid "    " and resid 19   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 24   and name HD21) OR   ( segid "    " and resid 24   and name HD22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HG1 ) OR   ( segid "    " and resid 26   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 27   and name HB1 ) OR   ( segid "    " and resid 27   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HD1 ) OR   ( segid "    " and resid 28   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH21) OR   ( segid "    " and resid 28   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 32   and name HB1 ) OR   ( segid "    " and resid 32   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HG1 ) OR   ( segid "    " and resid 33   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HB1 ) OR   ( segid "    " and resid 34   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HG1 ) OR   ( segid "    " and resid 34   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HD1 ) OR   ( segid "    " and resid 34   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH11) OR   ( segid "    " and resid 34   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 36   and name HB1 ) OR   ( segid "    " and resid 36   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HB1 ) OR   ( segid "    " and resid 38   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HG1 ) OR   ( segid "    " and resid 38   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($count=$count+1) 
 EVALUATE: symbol $COUNT set to    7.00000     (real)
 CNSsolve>end loop main 
 CNSsolve>while ($count le $Iterations.Assignstruct) loop main 
 NEXTCD: condition evaluated as true
 CNSsolve>   evaluate ($file = $filenames.bestfile_$count) 
 EVALUATE: symbol $FILE set to "PREVIT:ww1_7.pdb" (string)
 CNSsolve>   display $file 
PREVIT:ww1_7.pdb
 CNSsolve>   coor init end 
 COOR: selected main coordinates initialized
 CNSsolve>   if ($file ne "") then 
 NEXTCD: condition evaluated as true
 CNSsolve>      coor @@$file 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_7.pdb opened.
 COOR>REMARK FILENAME="/usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_7.pdb" 
 COOR>REMARK =============================================================== 
 COOR>REMARK            overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK energies: 248.999, 2.8282, 22.8529, 4.40326, 178.511, 30.4457, 0, 8.76748, 1.19066, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK            bonds,angles,impropers,dihe,noe,cdih,coup,sani,dani,vean 
 COOR>REMARK rms-dev.: 2.112082E-03,0.362314,0.288227,41.4574,1.395202E-02,0.590756,0,0,0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK               noe,cdih,coup,sani,dani,vean 
 COOR>REMARK               >0.3,>5,>1,>0,>5 
 COOR>REMARK violations.: 0, 0, 0, 0, 0, 0 
 COOR>REMARK =============================================================== 
 COOR>REMARK DATE:02-Mar-2010  14:02:33       created by user: fkieken 
 COOR>REMARK VERSION:1.1 
 COOR>ATOM      1  HA1 GLY     1      -1.694 -11.915  -6.749  1.00  0.00 
 COOR>ATOM      2  HA2 GLY     1      -1.376 -10.237  -6.336  1.00  0.00 
 CNSsolve>      eval ($floatfile = $file - ".pdb" + ".float") 
 EVALUATE: symbol $FLOATFILE set to "PREVIT:ww1_7.float" (string)
 CNSsolve>      fileexist $floatfile end  eval ($qfloatfile = $result) 
 MISCOM: file exists
 EVALUATE: symbol $QFLOATFILE set to TRUE (logical)
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_7.float opened.
 ARIA> REVE ((segid "    " and resid 1    and name HA1 ) OR   ( segid "    " and resid 1    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 2    and name HB1 ) OR   ( segid "    " and resid 2    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HD1 ) OR   ( segid "    " and resid 3    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 4    and name HB1 ) OR   ( segid "    " and resid 4    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HB1 ) OR   ( segid "    " and resid 5    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HG1 ) OR   ( segid "    " and resid 5    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HD11) OR   ( segid "    " and resid 6    and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HB1 ) OR   ( segid "    " and resid 7    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HG1 ) OR   ( segid "    " and resid 7    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HD1 ) OR   ( segid "    " and resid 7    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HG1 ) OR   ( segid "    " and resid 8    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HD1 ) OR   ( segid "    " and resid 8    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HG1 ) OR   ( segid "    " and resid 11   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH11) OR   ( segid "    " and resid 13   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH21) OR   ( segid "    " and resid 13   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 15   and name HB1 ) OR   ( segid "    " and resid 15   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 16   and name HG11) OR   ( segid "    " and resid 16   and name HG21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HB1 ) OR   ( segid "    " and resid 19   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HG1 ) OR   ( segid "    " and resid 19   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH11) OR   ( segid "    " and resid 28   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HB1 ) OR   ( segid "    " and resid 33   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HD1 ) OR   ( segid "    " and resid 33   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HE1 ) OR   ( segid "    " and resid 33   and name HE2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HG1 ) OR   ( segid "    " and resid 34   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 36   and name HB1 ) OR   ( segid "    " and resid 36   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HB1 ) OR   ( segid "    " and resid 38   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 39   and name HB1 ) OR   ( segid "    " and resid 39   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>      aria 
 ARIA>         analyse_restraints aver end 
DISACC: accumulating distance matrix with dimension  269
 AMBVAC: read in   990 distances in mode ACCU
 ARIA>         countvio threshold $Iterations.violtoler end 
 ARIEXC: peak, lower, upper, distance    1    0.18000E+01    0.36000E+01    0.84082E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.48000E+01    0.86058E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.45000E+01    0.83585E+00
 ARIEXC: peak, lower, upper, distance    5    0.19000E+01    0.47000E+01    0.85895E+00
 ARIEXC: peak, lower, upper, distance    6    0.18000E+01    0.36000E+01    0.86348E+00
 ARIEXC: peak, lower, upper, distance    7    0.19000E+01    0.53000E+01    0.83413E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.43000E+01    0.80530E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.54000E+01    0.77222E+00
 ARIEXC: peak, lower, upper, distance   13    0.20000E+01    0.58000E+01    0.83864E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.86652E+00
 ARIEXC: peak, lower, upper, distance   15    0.18000E+01    0.36000E+01    0.86667E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.45000E+01    0.85543E+00
 ARIEXC: peak, lower, upper, distance   17    0.19000E+01    0.60000E+01    0.80855E+00
 ARIEXC: peak, lower, upper, distance   21    0.13000E+01    0.22000E+01    0.91023E+00
 ARIEXC: peak, lower, upper, distance   23    0.13000E+01    0.60000E+01    0.85615E+00
 ARIEXC: peak, lower, upper, distance   24    0.20000E+01    0.60000E+01    0.80408E+00
 ARIEXC: peak, lower, upper, distance   26    0.15000E+01    0.27000E+01    0.86654E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.43000E+01    0.87507E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.84527E+00
 ARIEXC: peak, lower, upper, distance   30    0.18000E+01    0.38000E+01    0.80451E+00
 ARIEXC: peak, lower, upper, distance   31    0.18000E+01    0.36000E+01    0.81803E+00
 ARIEXC: peak, lower, upper, distance   33    0.18000E+01    0.60000E+01    0.78805E+00
 ARIEXC: peak, lower, upper, distance   34    0.19000E+01    0.49000E+01    0.83870E+00
 ARIEXC: peak, lower, upper, distance   35    0.19000E+01    0.60000E+01    0.75670E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.41000E+01    0.77947E+00
 ARIEXC: peak, lower, upper, distance   43    0.13000E+01    0.22000E+01    0.91111E+00
 ARIEXC: peak, lower, upper, distance   44    0.16000E+01    0.30000E+01    0.85619E+00
 ARIEXC: peak, lower, upper, distance   45    0.17000E+01    0.33000E+01    0.85701E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.43000E+01    0.89396E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.79229E+00
 ARIEXC: peak, lower, upper, distance   52    0.18000E+01    0.34000E+01    0.86267E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.41000E+01    0.83587E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.46000E+01    0.80108E+00
 ARIEXC: peak, lower, upper, distance   57    0.19000E+01    0.51000E+01    0.75809E+00
 ARIEXC: peak, lower, upper, distance   59    0.17000E+01    0.31000E+01    0.86020E+00
 ARIEXC: peak, lower, upper, distance   60    0.18000E+01    0.40000E+01    0.80795E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.86649E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.60000E+01    0.75770E+00
 ARIEXC: peak, lower, upper, distance   63    0.20000E+01    0.58000E+01    0.74570E+00
 ARIEXC: peak, lower, upper, distance   64    0.19000E+01    0.53000E+01    0.83680E+00
 ARIEXC: peak, lower, upper, distance   65    0.16000E+01    0.28000E+01    0.89017E+00
 ARIEXC: peak, lower, upper, distance   66    0.16000E+01    0.28000E+01    0.84567E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.41000E+01    0.83194E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.31000E+01    0.85807E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.60000E+01    0.86328E+00
 ARIEXC: peak, lower, upper, distance   71    0.19000E+01    0.45000E+01    0.86359E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.80705E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.41000E+01    0.83475E+00
 ARIEXC: peak, lower, upper, distance   76    0.20000E+01    0.52000E+01    0.86938E+00
 ARIEXC: peak, lower, upper, distance   77    0.13000E+01    0.22000E+01    0.91068E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.48000E+01    0.84191E+00
 ARIEXC: peak, lower, upper, distance   82    0.19000E+01    0.60000E+01    0.77920E+00
 ARIEXC: peak, lower, upper, distance   86    0.19000E+01    0.60000E+01    0.79518E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.79482E+00
 ARIEXC: peak, lower, upper, distance   91    0.19000E+01    0.60000E+01    0.79515E+00
 ARIEXC: peak, lower, upper, distance   93    0.16000E+01    0.26000E+01    0.87183E+00
 ARIEXC: peak, lower, upper, distance   95    0.11000E+01    0.60000E+01    0.81683E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.60000E+01    0.78830E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.41000E+01    0.85990E+00
 ARIEXC: peak, lower, upper, distance  100    0.20000E+01    0.56000E+01    0.76968E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.41000E+01    0.82031E+00
 ARIEXC: peak, lower, upper, distance  102    0.15000E+01    0.25000E+01    0.87159E+00
 ARIEXC: peak, lower, upper, distance  103    0.20000E+01    0.60000E+01    0.79566E+00
 ARIEXC: peak, lower, upper, distance  104    0.18000E+01    0.42000E+01    0.86335E+00
 ARIEXC: peak, lower, upper, distance  105    0.19000E+01    0.53000E+01    0.80225E+00
 ARIEXC: peak, lower, upper, distance  108    0.18000E+01    0.36000E+01    0.85846E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.82407E+00
 ARIEXC: peak, lower, upper, distance  110    0.17000E+01    0.29000E+01    0.85490E+00
 ARIEXC: peak, lower, upper, distance  112    0.20000E+01    0.60000E+01    0.80227E+00
 ARIEXC: peak, lower, upper, distance  113    0.19000E+01    0.43000E+01    0.85212E+00
 ARIEXC: peak, lower, upper, distance  114    0.20000E+01    0.58000E+01    0.77405E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.85476E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.81201E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.60000E+01    0.74787E+00
 ARIEXC: peak, lower, upper, distance  120    0.17000E+01    0.31000E+01    0.85503E+00
 ARIEXC: peak, lower, upper, distance  121    0.20000E+01    0.60000E+01    0.79312E+00
 ARIEXC: peak, lower, upper, distance  122    0.19000E+01    0.60000E+01    0.83877E+00
 ARIEXC: peak, lower, upper, distance  123    0.20000E+01    0.50000E+01    0.82362E+00
 ARIEXC: peak, lower, upper, distance  124    0.17000E+01    0.33000E+01    0.86156E+00
 ARIEXC: peak, lower, upper, distance  126    0.19000E+01    0.49000E+01    0.80658E+00
 ARIEXC: peak, lower, upper, distance  127    0.19000E+01    0.43000E+01    0.84230E+00
 ARIEXC: peak, lower, upper, distance  128    0.19000E+01    0.51000E+01    0.76072E+00
 ARIEXC: peak, lower, upper, distance  129    0.19000E+01    0.43000E+01    0.80399E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.75845E+00
 ARIEXC: peak, lower, upper, distance  132    0.19000E+01    0.45000E+01    0.80866E+00
 ARIEXC: peak, lower, upper, distance  133    0.19000E+01    0.60000E+01    0.85906E+00
 ARIEXC: peak, lower, upper, distance  134    0.20000E+01    0.48000E+01    0.81555E+00
 ARIEXC: peak, lower, upper, distance  135    0.17000E+01    0.60000E+01    0.78691E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.39000E+01    0.83592E+00
 ARIEXC: peak, lower, upper, distance  137    0.17000E+01    0.31000E+01    0.87213E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.52000E+01    0.82859E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.54000E+01    0.81436E+00
 ARIEXC: peak, lower, upper, distance  143    0.13000E+01    0.22000E+01    0.91041E+00
 ARIEXC: peak, lower, upper, distance  146    0.18000E+01    0.36000E+01    0.83434E+00
 ARIEXC: peak, lower, upper, distance  148    0.14000E+01    0.60000E+01    0.77528E+00
 ARIEXC: peak, lower, upper, distance  149    0.18000E+01    0.38000E+01    0.85951E+00
 ARIEXC: peak, lower, upper, distance  150    0.20000E+01    0.50000E+01    0.81445E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.60000E+01    0.74002E+00
 ARIEXC: peak, lower, upper, distance  153    0.19000E+01    0.60000E+01    0.75502E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.60000E+01    0.77169E+00
 ARIEXC: peak, lower, upper, distance  155    0.15000E+01    0.25000E+01    0.88006E+00
 ARIEXC: peak, lower, upper, distance  156    0.18000E+01    0.36000E+01    0.83733E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.43000E+01    0.83313E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.85028E+00
 ARIEXC: peak, lower, upper, distance  160    0.20000E+01    0.58000E+01    0.80307E+00
 ARIEXC: peak, lower, upper, distance  162    0.17000E+01    0.60000E+01    0.76253E+00
 ARIEXC: peak, lower, upper, distance  164    0.19000E+01    0.60000E+01    0.78028E+00
 ARIEXC: peak, lower, upper, distance  165    0.20000E+01    0.46000E+01    0.81314E+00
 ARIEXC: peak, lower, upper, distance  166    0.20000E+01    0.50000E+01    0.81057E+00
 ARIEXC: peak, lower, upper, distance  167    0.17000E+01    0.33000E+01    0.87415E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.39000E+01    0.84883E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.60000E+01    0.79988E+00
 ARIEXC: peak, lower, upper, distance  170    0.18000E+01    0.60000E+01    0.76669E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.46000E+01    0.78537E+00
 ARIEXC: peak, lower, upper, distance  174    0.20000E+01    0.52000E+01    0.78023E+00
 ARIEXC: peak, lower, upper, distance  175    0.19000E+01    0.43000E+01    0.83489E+00
 ARIEXC: peak, lower, upper, distance  177    0.20000E+01    0.52000E+01    0.76408E+00
 ARIEXC: peak, lower, upper, distance  178    0.20000E+01    0.60000E+01    0.76231E+00
 ARIEXC: peak, lower, upper, distance  180    0.19000E+01    0.45000E+01    0.85592E+00
 ARIEXC: peak, lower, upper, distance  181    0.14000E+01    0.60000E+01    0.81546E+00
 ARIEXC: peak, lower, upper, distance  183    0.20000E+01    0.60000E+01    0.80130E+00
 ARIEXC: peak, lower, upper, distance  184    0.20000E+01    0.48000E+01    0.82555E+00
 ARIEXC: peak, lower, upper, distance  185    0.18000E+01    0.60000E+01    0.79645E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.58000E+01    0.84298E+00
 ARIEXC: peak, lower, upper, distance  188    0.20000E+01    0.60000E+01    0.76255E+00
 ARIEXC: peak, lower, upper, distance  189    0.20000E+01    0.60000E+01    0.86284E+00
 ARIEXC: peak, lower, upper, distance  190    0.19000E+01    0.60000E+01    0.79019E+00
 ARIEXC: peak, lower, upper, distance  191    0.18000E+01    0.60000E+01    0.81078E+00
 ARIEXC: peak, lower, upper, distance  193    0.17000E+01    0.33000E+01    0.83766E+00
 ARIEXC: peak, lower, upper, distance  194    0.19000E+01    0.60000E+01    0.78770E+00
 ARIEXC: peak, lower, upper, distance  195    0.17000E+01    0.60000E+01    0.81428E+00
 ARIEXC: peak, lower, upper, distance  196    0.17000E+01    0.31000E+01    0.83166E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.74083E+00
 ARIEXC: peak, lower, upper, distance  198    0.18000E+01    0.36000E+01    0.83829E+00
 ARIEXC: peak, lower, upper, distance  199    0.15000E+01    0.23000E+01    0.87868E+00
 ARIEXC: peak, lower, upper, distance  200    0.17000E+01    0.31000E+01    0.86234E+00
 ARIEXC: peak, lower, upper, distance  201    0.19000E+01    0.60000E+01    0.79120E+00
 ARIEXC: peak, lower, upper, distance  203    0.19000E+01    0.41000E+01    0.87080E+00
 ARIEXC: peak, lower, upper, distance  205    0.20000E+01    0.52000E+01    0.79230E+00
 ARIEXC: peak, lower, upper, distance  206    0.20000E+01    0.56000E+01    0.73760E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.60000E+01    0.77643E+00
 ARIEXC: peak, lower, upper, distance  209    0.18000E+01    0.40000E+01    0.84097E+00
 ARIEXC: peak, lower, upper, distance  212    0.19000E+01    0.41000E+01    0.85131E+00
 ARIEXC: peak, lower, upper, distance  213    0.17000E+01    0.33000E+01    0.79777E+00
 ARIEXC: peak, lower, upper, distance  214    0.18000E+01    0.40000E+01    0.83701E+00
 ARIEXC: peak, lower, upper, distance  215    0.19000E+01    0.43000E+01    0.82053E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.47000E+01    0.79935E+00
 ARIEXC: peak, lower, upper, distance  217    0.15000E+01    0.60000E+01    0.78043E+00
 ARIEXC: peak, lower, upper, distance  219    0.17000E+01    0.31000E+01    0.85458E+00
 ARIEXC: peak, lower, upper, distance  220    0.18000E+01    0.36000E+01    0.83188E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.49000E+01    0.79921E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.51000E+01    0.86500E+00
 ARIEXC: peak, lower, upper, distance  223    0.19000E+01    0.49000E+01    0.80375E+00
 ARIEXC: peak, lower, upper, distance  224    0.20000E+01    0.58000E+01    0.84306E+00
 ARIEXC: peak, lower, upper, distance  226    0.20000E+01    0.52000E+01    0.79738E+00
 ARIEXC: peak, lower, upper, distance  227    0.20000E+01    0.60000E+01    0.82609E+00
 ARIEXC: peak, lower, upper, distance  230    0.20000E+01    0.56000E+01    0.86920E+00
 ARIEXC: peak, lower, upper, distance  231    0.20000E+01    0.56000E+01    0.80830E+00
 ARIEXC: peak, lower, upper, distance  232    0.13000E+01    0.22000E+01    0.91006E+00
 ARIEXC: peak, lower, upper, distance  236    0.20000E+01    0.56000E+01    0.81102E+00
 ARIEXC: peak, lower, upper, distance  237    0.19000E+01    0.60000E+01    0.77821E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.77124E+00
 ARIEXC: peak, lower, upper, distance  239    0.19000E+01    0.60000E+01    0.77544E+00
 ARIEXC: peak, lower, upper, distance  241    0.17000E+01    0.60000E+01    0.78323E+00
 ARIEXC: peak, lower, upper, distance  242    0.20000E+01    0.60000E+01    0.80279E+00
 ARIEXC: peak, lower, upper, distance  243    0.19000E+01    0.51000E+01    0.84542E+00
 ARIEXC: peak, lower, upper, distance  244    0.18000E+01    0.34000E+01    0.85866E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.41000E+01    0.80782E+00
 ARIEXC: peak, lower, upper, distance  249    0.19000E+01    0.39000E+01    0.85202E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.38000E+01    0.85492E+00
 ARIEXC: peak, lower, upper, distance  251    0.18000E+01    0.38000E+01    0.86931E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.76628E+00
 ARIEXC: peak, lower, upper, distance  253    0.19000E+01    0.60000E+01    0.81092E+00
 ARIEXC: peak, lower, upper, distance  258    0.17000E+01    0.33000E+01    0.85855E+00
 ARIEXC: peak, lower, upper, distance  259    0.17000E+01    0.31000E+01    0.83216E+00
 ARIEXC: peak, lower, upper, distance  260    0.20000E+01    0.60000E+01    0.76513E+00
 ARIEXC: peak, lower, upper, distance  261    0.20000E+01    0.60000E+01    0.77605E+00
 ARIEXC: peak, lower, upper, distance  262    0.19000E+01    0.45000E+01    0.78730E+00
 ARIEXC: peak, lower, upper, distance  263    0.20000E+01    0.52000E+01    0.80896E+00
 ARIEXC: peak, lower, upper, distance  264    0.15000E+01    0.25000E+01    0.87781E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.43000E+01    0.87913E+00
 ARIEXC: peak, lower, upper, distance  266    0.19000E+01    0.43000E+01    0.83536E+00
 ARIEXC: peak, lower, upper, distance  269    0.20000E+01    0.52000E+01    0.79353E+00
 ARIEXC: peak, lower, upper, distance  270    0.16000E+01    0.30000E+01    0.85865E+00
 ARIEXC: peak, lower, upper, distance  271    0.20000E+01    0.60000E+01    0.80559E+00
 ARIEXC: peak, lower, upper, distance  272    0.19000E+01    0.43000E+01    0.80804E+00
 ARIEXC: peak, lower, upper, distance  273    0.20000E+01    0.60000E+01    0.83223E+00
 ARIEXC: peak, lower, upper, distance  274    0.19000E+01    0.60000E+01    0.78965E+00
 ARIEXC: peak, lower, upper, distance  275    0.19000E+01    0.47000E+01    0.82716E+00
 ARIEXC: peak, lower, upper, distance  276    0.20000E+01    0.56000E+01    0.79843E+00
 ARIEXC: peak, lower, upper, distance  277    0.18000E+01    0.36000E+01    0.86415E+00
 ARIEXC: peak, lower, upper, distance  279    0.20000E+01    0.54000E+01    0.77766E+00
 ARIEXC: peak, lower, upper, distance  280    0.20000E+01    0.60000E+01    0.74051E+00
 ARIEXC: peak, lower, upper, distance  282    0.18000E+01    0.60000E+01    0.83707E+00
 ARIEXC: peak, lower, upper, distance  283    0.20000E+01    0.60000E+01    0.84563E+00
 ARIEXC: peak, lower, upper, distance  284    0.17000E+01    0.60000E+01    0.87198E+00
 ARIEXC: peak, lower, upper, distance  288    0.19000E+01    0.47000E+01    0.83633E+00
 ARIEXC: peak, lower, upper, distance  289    0.19000E+01    0.51000E+01    0.85214E+00
 ARIEXC: peak, lower, upper, distance  291    0.17000E+01    0.31000E+01    0.83551E+00
 ARIEXC: peak, lower, upper, distance  292    0.17000E+01    0.35000E+01    0.84743E+00
 ARIEXC: peak, lower, upper, distance  293    0.17000E+01    0.60000E+01    0.74399E+00
 ARIEXC: peak, lower, upper, distance  294    0.17000E+01    0.60000E+01    0.74766E+00
 ARIEXC: peak, lower, upper, distance  296    0.19000E+01    0.49000E+01    0.83521E+00
 ARIEXC: peak, lower, upper, distance  297    0.18000E+01    0.40000E+01    0.86301E+00
 ARIEXC: peak, lower, upper, distance  298    0.19000E+01    0.60000E+01    0.80116E+00
 ARIEXC: peak, lower, upper, distance  299    0.20000E+01    0.60000E+01    0.84864E+00
 ARIEXC: peak, lower, upper, distance  300    0.19000E+01    0.60000E+01    0.88096E+00
 ARIEXC: peak, lower, upper, distance  307    0.13000E+01    0.22000E+01    0.91030E+00
 ARIEXC: peak, lower, upper, distance  310    0.20000E+01    0.60000E+01    0.77780E+00
 ARIEXC: peak, lower, upper, distance  311    0.18000E+01    0.60000E+01    0.74317E+00
 ARIEXC: peak, lower, upper, distance  312    0.20000E+01    0.60000E+01    0.77365E+00
 ARIEXC: peak, lower, upper, distance  313    0.20000E+01    0.60000E+01    0.80647E+00
 ARIEXC: peak, lower, upper, distance  314    0.19000E+01    0.60000E+01    0.74036E+00
 ARIEXC: peak, lower, upper, distance  316    0.16000E+01    0.28000E+01    0.85500E+00
 ARIEXC: peak, lower, upper, distance  318    0.19000E+01    0.43000E+01    0.83684E+00
 ARIEXC: peak, lower, upper, distance  319    0.20000E+01    0.60000E+01    0.81114E+00
 ARIEXC: peak, lower, upper, distance  320    0.19000E+01    0.60000E+01    0.77184E+00
 ARIEXC: peak, lower, upper, distance  322    0.15000E+01    0.27000E+01    0.85807E+00
 ARIEXC: peak, lower, upper, distance  324    0.20000E+01    0.48000E+01    0.80362E+00
 ARIEXC: peak, lower, upper, distance  325    0.19000E+01    0.60000E+01    0.81278E+00
 ARIEXC: peak, lower, upper, distance  326    0.20000E+01    0.56000E+01    0.80676E+00
 ARIEXC: peak, lower, upper, distance  327    0.17000E+01    0.33000E+01    0.86280E+00
 ARIEXC: peak, lower, upper, distance  328    0.20000E+01    0.56000E+01    0.84211E+00
 ARIEXC: peak, lower, upper, distance  329    0.20000E+01    0.60000E+01    0.83185E+00
 ARIEXC: peak, lower, upper, distance  331    0.20000E+01    0.58000E+01    0.78894E+00
 ARIEXC: peak, lower, upper, distance  332    0.20000E+01    0.60000E+01    0.77460E+00
 ARIEXC: peak, lower, upper, distance  333    0.19000E+01    0.43000E+01    0.83106E+00
 ARIEXC: peak, lower, upper, distance  337    0.19000E+01    0.55000E+01    0.77345E+00
 ARIEXC: peak, lower, upper, distance  340    0.20000E+01    0.60000E+01    0.85170E+00
 ARIEXC: peak, lower, upper, distance  344    0.20000E+01    0.60000E+01    0.76343E+00
 ARIEXC: peak, lower, upper, distance  345    0.17000E+01    0.31000E+01    0.87670E+00
 ARIEXC: peak, lower, upper, distance  346    0.20000E+01    0.54000E+01    0.85416E+00
 ARIEXC: peak, lower, upper, distance  347    0.18000E+01    0.42000E+01    0.80004E+00
 ARIEXC: peak, lower, upper, distance  348    0.16000E+01    0.60000E+01    0.75004E+00
 ARIEXC: peak, lower, upper, distance  351    0.17000E+01    0.29000E+01    0.85271E+00
 ARIEXC: peak, lower, upper, distance  352    0.20000E+01    0.60000E+01    0.73167E+00
 ARIEXC: peak, lower, upper, distance  353    0.18000E+01    0.36000E+01    0.82648E+00
 ARIEXC: peak, lower, upper, distance  354    0.19000E+01    0.60000E+01    0.78513E+00
 ARIEXC: peak, lower, upper, distance  355    0.20000E+01    0.54000E+01    0.81668E+00
 ARIEXC: peak, lower, upper, distance  356    0.20000E+01    0.60000E+01    0.79705E+00
 ARIEXC: peak, lower, upper, distance  357    0.20000E+01    0.60000E+01    0.79717E+00
 ARIEXC: peak, lower, upper, distance  360    0.18000E+01    0.34000E+01    0.84547E+00
 ARIEXC: peak, lower, upper, distance  363    0.20000E+01    0.50000E+01    0.86829E+00
 ARIEXC: peak, lower, upper, distance  365    0.19000E+01    0.60000E+01    0.76647E+00
 ARIEXC: peak, lower, upper, distance  367    0.16000E+01    0.30000E+01    0.87554E+00
 ARIEXC: peak, lower, upper, distance  368    0.18000E+01    0.38000E+01    0.83550E+00
 ARIEXC: peak, lower, upper, distance  369    0.20000E+01    0.60000E+01    0.78208E+00
 ARIEXC: peak, lower, upper, distance  370    0.20000E+01    0.56000E+01    0.77796E+00
 ARIEXC: peak, lower, upper, distance  372    0.18000E+01    0.34000E+01    0.86497E+00
 ARIEXC: peak, lower, upper, distance  373    0.17000E+01    0.33000E+01    0.83215E+00
 ARIEXC: peak, lower, upper, distance  377    0.20000E+01    0.60000E+01    0.79185E+00
 ARIEXC: peak, lower, upper, distance  378    0.18000E+01    0.60000E+01    0.80202E+00
 ARIEXC: peak, lower, upper, distance  379    0.20000E+01    0.52000E+01    0.79812E+00
 ARIEXC: peak, lower, upper, distance  380    0.17000E+01    0.60000E+01    0.76023E+00
 ARIEXC: peak, lower, upper, distance  381    0.20000E+01    0.54000E+01    0.83184E+00
 ARIEXC: peak, lower, upper, distance  382    0.18000E+01    0.38000E+01    0.80328E+00
 ARIEXC: peak, lower, upper, distance  383    0.20000E+01    0.48000E+01    0.84881E+00
 ARIEXC: peak, lower, upper, distance  384    0.17000E+01    0.33000E+01    0.85184E+00
 ARIEXC: peak, lower, upper, distance  385    0.18000E+01    0.34000E+01    0.87940E+00
 ARIEXC: peak, lower, upper, distance  387    0.16000E+01    0.26000E+01    0.84530E+00
 ARIEXC: peak, lower, upper, distance  390    0.19000E+01    0.60000E+01    0.75088E+00
 ARIEXC: peak, lower, upper, distance  391    0.20000E+01    0.60000E+01    0.74091E+00
 ARIEXC: peak, lower, upper, distance  394    0.17000E+01    0.60000E+01    0.75275E+00
 ARIEXC: peak, lower, upper, distance  395    0.19000E+01    0.60000E+01    0.76302E+00
 ARIEXC: peak, lower, upper, distance  396    0.17000E+01    0.60000E+01    0.78922E+00
 ARIEXC: peak, lower, upper, distance  397    0.19000E+01    0.43000E+01    0.83515E+00
 ARIEXC: peak, lower, upper, distance  399    0.13000E+01    0.60000E+01    0.76842E+00
 ARIEXC: peak, lower, upper, distance  400    0.19000E+01    0.49000E+01    0.78447E+00
 ARIEXC: peak, lower, upper, distance  401    0.18000E+01    0.36000E+01    0.86573E+00
 ARIEXC: peak, lower, upper, distance  402    0.17000E+01    0.33000E+01    0.86605E+00
 ARIEXC: peak, lower, upper, distance  403    0.19000E+01    0.53000E+01    0.83198E+00
 ARIEXC: peak, lower, upper, distance  404    0.18000E+01    0.38000E+01    0.83462E+00
 ARIEXC: peak, lower, upper, distance  405    0.18000E+01    0.60000E+01    0.78942E+00
 ARIEXC: peak, lower, upper, distance  406    0.16000E+01    0.60000E+01    0.74547E+00
 ARIEXC: peak, lower, upper, distance  407    0.19000E+01    0.43000E+01    0.82097E+00
 ARIEXC: peak, lower, upper, distance  408    0.18000E+01    0.60000E+01    0.79798E+00
 ARIEXC: peak, lower, upper, distance  411    0.19000E+01    0.60000E+01    0.77487E+00
 ARIEXC: peak, lower, upper, distance  414    0.19000E+01    0.41000E+01    0.86691E+00
 ARIEXC: peak, lower, upper, distance  416    0.16000E+01    0.60000E+01    0.78181E+00
 ARIEXC: peak, lower, upper, distance  417    0.19000E+01    0.43000E+01    0.86603E+00
 ARIEXC: peak, lower, upper, distance  418    0.20000E+01    0.60000E+01    0.77214E+00
 ARIEXC: peak, lower, upper, distance  422    0.20000E+01    0.60000E+01    0.79955E+00
 ARIEXC: peak, lower, upper, distance  423    0.18000E+01    0.60000E+01    0.73428E+00
 ARIEXC: peak, lower, upper, distance  427    0.20000E+01    0.60000E+01    0.86350E+00
 ARIEXC: peak, lower, upper, distance  428    0.17000E+01    0.31000E+01    0.85546E+00
 ARIEXC: peak, lower, upper, distance  429    0.20000E+01    0.60000E+01    0.76983E+00
 ARIEXC: peak, lower, upper, distance  431    0.20000E+01    0.60000E+01    0.77587E+00
 ARIEXC: peak, lower, upper, distance  432    0.20000E+01    0.50000E+01    0.84992E+00
 ARIEXC: peak, lower, upper, distance  442    0.19000E+01    0.60000E+01    0.76729E+00
 ARIEXC: peak, lower, upper, distance  444    0.18000E+01    0.36000E+01    0.85514E+00
 ARIEXC: peak, lower, upper, distance  446    0.20000E+01    0.60000E+01    0.81225E+00
 ARIEXC: peak, lower, upper, distance  447    0.18000E+01    0.36000E+01    0.83546E+00
 ARIEXC: peak, lower, upper, distance  448    0.20000E+01    0.60000E+01    0.76652E+00
 ARIEXC: peak, lower, upper, distance  449    0.16000E+01    0.60000E+01    0.74125E+00
 ARIEXC: peak, lower, upper, distance  450    0.17000E+01    0.33000E+01    0.84865E+00
 ARIEXC: peak, lower, upper, distance  452    0.19000E+01    0.41000E+01    0.85681E+00
 ARIEXC: peak, lower, upper, distance  453    0.20000E+01    0.60000E+01    0.78301E+00
 ARIEXC: peak, lower, upper, distance  454    0.18000E+01    0.40000E+01    0.83164E+00
 ARIEXC: peak, lower, upper, distance  455    0.19000E+01    0.39000E+01    0.84245E+00
 ARIEXC: peak, lower, upper, distance  457    0.20000E+01    0.60000E+01    0.79860E+00
 ARIEXC: peak, lower, upper, distance  458    0.20000E+01    0.54000E+01    0.87211E+00
 ARIEXC: peak, lower, upper, distance  459    0.16000E+01    0.60000E+01    0.81216E+00
 ARIEXC: peak, lower, upper, distance  460    0.20000E+01    0.56000E+01    0.85023E+00
 ARIEXC: peak, lower, upper, distance  462    0.20000E+01    0.60000E+01    0.78941E+00
 ARIEXC: peak, lower, upper, distance  464    0.13000E+01    0.22000E+01    0.91007E+00
 ARIEXC: peak, lower, upper, distance  465    0.19000E+01    0.60000E+01    0.73535E+00
 ARIEXC: peak, lower, upper, distance  466    0.20000E+01    0.54000E+01    0.81104E+00
 ARIEXC: peak, lower, upper, distance  467    0.20000E+01    0.60000E+01    0.76384E+00
 ARIEXC: peak, lower, upper, distance  468    0.17000E+01    0.60000E+01    0.79926E+00
 ARIEXC: peak, lower, upper, distance  469    0.16000E+01    0.30000E+01    0.85606E+00
 ARIEXC: peak, lower, upper, distance  470    0.19000E+01    0.60000E+01    0.74162E+00
 ARIEXC: peak, lower, upper, distance  471    0.20000E+01    0.60000E+01    0.80739E+00
 ARIEXC: peak, lower, upper, distance  472    0.20000E+01    0.50000E+01    0.77343E+00
 ARIEXC: peak, lower, upper, distance  473    0.20000E+01    0.56000E+01    0.84246E+00
 ARIEXC: peak, lower, upper, distance  474    0.20000E+01    0.60000E+01    0.79524E+00
 ARIEXC: peak, lower, upper, distance  477    0.19000E+01    0.43000E+01    0.84047E+00
 ARIEXC: peak, lower, upper, distance  478    0.20000E+01    0.60000E+01    0.78336E+00
 ARIEXC: peak, lower, upper, distance  479    0.19000E+01    0.60000E+01    0.78040E+00
 ARIEXC: peak, lower, upper, distance  480    0.18000E+01    0.34000E+01    0.85708E+00
 ARIEXC: peak, lower, upper, distance  481    0.18000E+01    0.38000E+01    0.85738E+00
 ARIEXC: peak, lower, upper, distance  482    0.20000E+01    0.60000E+01    0.74710E+00
 ARIEXC: peak, lower, upper, distance  483    0.17000E+01    0.33000E+01    0.86259E+00
 ARIEXC: peak, lower, upper, distance  484    0.20000E+01    0.60000E+01    0.87847E+00
 ARIEXC: peak, lower, upper, distance  487    0.19000E+01    0.60000E+01    0.75846E+00
 ARIEXC: peak, lower, upper, distance  488    0.18000E+01    0.60000E+01    0.77830E+00
 ARIEXC: peak, lower, upper, distance  489    0.18000E+01    0.60000E+01    0.78134E+00
 ARIEXC: peak, lower, upper, distance  490    0.20000E+01    0.54000E+01    0.83403E+00
 ARIEXC: peak, lower, upper, distance  492    0.19000E+01    0.41000E+01    0.83694E+00
 ARIEXC: peak, lower, upper, distance  493    0.17000E+01    0.31000E+01    0.86000E+00
 ARIEXC: peak, lower, upper, distance  494    0.18000E+01    0.38000E+01    0.86248E+00
 ARIEXC: peak, lower, upper, distance  495    0.19000E+01    0.51000E+01    0.78773E+00
 ARIEXC: peak, lower, upper, distance  496    0.20000E+01    0.60000E+01    0.74475E+00
 ARIEXC: peak, lower, upper, distance  497    0.17000E+01    0.31000E+01    0.87141E+00
 ARIEXC: peak, lower, upper, distance  498    0.19000E+01    0.45000E+01    0.83423E+00
 ARIEXC: peak, lower, upper, distance  499    0.20000E+01    0.60000E+01    0.82502E+00
 ARIEXC: peak, lower, upper, distance  501    0.17000E+01    0.31000E+01    0.85638E+00
 ARIEXC: peak, lower, upper, distance  502    0.18000E+01    0.40000E+01    0.86576E+00
 ARIEXC: peak, lower, upper, distance  503    0.19000E+01    0.53000E+01    0.80530E+00
 ARIEXC: peak, lower, upper, distance  504    0.20000E+01    0.60000E+01    0.80695E+00
 ARIEXC: peak, lower, upper, distance  505    0.20000E+01    0.52000E+01    0.80165E+00
 ARIEXC: peak, lower, upper, distance  507    0.18000E+01    0.40000E+01    0.83188E+00
 ARIEXC: peak, lower, upper, distance  509    0.18000E+01    0.36000E+01    0.85509E+00
 ARIEXC: peak, lower, upper, distance  511    0.20000E+01    0.60000E+01    0.81664E+00
 ARIEXC: peak, lower, upper, distance  519    0.19000E+01    0.39000E+01    0.86096E+00
 ARIEXC: peak, lower, upper, distance  520    0.17000E+01    0.33000E+01    0.86191E+00
 ARIEXC: peak, lower, upper, distance  521    0.17000E+01    0.31000E+01    0.86192E+00
 ARIEXC: peak, lower, upper, distance  526    0.20000E+01    0.60000E+01    0.80565E+00
 ARIEXC: peak, lower, upper, distance  529    0.20000E+01    0.56000E+01    0.80567E+00
 ARIEXC: peak, lower, upper, distance  531    0.20000E+01    0.52000E+01    0.85702E+00
 ARIEXC: peak, lower, upper, distance  532    0.20000E+01    0.60000E+01    0.74603E+00
 ARIEXC: peak, lower, upper, distance  534    0.20000E+01    0.60000E+01    0.72858E+00
 ARIEXC: peak, lower, upper, distance  535    0.18000E+01    0.60000E+01    0.77964E+00
 ARIEXC: peak, lower, upper, distance  541    0.17000E+01    0.31000E+01    0.86363E+00
 ARIEXC: peak, lower, upper, distance  542    0.20000E+01    0.46000E+01    0.83508E+00
 ARIEXC: peak, lower, upper, distance  543    0.20000E+01    0.56000E+01    0.79240E+00
 ARIEXC: peak, lower, upper, distance  548    0.18000E+01    0.36000E+01    0.84144E+00
 ARIEXC: peak, lower, upper, distance  549    0.20000E+01    0.60000E+01    0.77425E+00
 ARIEXC: peak, lower, upper, distance  550    0.20000E+01    0.60000E+01    0.78326E+00
 ARIEXC: peak, lower, upper, distance  551    0.20000E+01    0.54000E+01    0.81326E+00
 ARIEXC: peak, lower, upper, distance  558    0.19000E+01    0.47000E+01    0.83928E+00
 ARIEXC: peak, lower, upper, distance  559    0.19000E+01    0.41000E+01    0.87698E+00
 ARIEXC: peak, lower, upper, distance  560    0.16000E+01    0.60000E+01    0.78978E+00
 ARIEXC: peak, lower, upper, distance  561    0.11000E+01    0.60000E+01    0.76331E+00
 ARIEXC: peak, lower, upper, distance  562    0.17000E+01    0.31000E+01    0.85388E+00
 ARIEXC: peak, lower, upper, distance  563    0.18000E+01    0.36000E+01    0.83156E+00
 ARIEXC: peak, lower, upper, distance  566    0.19000E+01    0.60000E+01    0.77639E+00
 ARIEXC: peak, lower, upper, distance  567    0.16000E+01    0.60000E+01    0.76880E+00
 ARIEXC: peak, lower, upper, distance  568    0.20000E+01    0.58000E+01    0.81267E+00
 ARIEXC: peak, lower, upper, distance  569    0.20000E+01    0.58000E+01    0.83139E+00
 ARIEXC: peak, lower, upper, distance  570    0.20000E+01    0.56000E+01    0.84295E+00
 ARIEXC: peak, lower, upper, distance  571    0.19000E+01    0.60000E+01    0.78420E+00
 ARIEXC: peak, lower, upper, distance  572    0.16000E+01    0.60000E+01    0.76847E+00
 ARIEXC: peak, lower, upper, distance  573    0.20000E+01    0.60000E+01    0.83346E+00
 ARIEXC: peak, lower, upper, distance  574    0.17000E+01    0.33000E+01    0.88704E+00
 ARIEXC: peak, lower, upper, distance  575    0.18000E+01    0.34000E+01    0.87279E+00
 ARIEXC: peak, lower, upper, distance  576    0.20000E+01    0.52000E+01    0.81221E+00
 ARIEXC: peak, lower, upper, distance  577    0.19000E+01    0.57000E+01    0.80041E+00
 ARIEXC: peak, lower, upper, distance  578    0.20000E+01    0.56000E+01    0.81179E+00
 ARIEXC: peak, lower, upper, distance  579    0.19000E+01    0.60000E+01    0.79156E+00
 ARIEXC: peak, lower, upper, distance  580    0.20000E+01    0.60000E+01    0.78422E+00
 ARIEXC: peak, lower, upper, distance  581    0.19000E+01    0.60000E+01    0.79909E+00
 ARIEXC: peak, lower, upper, distance  582    0.18000E+01    0.60000E+01    0.74912E+00
 ARIEXC: peak, lower, upper, distance  583    0.16000E+01    0.60000E+01    0.74143E+00
 ARIEXC: peak, lower, upper, distance  584    0.20000E+01    0.60000E+01    0.80118E+00
 ARIEXC: peak, lower, upper, distance  586    0.20000E+01    0.58000E+01    0.81026E+00
 ARIEXC: peak, lower, upper, distance  587    0.20000E+01    0.50000E+01    0.78393E+00
 ARIEXC: peak, lower, upper, distance  588    0.18000E+01    0.38000E+01    0.83264E+00
 ARIEXC: peak, lower, upper, distance  589    0.18000E+01    0.40000E+01    0.85123E+00
 ARIEXC: peak, lower, upper, distance  590    0.20000E+01    0.56000E+01    0.75888E+00
 ARIEXC: peak, lower, upper, distance  591    0.15000E+01    0.60000E+01    0.87218E+00
 ARIEXC: peak, lower, upper, distance  592    0.20000E+01    0.60000E+01    0.80963E+00
 ARIEXC: peak, lower, upper, distance  593    0.20000E+01    0.60000E+01    0.82429E+00
 ARIEXC: peak, lower, upper, distance  594    0.20000E+01    0.52000E+01    0.78721E+00
 ARIEXC: peak, lower, upper, distance  595    0.19000E+01    0.53000E+01    0.84843E+00
 ARIEXC: peak, lower, upper, distance  596    0.20000E+01    0.54000E+01    0.85467E+00
 ARIEXC: peak, lower, upper, distance  597    0.19000E+01    0.47000E+01    0.81317E+00
 ARIEXC: peak, lower, upper, distance  598    0.19000E+01    0.43000E+01    0.81856E+00
 ARIEXC: peak, lower, upper, distance  599    0.13000E+01    0.22000E+01    0.91011E+00
 ARIEXC: peak, lower, upper, distance  601    0.19000E+01    0.60000E+01    0.74833E+00
 ARIEXC: peak, lower, upper, distance  603    0.18000E+01    0.36000E+01    0.86922E+00
 ARIEXC: peak, lower, upper, distance  604    0.19000E+01    0.39000E+01    0.83987E+00
 ARIEXC: peak, lower, upper, distance  605    0.20000E+01    0.60000E+01    0.75400E+00
 ARIEXC: peak, lower, upper, distance  607    0.19000E+01    0.41000E+01    0.80006E+00
 ARIEXC: peak, lower, upper, distance  609    0.18000E+01    0.34000E+01    0.86358E+00
 ARIEXC: peak, lower, upper, distance  610    0.18000E+01    0.42000E+01    0.85049E+00
 ARIEXC: peak, lower, upper, distance  615    0.19000E+01    0.47000E+01    0.83156E+00
 ARIEXC: peak, lower, upper, distance  616    0.19000E+01    0.47000E+01    0.86249E+00
 ARIEXC: peak, lower, upper, distance  617    0.17000E+01    0.33000E+01    0.86431E+00
 ARIEXC: peak, lower, upper, distance  619    0.20000E+01    0.60000E+01    0.77577E+00
 ARIEXC: peak, lower, upper, distance  620    0.20000E+01    0.60000E+01    0.78176E+00
 ARIEXC: peak, lower, upper, distance  623    0.20000E+01    0.60000E+01    0.82521E+00
 ARIEXC: peak, lower, upper, distance  625    0.20000E+01    0.60000E+01    0.86495E+00
 ARIEXC: peak, lower, upper, distance  626    0.15000E+01    0.25000E+01    0.86173E+00
 ARIEXC: peak, lower, upper, distance  628    0.19000E+01    0.45000E+01    0.85756E+00
 ARIEXC: peak, lower, upper, distance  629    0.18000E+01    0.40000E+01    0.82536E+00
 ARIEXC: peak, lower, upper, distance  630    0.20000E+01    0.60000E+01    0.83803E+00
 ARIEXC: peak, lower, upper, distance  631    0.18000E+01    0.40000E+01    0.80462E+00
 ARIEXC: peak, lower, upper, distance  633    0.19000E+01    0.41000E+01    0.80167E+00
 ARIEXC: peak, lower, upper, distance  635    0.19000E+01    0.43000E+01    0.80247E+00
 ARIEXC: peak, lower, upper, distance  638    0.17000E+01    0.33000E+01    0.81518E+00
 ARIEXC: peak, lower, upper, distance  640    0.20000E+01    0.52000E+01    0.78614E+00
 ARIEXC: peak, lower, upper, distance  641    0.20000E+01    0.60000E+01    0.83465E+00
 ARIEXC: peak, lower, upper, distance  642    0.20000E+01    0.54000E+01    0.87463E+00
 ARIEXC: peak, lower, upper, distance  644    0.20000E+01    0.60000E+01    0.82532E+00
 ARIEXC: peak, lower, upper, distance  645    0.12000E+01    0.22000E+01    0.91017E+00
 ARIEXC: peak, lower, upper, distance  647    0.15000E+01    0.27000E+01    0.87172E+00
 ARIEXC: peak, lower, upper, distance  654    0.18000E+01    0.34000E+01    0.86197E+00
 ARIEXC: peak, lower, upper, distance  657    0.20000E+01    0.60000E+01    0.76138E+00
 ARIEXC: peak, lower, upper, distance  658    0.13000E+01    0.22000E+01    0.90957E+00
 ARIEXC: peak, lower, upper, distance  665    0.15000E+01    0.25000E+01    0.85900E+00
 ARIEXC: peak, lower, upper, distance  666    0.20000E+01    0.56000E+01    0.87999E+00
 ARIEXC: peak, lower, upper, distance  667    0.20000E+01    0.60000E+01    0.80738E+00
 ARIEXC: peak, lower, upper, distance  668    0.18000E+01    0.36000E+01    0.84595E+00
 ARIEXC: peak, lower, upper, distance  669    0.20000E+01    0.54000E+01    0.79318E+00
 ARIEXC: peak, lower, upper, distance  670    0.20000E+01    0.48000E+01    0.79847E+00
 ARIEXC: peak, lower, upper, distance  671    0.19000E+01    0.45000E+01    0.87614E+00
 ARIEXC: peak, lower, upper, distance  672    0.17000E+01    0.33000E+01    0.88130E+00
 ARIEXC: peak, lower, upper, distance  673    0.20000E+01    0.56000E+01    0.79903E+00
 ARIEXC: peak, lower, upper, distance  674    0.18000E+01    0.38000E+01    0.82169E+00
 ARIEXC: peak, lower, upper, distance  676    0.20000E+01    0.58000E+01    0.79052E+00
 ARIEXC: peak, lower, upper, distance  677    0.16000E+01    0.60000E+01    0.74164E+00
 ARIEXC: peak, lower, upper, distance  678    0.12000E+01    0.60000E+01    0.77405E+00
 ARIEXC: peak, lower, upper, distance  679    0.15000E+01    0.25000E+01    0.87003E+00
 ARIEXC: peak, lower, upper, distance  680    0.20000E+01    0.60000E+01    0.79905E+00
 ARIEXC: peak, lower, upper, distance  681    0.19000E+01    0.60000E+01    0.79237E+00
 ARIEXC: peak, lower, upper, distance  684    0.18000E+01    0.42000E+01    0.81162E+00
 ARIEXC: peak, lower, upper, distance  685    0.15000E+01    0.60000E+01    0.82141E+00
 ARIEXC: peak, lower, upper, distance  686    0.20000E+01    0.60000E+01    0.77836E+00
 ARIEXC: peak, lower, upper, distance  687    0.14000E+01    0.60000E+01    0.74162E+00
 ARIEXC: peak, lower, upper, distance  688    0.16000E+01    0.28000E+01    0.87090E+00
 ARIEXC: peak, lower, upper, distance  689    0.13000E+01    0.22000E+01    0.90893E+00
 ARIEXC: peak, lower, upper, distance  690    0.17000E+01    0.29000E+01    0.86146E+00
 ARIEXC: peak, lower, upper, distance  696    0.20000E+01    0.60000E+01    0.74805E+00
 ARIEXC: peak, lower, upper, distance  697    0.19000E+01    0.49000E+01    0.83355E+00
 ARIEXC: peak, lower, upper, distance  698    0.19000E+01    0.39000E+01    0.87033E+00
 ARIEXC: peak, lower, upper, distance  699    0.20000E+01    0.54000E+01    0.79229E+00
 ARIEXC: peak, lower, upper, distance  700    0.19000E+01    0.41000E+01    0.84662E+00
 ARIEXC: peak, lower, upper, distance  701    0.18000E+01    0.38000E+01    0.87020E+00
 ARIEXC: peak, lower, upper, distance  702    0.19000E+01    0.39000E+01    0.83349E+00
 ARIEXC: peak, lower, upper, distance  703    0.19000E+01    0.43000E+01    0.83710E+00
 ARIEXC: peak, lower, upper, distance  704    0.19000E+01    0.60000E+01    0.78373E+00
 ARIEXC: peak, lower, upper, distance  706    0.11000E+01    0.60000E+01    0.77563E+00
 ARIEXC: peak, lower, upper, distance  711    0.19000E+01    0.60000E+01    0.80799E+00
 ARIEXC: peak, lower, upper, distance  712    0.14000E+01    0.24000E+01    0.86868E+00
 ARIEXC: peak, lower, upper, distance  713    0.14000E+01    0.22000E+01    0.90892E+00
 ARIEXC: peak, lower, upper, distance  718    0.19000E+01    0.60000E+01    0.85399E+00
 ARIEXC: peak, lower, upper, distance  719    0.20000E+01    0.60000E+01    0.80969E+00
 ARIEXC: peak, lower, upper, distance  722    0.20000E+01    0.60000E+01    0.74112E+00
 ARIEXC: peak, lower, upper, distance  723    0.17000E+01    0.31000E+01    0.86987E+00
 ARIEXC: peak, lower, upper, distance  725    0.20000E+01    0.60000E+01    0.82009E+00
 ARIEXC: peak, lower, upper, distance  728    0.20000E+01    0.54000E+01    0.77963E+00
 ARIEXC: peak, lower, upper, distance  730    0.17000E+01    0.31000E+01    0.86850E+00
 ARIEXC: peak, lower, upper, distance  731    0.20000E+01    0.52000E+01    0.84183E+00
 ARIEXC: peak, lower, upper, distance  732    0.18000E+01    0.60000E+01    0.75336E+00
 ARIEXC: peak, lower, upper, distance  733    0.17000E+01    0.60000E+01    0.74933E+00
 ARIEXC: peak, lower, upper, distance  736    0.15000E+01    0.25000E+01    0.87953E+00
 ARIEXC: peak, lower, upper, distance  738    0.17000E+01    0.31000E+01    0.88998E+00
 ARIEXC: peak, lower, upper, distance  740    0.20000E+01    0.60000E+01    0.77802E+00
 ARIEXC: peak, lower, upper, distance  741    0.20000E+01    0.60000E+01    0.81659E+00
 ARIEXC: peak, lower, upper, distance  743    0.20000E+01    0.56000E+01    0.84944E+00
 ARIEXC: peak, lower, upper, distance  744    0.18000E+01    0.34000E+01    0.86955E+00
 ARIEXC: peak, lower, upper, distance  745    0.16000E+01    0.30000E+01    0.84833E+00
 ARIEXC: peak, lower, upper, distance  748    0.17000E+01    0.35000E+01    0.87217E+00
 ARIEXC: peak, lower, upper, distance  749    0.20000E+01    0.60000E+01    0.83623E+00
 ARIEXC: peak, lower, upper, distance  750    0.18000E+01    0.40000E+01    0.83165E+00
 ARIEXC: peak, lower, upper, distance  752    0.19000E+01    0.39000E+01    0.84225E+00
 ARIEXC: peak, lower, upper, distance  753    0.17000E+01    0.60000E+01    0.78308E+00
 ARIEXC: peak, lower, upper, distance  754    0.19000E+01    0.60000E+01    0.78266E+00
 ARIEXC: peak, lower, upper, distance  758    0.18000E+01    0.38000E+01    0.83430E+00
 ARIEXC: peak, lower, upper, distance  759    0.20000E+01    0.60000E+01    0.83424E+00
 ARIEXC: peak, lower, upper, distance  760    0.19000E+01    0.60000E+01    0.82175E+00
 ARIEXC: peak, lower, upper, distance  761    0.19000E+01    0.43000E+01    0.88495E+00
 ARIEXC: peak, lower, upper, distance  765    0.19000E+01    0.41000E+01    0.79818E+00
 ARIEXC: peak, lower, upper, distance  768    0.19000E+01    0.51000E+01    0.79673E+00
 ARIEXC: peak, lower, upper, distance  769    0.19000E+01    0.60000E+01    0.79293E+00
 ARIEXC: peak, lower, upper, distance  770    0.20000E+01    0.58000E+01    0.82381E+00
 ARIEXC: peak, lower, upper, distance  771    0.16000E+01    0.28000E+01    0.86905E+00
 ARIEXC: peak, lower, upper, distance  772    0.15000E+01    0.27000E+01    0.84904E+00
 ARIEXC: peak, lower, upper, distance  773    0.16000E+01    0.26000E+01    0.86993E+00
 ARIEXC: peak, lower, upper, distance  774    0.19000E+01    0.45000E+01    0.83352E+00
 ARIEXC: peak, lower, upper, distance  775    0.20000E+01    0.46000E+01    0.78286E+00
 ARIEXC: peak, lower, upper, distance  776    0.18000E+01    0.60000E+01    0.78749E+00
 ARIEXC: peak, lower, upper, distance  781    0.16000E+01    0.30000E+01    0.84174E+00
 ARIEXC: peak, lower, upper, distance  783    0.19000E+01    0.41000E+01    0.84790E+00
 ARIEXC: peak, lower, upper, distance  784    0.20000E+01    0.60000E+01    0.83249E+00
 ARIEXC: peak, lower, upper, distance  788    0.18000E+01    0.38000E+01    0.85586E+00
 ARIEXC: peak, lower, upper, distance  789    0.19000E+01    0.43000E+01    0.84501E+00
 ARIEXC: peak, lower, upper, distance  792    0.17000E+01    0.31000E+01    0.86270E+00
 ARIEXC: peak, lower, upper, distance  793    0.19000E+01    0.60000E+01    0.87523E+00
 ARIEXC: peak, lower, upper, distance  794    0.18000E+01    0.60000E+01    0.80877E+00
 ARIEXC: peak, lower, upper, distance  795    0.18000E+01    0.36000E+01    0.86187E+00
 ARIEXC: peak, lower, upper, distance  798    0.13000E+01    0.22000E+01    0.87259E+00
 ARIEXC: peak, lower, upper, distance  802    0.20000E+01    0.60000E+01    0.79214E+00
 ARIEXC: peak, lower, upper, distance  803    0.16000E+01    0.60000E+01    0.77041E+00
 ARIEXC: peak, lower, upper, distance  804    0.15000E+01    0.60000E+01    0.75626E+00
 ARIEXC: peak, lower, upper, distance  805    0.19000E+01    0.41000E+01    0.80922E+00
 ARIEXC: peak, lower, upper, distance  807    0.20000E+01    0.58000E+01    0.79822E+00
 ARIEXC: peak, lower, upper, distance  813    0.19000E+01    0.37000E+01    0.80819E+00
 ARIEXC: peak, lower, upper, distance  814    0.20000E+01    0.60000E+01    0.86161E+00
 ARIEXC: peak, lower, upper, distance  817    0.17000E+01    0.31000E+01    0.85543E+00
 ARIEXC: peak, lower, upper, distance  821    0.15000E+01    0.60000E+01    0.78010E+00
 ARIEXC: peak, lower, upper, distance  826    0.16000E+01    0.28000E+01    0.85518E+00
 ARIEXC: peak, lower, upper, distance  827    0.19000E+01    0.41000E+01    0.83228E+00
 ARIEXC: peak, lower, upper, distance  831    0.19000E+01    0.49000E+01    0.80067E+00
 ARIEXC: peak, lower, upper, distance  832    0.19000E+01    0.39000E+01    0.79886E+00
 ARIEXC: peak, lower, upper, distance  835    0.16000E+01    0.60000E+01    0.78564E+00
 ARIEXC: peak, lower, upper, distance  839    0.20000E+01    0.60000E+01    0.76683E+00
 ARIEXC: peak, lower, upper, distance  845    0.19000E+01    0.60000E+01    0.86072E+00
 ARIEXC: peak, lower, upper, distance  851    0.19000E+01    0.60000E+01    0.80075E+00
 ARIEXC: peak, lower, upper, distance  852    0.18000E+01    0.60000E+01    0.77872E+00
 ARIEXC: peak, lower, upper, distance  853    0.10000E+01    0.60000E+01    0.75475E+00
 ARIEXC: peak, lower, upper, distance  858    0.19000E+01    0.39000E+01    0.79194E+00
 ARIEXC: peak, lower, upper, distance  860    0.20000E+01    0.52000E+01    0.76329E+00
 ARIEXC: peak, lower, upper, distance  861    0.20000E+01    0.54000E+01    0.74572E+00
 ARIEXC: peak, lower, upper, distance  862    0.17000E+01    0.31000E+01    0.85541E+00
 ARIEXC: peak, lower, upper, distance  863    0.18000E+01    0.38000E+01    0.83791E+00
 ARIEXC: peak, lower, upper, distance  865    0.19000E+01    0.60000E+01    0.75971E+00
 ARIEXC: peak, lower, upper, distance  868    0.18000E+01    0.60000E+01    0.78231E+00
 ARIEXC: peak, lower, upper, distance  869    0.20000E+01    0.60000E+01    0.84123E+00
 ARIEXC: peak, lower, upper, distance  872    0.12000E+01    0.22000E+01    0.90909E+00
 ARIEXC: peak, lower, upper, distance  875    0.19000E+01    0.51000E+01    0.87208E+00
 ARIEXC: peak, lower, upper, distance  876    0.19000E+01    0.43000E+01    0.83552E+00
 ARIEXC: peak, lower, upper, distance  877    0.19000E+01    0.60000E+01    0.79400E+00
 ARIEXC: peak, lower, upper, distance  886    0.19000E+01    0.60000E+01    0.81796E+00
 ARIEXC: peak, lower, upper, distance    1    0.19000E+01    0.43000E+01    0.79645E+00
 ARIEXC: peak, lower, upper, distance    1    0.17000E+01    0.29000E+01    0.84790E+00
 ARIEXC: peak, lower, upper, distance    2    0.17000E+01    0.29000E+01    0.86259E+00
 ARIEXC: peak, lower, upper, distance    4    0.19000E+01    0.43000E+01    0.86500E+00
 ARIEXC: peak, lower, upper, distance    5    0.16000E+01    0.28000E+01    0.84082E+00
 ARIEXC: peak, lower, upper, distance    6    0.17000E+01    0.60000E+01    0.76995E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.60000E+01    0.77365E+00
 ARIEXC: peak, lower, upper, distance    8    0.17000E+01    0.60000E+01    0.76184E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.50000E+01    0.80705E+00
 ARIEXC: peak, lower, upper, distance   10    0.20000E+01    0.60000E+01    0.78010E+00
 ARIEXC: peak, lower, upper, distance   11    0.19000E+01    0.60000E+01    0.77872E+00
 ARIEXC: peak, lower, upper, distance   13    0.19000E+01    0.45000E+01    0.87999E+00
 ARIEXC: peak, lower, upper, distance   14    0.20000E+01    0.60000E+01    0.83549E+00
 ARIEXC: peak, lower, upper, distance   15    0.20000E+01    0.56000E+01    0.86487E+00
 ARIEXC: peak, lower, upper, distance   16    0.19000E+01    0.60000E+01    0.77889E+00
 ARIEXC: peak, lower, upper, distance   17    0.20000E+01    0.48000E+01    0.85298E+00
 ARIEXC: peak, lower, upper, distance   18    0.19000E+01    0.39000E+01    0.83733E+00
 ARIEXC: peak, lower, upper, distance   19    0.20000E+01    0.58000E+01    0.80738E+00
 ARIEXC: peak, lower, upper, distance   20    0.20000E+01    0.50000E+01    0.81436E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.47000E+01    0.82859E+00
 ARIEXC: peak, lower, upper, distance   22    0.16000E+01    0.28000E+01    0.87415E+00
 ARIEXC: peak, lower, upper, distance   23    0.19000E+01    0.53000E+01    0.81057E+00
 ARIEXC: peak, lower, upper, distance   25    0.18000E+01    0.60000E+01    0.77647E+00
 ARIEXC: peak, lower, upper, distance   27    0.20000E+01    0.60000E+01    0.80495E+00
 ARIEXC: peak, lower, upper, distance   28    0.19000E+01    0.60000E+01    0.79635E+00
 ARIEXC: peak, lower, upper, distance   29    0.20000E+01    0.60000E+01    0.75680E+00
 ARIEXC: peak, lower, upper, distance   30    0.20000E+01    0.60000E+01    0.78161E+00
 ARIEXC: peak, lower, upper, distance   33    0.16000E+01    0.30000E+01    0.88006E+00
 ARIEXC: peak, lower, upper, distance   34    0.20000E+01    0.50000E+01    0.83513E+00
 ARIEXC: peak, lower, upper, distance   35    0.20000E+01    0.60000E+01    0.81225E+00
 ARIEXC: peak, lower, upper, distance   36    0.19000E+01    0.60000E+01    0.78028E+00
 ARIEXC: peak, lower, upper, distance   37    0.20000E+01    0.48000E+01    0.81314E+00
 ARIEXC: peak, lower, upper, distance   38    0.20000E+01    0.58000E+01    0.86284E+00
 ARIEXC: peak, lower, upper, distance   39    0.19000E+01    0.47000E+01    0.82555E+00
 ARIEXC: peak, lower, upper, distance   40    0.20000E+01    0.60000E+01    0.78181E+00
 ARIEXC: peak, lower, upper, distance   41    0.19000E+01    0.60000E+01    0.77937E+00
 ARIEXC: peak, lower, upper, distance   43    0.15000E+01    0.27000E+01    0.87380E+00
 ARIEXC: peak, lower, upper, distance   44    0.18000E+01    0.38000E+01    0.83766E+00
 ARIEXC: peak, lower, upper, distance   45    0.19000E+01    0.60000E+01    0.79019E+00
 ARIEXC: peak, lower, upper, distance   47    0.19000E+01    0.60000E+01    0.80075E+00
 ARIEXC: peak, lower, upper, distance   48    0.20000E+01    0.60000E+01    0.77679E+00
 ARIEXC: peak, lower, upper, distance   49    0.19000E+01    0.41000E+01    0.84006E+00
 ARIEXC: peak, lower, upper, distance   50    0.15000E+01    0.23000E+01    0.87868E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.50000E+01    0.79120E+00
 ARIEXC: peak, lower, upper, distance   53    0.20000E+01    0.50000E+01    0.77345E+00
 ARIEXC: peak, lower, upper, distance   54    0.20000E+01    0.46000E+01    0.84306E+00
 ARIEXC: peak, lower, upper, distance   55    0.20000E+01    0.60000E+01    0.78177E+00
 ARIEXC: peak, lower, upper, distance   56    0.19000E+01    0.60000E+01    0.78114E+00
 ARIEXC: peak, lower, upper, distance   57    0.18000E+01    0.38000E+01    0.83536E+00
 ARIEXC: peak, lower, upper, distance   58    0.16000E+01    0.28000E+01    0.86058E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.60000E+01    0.81092E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.60000E+01    0.83707E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.48000E+01    0.84563E+00
 ARIEXC: peak, lower, upper, distance   62    0.19000E+01    0.43000E+01    0.79843E+00
 ARIEXC: peak, lower, upper, distance   65    0.12000E+01    0.22000E+01    0.91281E+00
 ARIEXC: peak, lower, upper, distance   67    0.19000E+01    0.60000E+01    0.80487E+00
 ARIEXC: peak, lower, upper, distance   68    0.19000E+01    0.51000E+01    0.83490E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.48000E+01    0.87198E+00
 ARIEXC: peak, lower, upper, distance   71    0.20000E+01    0.58000E+01    0.81184E+00
 ARIEXC: peak, lower, upper, distance   72    0.13000E+01    0.22000E+01    0.91307E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.60000E+01    0.79903E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.43000E+01    0.82169E+00
 ARIEXC: peak, lower, upper, distance   78    0.19000E+01    0.60000E+01    0.76062E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.60000E+01    0.78355E+00
 ARIEXC: peak, lower, upper, distance   80    0.19000E+01    0.60000E+01    0.77651E+00
 ARIEXC: peak, lower, upper, distance   81    0.20000E+01    0.54000E+01    0.77869E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.60000E+01    0.80041E+00
 ARIEXC: peak, lower, upper, distance   83    0.17000E+01    0.31000E+01    0.87279E+00
 ARIEXC: peak, lower, upper, distance   84    0.20000E+01    0.50000E+01    0.83564E+00
 ARIEXC: peak, lower, upper, distance   85    0.20000E+01    0.56000E+01    0.80342E+00
 ARIEXC: peak, lower, upper, distance   87    0.15000E+01    0.25000E+01    0.87781E+00
 ARIEXC: peak, lower, upper, distance   88    0.19000E+01    0.39000E+01    0.83633E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.46000E+01    0.83521E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.40000E+01    0.86301E+00
 ARIEXC: peak, lower, upper, distance   92    0.20000E+01    0.60000E+01    0.78965E+00
 ARIEXC: peak, lower, upper, distance   93    0.20000E+01    0.60000E+01    0.84864E+00
 ARIEXC: peak, lower, upper, distance   94    0.19000E+01    0.45000E+01    0.85214E+00
 ARIEXC: peak, lower, upper, distance   95    0.20000E+01    0.56000E+01    0.83877E+00
 ARIEXC: peak, lower, upper, distance   96    0.20000E+01    0.50000E+01    0.84864E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.56000E+01    0.80116E+00
 ARIEXC: peak, lower, upper, distance   98    0.20000E+01    0.48000E+01    0.80647E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.84447E+00
 ARIEXC: peak, lower, upper, distance  101    0.20000E+01    0.60000E+01    0.79478E+00
 ARIEXC: peak, lower, upper, distance  103    0.18000E+01    0.42000E+01    0.83684E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.56000E+01    0.82362E+00
 ARIEXC: peak, lower, upper, distance  105    0.17000E+01    0.60000E+01    0.77528E+00
 ARIEXC: peak, lower, upper, distance  106    0.20000E+01    0.60000E+01    0.88096E+00
 ARIEXC: peak, lower, upper, distance  107    0.20000E+01    0.60000E+01    0.78231E+00
 ARIEXC: peak, lower, upper, distance  108    0.17000E+01    0.31000E+01    0.86280E+00
 ARIEXC: peak, lower, upper, distance  109    0.18000E+01    0.36000E+01    0.80819E+00
 ARIEXC: peak, lower, upper, distance  110    0.20000E+01    0.48000E+01    0.80067E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.86072E+00
 ARIEXC: peak, lower, upper, distance  113    0.16000E+01    0.28000E+01    0.87217E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.75529E+00
 ARIEXC: peak, lower, upper, distance  115    0.19000E+01    0.47000E+01    0.81114E+00
 ARIEXC: peak, lower, upper, distance  116    0.17000E+01    0.33000E+01    0.83434E+00
 ARIEXC: peak, lower, upper, distance  117    0.17000E+01    0.35000E+01    0.85951E+00
 ARIEXC: peak, lower, upper, distance  118    0.19000E+01    0.60000E+01    0.74847E+00
 ARIEXC: peak, lower, upper, distance  119    0.19000E+01    0.43000E+01    0.84008E+00
 ARIEXC: peak, lower, upper, distance  120    0.20000E+01    0.60000E+01    0.80132E+00
 ARIEXC: peak, lower, upper, distance  122    0.16000E+01    0.60000E+01    0.77620E+00
 ARIEXC: peak, lower, upper, distance  123    0.14000E+01    0.24000E+01    0.91292E+00
 ARIEXC: peak, lower, upper, distance  124    0.19000E+01    0.60000E+01    0.80181E+00
 ARIEXC: peak, lower, upper, distance  125    0.20000E+01    0.50000E+01    0.87211E+00
 ARIEXC: peak, lower, upper, distance  126    0.20000E+01    0.52000E+01    0.81216E+00
 ARIEXC: peak, lower, upper, distance  127    0.20000E+01    0.56000E+01    0.78338E+00
 ARIEXC: peak, lower, upper, distance  128    0.17000E+01    0.33000E+01    0.86605E+00
 ARIEXC: peak, lower, upper, distance  130    0.18000E+01    0.40000E+01    0.83747E+00
 ARIEXC: peak, lower, upper, distance  131    0.20000E+01    0.60000E+01    0.82996E+00
 ARIEXC: peak, lower, upper, distance  132    0.20000E+01    0.50000E+01    0.81445E+00
 ARIEXC: peak, lower, upper, distance  133    0.17000E+01    0.35000E+01    0.81803E+00
 ARIEXC: peak, lower, upper, distance  134    0.19000E+01    0.51000E+01    0.81426E+00
 ARIEXC: peak, lower, upper, distance  135    0.19000E+01    0.39000E+01    0.84211E+00
 ARIEXC: peak, lower, upper, distance  136    0.19000E+01    0.43000E+01    0.89396E+00
 ARIEXC: peak, lower, upper, distance  137    0.19000E+01    0.41000E+01    0.83774E+00
 ARIEXC: peak, lower, upper, distance  138    0.16000E+01    0.28000E+01    0.86654E+00
 ARIEXC: peak, lower, upper, distance  139    0.18000E+01    0.34000E+01    0.81201E+00
 ARIEXC: peak, lower, upper, distance  140    0.20000E+01    0.60000E+01    0.81639E+00
 ARIEXC: peak, lower, upper, distance  141    0.20000E+01    0.56000E+01    0.84222E+00
 ARIEXC: peak, lower, upper, distance  142    0.19000E+01    0.60000E+01    0.76311E+00
 ARIEXC: peak, lower, upper, distance  143    0.20000E+01    0.60000E+01    0.80652E+00
 ARIEXC: peak, lower, upper, distance  144    0.19000E+01    0.45000E+01    0.78751E+00
 ARIEXC: peak, lower, upper, distance  145    0.19000E+01    0.60000E+01    0.78253E+00
 ARIEXC: peak, lower, upper, distance  146    0.19000E+01    0.41000E+01    0.87913E+00
 ARIEXC: peak, lower, upper, distance  147    0.15000E+01    0.25000E+01    0.87953E+00
 ARIEXC: peak, lower, upper, distance  148    0.18000E+01    0.38000E+01    0.83675E+00
 ARIEXC: peak, lower, upper, distance  149    0.19000E+01    0.60000E+01    0.80165E+00
 ARIEXC: peak, lower, upper, distance  150    0.19000E+01    0.60000E+01    0.80525E+00
 ARIEXC: peak, lower, upper, distance  151    0.19000E+01    0.45000E+01    0.85669E+00
 ARIEXC: peak, lower, upper, distance  152    0.20000E+01    0.60000E+01    0.76940E+00
 ARIEXC: peak, lower, upper, distance  154    0.20000E+01    0.56000E+01    0.78179E+00
 ARIEXC: peak, lower, upper, distance  155    0.19000E+01    0.41000E+01    0.84270E+00
 ARIEXC: peak, lower, upper, distance  156    0.19000E+01    0.41000E+01    0.83550E+00
 ARIEXC: peak, lower, upper, distance  157    0.19000E+01    0.60000E+01    0.76803E+00
 ARIEXC: peak, lower, upper, distance  158    0.17000E+01    0.31000E+01    0.87670E+00
 ARIEXC: peak, lower, upper, distance  159    0.18000E+01    0.40000E+01    0.80328E+00
 ARIEXC: peak, lower, upper, distance  160    0.19000E+01    0.47000E+01    0.84881E+00
 ARIEXC: peak, lower, upper, distance  161    0.20000E+01    0.48000E+01    0.78513E+00
 ARIEXC: peak, lower, upper, distance  162    0.19000E+01    0.60000E+01    0.74725E+00
 ARIEXC: peak, lower, upper, distance  163    0.19000E+01    0.43000E+01    0.82518E+00
 ARIEXC: peak, lower, upper, distance  166    0.16000E+01    0.28000E+01    0.87554E+00
 ARIEXC: peak, lower, upper, distance  167    0.19000E+01    0.45000E+01    0.83515E+00
 ARIEXC: peak, lower, upper, distance  168    0.19000E+01    0.60000E+01    0.78770E+00
 ARIEXC: peak, lower, upper, distance  169    0.20000E+01    0.56000E+01    0.83184E+00
 ARIEXC: peak, lower, upper, distance  170    0.20000E+01    0.52000E+01    0.79812E+00
 ARIEXC: peak, lower, upper, distance  171    0.20000E+01    0.60000E+01    0.74670E+00
 ARIEXC: peak, lower, upper, distance  172    0.19000E+01    0.45000E+01    0.82097E+00
 ARIEXC: peak, lower, upper, distance  173    0.20000E+01    0.56000E+01    0.77587E+00
 ARIEXC: peak, lower, upper, distance  175    0.20000E+01    0.60000E+01    0.80172E+00
 ARIEXC: peak, lower, upper, distance  176    0.16000E+01    0.26000E+01    0.87491E+00
 ARIEXC: peak, lower, upper, distance  177    0.18000E+01    0.40000E+01    0.83546E+00
 ARIEXC: peak, lower, upper, distance  179    0.18000E+01    0.36000E+01    0.84245E+00
 ARIEXC: peak, lower, upper, distance  180    0.20000E+01    0.60000E+01    0.79798E+00
 ARIEXC: peak, lower, upper, distance  181    0.18000E+01    0.60000E+01    0.77686E+00
 ARIEXC: peak, lower, upper, distance  182    0.18000E+01    0.38000E+01    0.84992E+00
 ARIEXC: peak, lower, upper, distance  183    0.19000E+01    0.39000E+01    0.85023E+00
 ARIEXC: peak, lower, upper, distance  184    0.18000E+01    0.34000E+01    0.87330E+00
 ARIEXC: peak, lower, upper, distance  185    0.20000E+01    0.50000E+01    0.83804E+00
 ARIEXC: peak, lower, upper, distance  186    0.20000E+01    0.54000E+01    0.80806E+00
 ARIEXC: peak, lower, upper, distance  187    0.18000E+01    0.34000E+01    0.84277E+00
 ARIEXC: peak, lower, upper, distance  188    0.19000E+01    0.60000E+01    0.77643E+00
 ARIEXC: peak, lower, upper, distance  189    0.19000E+01    0.60000E+01    0.78994E+00
 ARIEXC: peak, lower, upper, distance  190    0.20000E+01    0.52000E+01    0.81104E+00
 ARIEXC: peak, lower, upper, distance  191    0.19000E+01    0.39000E+01    0.84047E+00
 ARIEXC: peak, lower, upper, distance  192    0.18000E+01    0.40000E+01    0.84246E+00
 ARIEXC: peak, lower, upper, distance  196    0.19000E+01    0.43000E+01    0.83694E+00
 ARIEXC: peak, lower, upper, distance  197    0.20000E+01    0.60000E+01    0.80891E+00
 ARIEXC: peak, lower, upper, distance  198    0.19000E+01    0.45000E+01    0.80658E+00
 ARIEXC: peak, lower, upper, distance  199    0.19000E+01    0.43000E+01    0.84230E+00
 ARIEXC: peak, lower, upper, distance  200    0.20000E+01    0.54000E+01    0.87847E+00
 ARIEXC: peak, lower, upper, distance  201    0.20000E+01    0.56000E+01    0.80717E+00
 ARIEXC: peak, lower, upper, distance  202    0.19000E+01    0.43000E+01    0.84713E+00
 ARIEXC: peak, lower, upper, distance  203    0.20000E+01    0.56000E+01    0.81751E+00
 ARIEXC: peak, lower, upper, distance  204    0.20000E+01    0.56000E+01    0.80084E+00
 ARIEXC: peak, lower, upper, distance  205    0.16000E+01    0.28000E+01    0.87141E+00
 ARIEXC: peak, lower, upper, distance  206    0.19000E+01    0.60000E+01    0.87447E+00
 ARIEXC: peak, lower, upper, distance  207    0.20000E+01    0.60000E+01    0.77270E+00
 ARIEXC: peak, lower, upper, distance  208    0.20000E+01    0.46000E+01    0.81664E+00
 ARIEXC: peak, lower, upper, distance  209    0.19000E+01    0.47000E+01    0.82268E+00
 ARIEXC: peak, lower, upper, distance  211    0.19000E+01    0.41000E+01    0.83623E+00
 ARIEXC: peak, lower, upper, distance  212    0.18000E+01    0.34000E+01    0.83423E+00
 ARIEXC: peak, lower, upper, distance  213    0.20000E+01    0.60000E+01    0.79860E+00
 ARIEXC: peak, lower, upper, distance  214    0.20000E+01    0.60000E+01    0.77561E+00
 ARIEXC: peak, lower, upper, distance  215    0.20000E+01    0.50000E+01    0.86093E+00
 ARIEXC: peak, lower, upper, distance  216    0.19000E+01    0.60000E+01    0.77808E+00
 ARIEXC: peak, lower, upper, distance  217    0.19000E+01    0.60000E+01    0.77638E+00
 ARIEXC: peak, lower, upper, distance  218    0.20000E+01    0.46000E+01    0.83508E+00
 ARIEXC: peak, lower, upper, distance  219    0.16000E+01    0.30000E+01    0.87217E+00
 ARIEXC: peak, lower, upper, distance  220    0.20000E+01    0.48000E+01    0.80225E+00
 ARIEXC: peak, lower, upper, distance  221    0.19000E+01    0.43000E+01    0.85702E+00
 ARIEXC: peak, lower, upper, distance  222    0.19000E+01    0.47000E+01    0.81326E+00
 ARIEXC: peak, lower, upper, distance  224    0.17000E+01    0.33000E+01    0.86363E+00
 ARIEXC: peak, lower, upper, distance  225    0.19000E+01    0.47000E+01    0.86335E+00
 ARIEXC: peak, lower, upper, distance  226    0.19000E+01    0.60000E+01    0.77639E+00
 ARIEXC: peak, lower, upper, distance  227    0.19000E+01    0.47000E+01    0.81267E+00
 ARIEXC: peak, lower, upper, distance  228    0.20000E+01    0.60000E+01    0.78326E+00
 ARIEXC: peak, lower, upper, distance  230    0.19000E+01    0.41000E+01    0.84043E+00
 ARIEXC: peak, lower, upper, distance  231    0.19000E+01    0.51000E+01    0.87218E+00
 ARIEXC: peak, lower, upper, distance  232    0.20000E+01    0.52000E+01    0.80963E+00
 ARIEXC: peak, lower, upper, distance  233    0.19000E+01    0.60000E+01    0.79028E+00
 ARIEXC: peak, lower, upper, distance  234    0.19000E+01    0.60000E+01    0.83891E+00
 ARIEXC: peak, lower, upper, distance  237    0.17000E+01    0.35000E+01    0.85278E+00
 ARIEXC: peak, lower, upper, distance  238    0.17000E+01    0.60000E+01    0.76422E+00
 ARIEXC: peak, lower, upper, distance  239    0.18000E+01    0.36000E+01    0.83987E+00
 ARIEXC: peak, lower, upper, distance  240    0.20000E+01    0.50000E+01    0.84843E+00
 ARIEXC: peak, lower, upper, distance  241    0.19000E+01    0.43000E+01    0.81856E+00
 ARIEXC: peak, lower, upper, distance  242    0.17000E+01    0.33000E+01    0.88704E+00
 ARIEXC: peak, lower, upper, distance  243    0.20000E+01    0.60000E+01    0.78420E+00
 ARIEXC: peak, lower, upper, distance  245    0.19000E+01    0.49000E+01    0.78176E+00
 ARIEXC: peak, lower, upper, distance  246    0.17000E+01    0.31000E+01    0.86922E+00
 ARIEXC: peak, lower, upper, distance  247    0.18000E+01    0.60000E+01    0.79152E+00
 ARIEXC: peak, lower, upper, distance  248    0.19000E+01    0.47000E+01    0.83803E+00
 ARIEXC: peak, lower, upper, distance  250    0.18000E+01    0.36000E+01    0.84501E+00
 ARIEXC: peak, lower, upper, distance  252    0.19000E+01    0.60000E+01    0.77506E+00
 ARIEXC: peak, lower, upper, distance  253    0.15000E+01    0.27000E+01    0.88130E+00
 ARIEXC: peak, lower, upper, distance  255    0.19000E+01    0.45000E+01    0.80969E+00
 ARIEXC: peak, lower, upper, distance  256    0.20000E+01    0.50000E+01    0.79846E+00
 ARIEXC: peak, lower, upper, distance  257    0.18000E+01    0.34000E+01    0.83864E+00
 ARIEXC: peak, lower, upper, distance  258    0.20000E+01    0.58000E+01    0.80452E+00
 ARIEXC: peak, lower, upper, distance  259    0.20000E+01    0.56000E+01    0.85615E+00
 ARIEXC: peak, lower, upper, distance  260    0.19000E+01    0.43000E+01    0.80855E+00
 ARIEXC: peak, lower, upper, distance  262    0.18000E+01    0.38000E+01    0.83585E+00
 ARIEXC: peak, lower, upper, distance  264    0.18000E+01    0.36000E+01    0.80530E+00
 ARIEXC: peak, lower, upper, distance  265    0.19000E+01    0.60000E+01    0.77659E+00
 ARIEXC: peak, lower, upper, distance  266    0.17000E+01    0.60000E+01    0.78760E+00
 ARIEXC: peak, lower, upper, distance    1    0.20000E+01    0.52000E+01    0.84092E+00
 ARIEXC: peak, lower, upper, distance    2    0.16000E+01    0.30000E+01    0.86089E+00
 ARIEXC: peak, lower, upper, distance    3    0.20000E+01    0.60000E+01    0.78533E+00
 ARIEXC: peak, lower, upper, distance    4    0.11000E+01    0.60000E+01    0.74137E+00
 ARIEXC: peak, lower, upper, distance    5    0.20000E+01    0.58000E+01    0.79067E+00
 ARIEXC: peak, lower, upper, distance    6    0.20000E+01    0.60000E+01    0.74603E+00
 ARIEXC: peak, lower, upper, distance    7    0.20000E+01    0.50000E+01    0.80423E+00
 ARIEXC: peak, lower, upper, distance    8    0.19000E+01    0.60000E+01    0.75815E+00
 ARIEXC: peak, lower, upper, distance    9    0.20000E+01    0.56000E+01    0.84140E+00
 ARIEXC: peak, lower, upper, distance   11    0.20000E+01    0.60000E+01    0.74112E+00
 ARIEXC: peak, lower, upper, distance   12    0.19000E+01    0.60000E+01    0.79926E+00
 ARIEXC: peak, lower, upper, distance   13    0.18000E+01    0.36000E+01    0.83594E+00
 ARIEXC: peak, lower, upper, distance   14    0.19000E+01    0.41000E+01    0.82741E+00
 ARIEXC: peak, lower, upper, distance   16    0.18000E+01    0.60000E+01    0.78934E+00
 ARIEXC: peak, lower, upper, distance   17    0.17000E+01    0.35000E+01    0.85510E+00
 ARIEXC: peak, lower, upper, distance   20    0.19000E+01    0.60000E+01    0.76732E+00
 ARIEXC: peak, lower, upper, distance   21    0.19000E+01    0.60000E+01    0.77434E+00
 ARIEXC: peak, lower, upper, distance   24    0.19000E+01    0.49000E+01    0.81305E+00
 ARIEXC: peak, lower, upper, distance   25    0.14000E+01    0.24000E+01    0.84467E+00
 ARIEXC: peak, lower, upper, distance   29    0.16000E+01    0.30000E+01    0.84530E+00
 ARIEXC: peak, lower, upper, distance   42    0.20000E+01    0.58000E+01    0.80789E+00
 ARIEXC: peak, lower, upper, distance   51    0.20000E+01    0.60000E+01    0.74925E+00
 ARIEXC: peak, lower, upper, distance   54    0.19000E+01    0.43000E+01    0.79738E+00
 ARIEXC: peak, lower, upper, distance   56    0.20000E+01    0.60000E+01    0.77124E+00
 ARIEXC: peak, lower, upper, distance   59    0.20000E+01    0.58000E+01    0.76611E+00
 ARIEXC: peak, lower, upper, distance   60    0.20000E+01    0.58000E+01    0.76539E+00
 ARIEXC: peak, lower, upper, distance   61    0.20000E+01    0.60000E+01    0.76261E+00
 ARIEXC: peak, lower, upper, distance   66    0.20000E+01    0.46000E+01    0.81107E+00
 ARIEXC: peak, lower, upper, distance   67    0.20000E+01    0.52000E+01    0.79012E+00
 ARIEXC: peak, lower, upper, distance   68    0.17000E+01    0.33000E+01    0.86073E+00
 ARIEXC: peak, lower, upper, distance   69    0.19000E+01    0.47000E+01    0.82061E+00
 ARIEXC: peak, lower, upper, distance   70    0.20000E+01    0.60000E+01    0.79080E+00
 ARIEXC: peak, lower, upper, distance   71    0.17000E+01    0.33000E+01    0.85184E+00
 ARIEXC: peak, lower, upper, distance   72    0.20000E+01    0.60000E+01    0.78824E+00
 ARIEXC: peak, lower, upper, distance   73    0.16000E+01    0.26000E+01    0.85599E+00
 ARIEXC: peak, lower, upper, distance   74    0.20000E+01    0.52000E+01    0.80612E+00
 ARIEXC: peak, lower, upper, distance   75    0.19000E+01    0.60000E+01    0.75742E+00
 ARIEXC: peak, lower, upper, distance   77    0.16000E+01    0.28000E+01    0.86187E+00
 ARIEXC: peak, lower, upper, distance   78    0.20000E+01    0.58000E+01    0.79240E+00
 ARIEXC: peak, lower, upper, distance   79    0.20000E+01    0.56000E+01    0.78447E+00
 ARIEXC: peak, lower, upper, distance   80    0.17000E+01    0.33000E+01    0.83039E+00
 ARIEXC: peak, lower, upper, distance   82    0.20000E+01    0.50000E+01    0.79005E+00
 ARIEXC: peak, lower, upper, distance   83    0.19000E+01    0.60000E+01    0.72858E+00
 ARIEXC: peak, lower, upper, distance   84    0.17000E+01    0.35000E+01    0.86194E+00
 ARIEXC: peak, lower, upper, distance   85    0.19000E+01    0.41000E+01    0.77947E+00
 ARIEXC: peak, lower, upper, distance   86    0.20000E+01    0.54000E+01    0.83870E+00
 ARIEXC: peak, lower, upper, distance   89    0.20000E+01    0.54000E+01    0.77405E+00
 ARIEXC: peak, lower, upper, distance   90    0.18000E+01    0.60000E+01    0.77431E+00
 ARIEXC: peak, lower, upper, distance   91    0.18000E+01    0.40000E+01    0.83790E+00
 ARIEXC: peak, lower, upper, distance   93    0.19000E+01    0.39000E+01    0.85417E+00
 ARIEXC: peak, lower, upper, distance   95    0.19000E+01    0.39000E+01    0.82719E+00
 ARIEXC: peak, lower, upper, distance   96    0.18000E+01    0.60000E+01    0.74623E+00
 ARIEXC: peak, lower, upper, distance   97    0.20000E+01    0.60000E+01    0.75981E+00
 ARIEXC: peak, lower, upper, distance   98    0.17000E+01    0.33000E+01    0.84883E+00
 ARIEXC: peak, lower, upper, distance   99    0.19000E+01    0.45000E+01    0.79988E+00
 ARIEXC: peak, lower, upper, distance  101    0.19000E+01    0.45000E+01    0.90273E+00
 ARIEXC: peak, lower, upper, distance  102    0.18000E+01    0.38000E+01    0.78286E+00
 ARIEXC: peak, lower, upper, distance  103    0.19000E+01    0.60000E+01    0.77408E+00
 ARIEXC: peak, lower, upper, distance  104    0.20000E+01    0.46000E+01    0.85464E+00
 ARIEXC: peak, lower, upper, distance  105    0.20000E+01    0.60000E+01    0.80101E+00
 ARIEXC: peak, lower, upper, distance  106    0.19000E+01    0.43000E+01    0.85467E+00
 ARIEXC: peak, lower, upper, distance  107    0.18000E+01    0.40000E+01    0.81317E+00
 ARIEXC: peak, lower, upper, distance  109    0.20000E+01    0.60000E+01    0.73914E+00
 ARIEXC: peak, lower, upper, distance  111    0.20000E+01    0.60000E+01    0.78721E+00
 ARIEXC: peak, lower, upper, distance  112    0.19000E+01    0.60000E+01    0.82429E+00
 ARIEXC: peak, lower, upper, distance  113    0.20000E+01    0.54000E+01    0.78185E+00
 ARIEXC: peak, lower, upper, distance  114    0.19000E+01    0.60000E+01    0.78528E+00
 ARIEXC: peak, lower, upper, distance  115    0.18000E+01    0.40000E+01    0.86107E+00
 ARIEXC: peak, lower, upper, distance  116    0.20000E+01    0.50000E+01    0.75670E+00
 ARIEXC: peak, lower, upper, distance  117    0.20000E+01    0.60000E+01    0.78805E+00
 COUNTV:  839 violations above         0.10000
 ARIA>      end 
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 NEXTCD: condition evaluated as true
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/ww1_7.float opened.
 ARIA> REVE ((segid "    " and resid 1    and name HA1 ) OR   ( segid "    " and resid 1    and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 2    and name HB1 ) OR   ( segid "    " and resid 2    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 3    and name HD1 ) OR   ( segid "    " and resid 3    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 4    and name HB1 ) OR   ( segid "    " and resid 4    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HB1 ) OR   ( segid "    " and resid 5    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 5    and name HG1 ) OR   ( segid "    " and resid 5    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 6    and name HD11) OR   ( segid "    " and resid 6    and name HD21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HB1 ) OR   ( segid "    " and resid 7    and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HG1 ) OR   ( segid "    " and resid 7    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 7    and name HD1 ) OR   ( segid "    " and resid 7    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HG1 ) OR   ( segid "    " and resid 8    and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 8    and name HD1 ) OR   ( segid "    " and resid 8    and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 11   and name HG1 ) OR   ( segid "    " and resid 11   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HB1 ) OR   ( segid "    " and resid 13   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HD1 ) OR   ( segid "    " and resid 13   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH11) OR   ( segid "    " and resid 13   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 13   and name HH21) OR   ( segid "    " and resid 13   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 15   and name HB1 ) OR   ( segid "    " and resid 15   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 16   and name HG11) OR   ( segid "    " and resid 16   and name HG21)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 18   and name HA1 ) OR   ( segid "    " and resid 18   and name HA2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HB1 ) OR   ( segid "    " and resid 19   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 19   and name HG1 ) OR   ( segid "    " and resid 19   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 22   and name HB1 ) OR   ( segid "    " and resid 22   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 26   and name HB1 ) OR   ( segid "    " and resid 26   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 28   and name HH11) OR   ( segid "    " and resid 28   and name HH12)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HB1 ) OR   ( segid "    " and resid 33   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HD1 ) OR   ( segid "    " and resid 33   and name HD2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 33   and name HE1 ) OR   ( segid "    " and resid 33   and name HE2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HG1 ) OR   ( segid "    " and resid 34   and name HG2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 34   and name HH21) OR   ( segid "    " and resid 34   and name HH22)) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 36   and name HB1 ) OR   ( segid "    " and resid 36   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 38   and name HB1 ) OR   ( segid "    " and resid 38   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> REVE ((segid "    " and resid 39   and name HB1 ) OR   ( segid "    " and resid 39   and name HB2 )) 
 SELRPN:      2 atoms have been selected out of    622
 ARIA> end end if 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($count=$count+1) 
 EVALUATE: symbol $COUNT set to    8.00000     (real)
 CNSsolve>end loop main 
 CNSsolve>while ($count le $Iterations.Assignstruct) loop main 
 NEXTCD: condition evaluated as false
 CNSsolve>   evaluate ($file = $filenames.bestfile_$count) 
 CNSsolve>   display $file 
 CNSsolve>   coor init end 
 CNSsolve>   if ($file ne "") then 
 CNSsolve>      coor @@$file 
 CNSsolve>      eval ($floatfile = $file - ".pdb" + ".float") 
 CNSsolve>      fileexist $floatfile end  eval ($qfloatfile = $result) 
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 CNSsolve>      aria 
 CNSsolve>         analyse_restraints aver end 
 CNSsolve>         countvio threshold $Iterations.violtoler end 
 CNSsolve>      end 
 CNSsolve>      if ($qfloatfile eq true) then aria @@$floatfile end end if 
 CNSsolve>   end if 
 CNSsolve>   evaluate ($count=$count+1) 
 CNSsolve>end loop main 
 CNSsolve> 
 CNSsolve>! list violated restraints 
 CNSsolve>aria countvio list DIST $Iterations.violratio end end 
 CNSsolve>! compare noe tables and remove double entries 
 CNSsolve>aria analyse_restraints cutoff 1000 level 1.01 check * end end 
 Duplicate restraint removed (1):        1       1       660       5
 Duplicate restraint removed (1):        2       3       709      58
 Duplicate restraint removed (1):        3       4       895     262
 Duplicate restraint removed (1):        7       8       897     264
 Duplicate restraint removed (1):       10      13       891     257
 Duplicate restraint removed (1):       14      17       894     260
 Duplicate restraint removed (1):       17      23       893     259
 Duplicate restraint removed (2):       20      26       782     138
 Duplicate restraint removed (2):       24      31       777     133
 Duplicate restraint removed (1):       25      32       778     134
 Duplicate restraint removed (1):       26      33       989     117
 Duplicate restraint removed (2):       27      34       963      86
 Duplicate restraint removed (1):       28      35       988     116
 Duplicate restraint removed (2):       29      36       962      85
 Duplicate restraint removed (2):       33      47       780     136
 Duplicate restraint removed (1):       54      72       664       9
 Duplicate restraint removed (1):       63      87       971      97
 Duplicate restraint removed (2):       74     104       862     225
 Duplicate restraint removed (1):       75     105       858     220
 Duplicate restraint removed (2):       76     106       924      26
 Duplicate restraint removed (1):       77     107       933      45
 Duplicate restraint removed (1):       84     114       964      89
 Duplicate restraint removed (1):       86     117       783     139
 Duplicate restraint removed (1):       91     122       742      95
 Duplicate restraint removed (2):       92     123       749     104
 Duplicate restraint removed (1):       94     126       837     198
 Duplicate restraint removed (2):       95     127       838     199
 Duplicate restraint removed (1):      107     140       675      21
 Duplicate restraint removed (1):      108     141       674      20
 Duplicate restraint removed (1):      111     145       669      15
 Duplicate restraint removed (1):      112     146       761     116
 Duplicate restraint removed (1):      114     148       750     105
 Duplicate restraint removed (1):      115     149       762     117
 Duplicate restraint removed (2):      116     150       776     132
 Duplicate restraint removed (2):      121     155       685      33
 Duplicate restraint removed (2):      122     156       672      18
 Duplicate restraint removed (2):      130     164       688      36
 Duplicate restraint removed (2):      131     165       689      37
 Duplicate restraint removed (2):      132     166       677      23
 Duplicate restraint removed (1):      133     167       676      22
 Duplicate restraint removed (1):      134     168       972      98
 Duplicate restraint removed (1):      135     169       973      99
 Duplicate restraint removed (2):      146     184       691      39
 Duplicate restraint removed (1):      147     185       655       1
 Duplicate restraint removed (1):      150     189       690      38
 Duplicate restraint removed (1):      151     190       696      45
 Duplicate restraint removed (2):      153     193       695      44
 Duplicate restraint removed (2):      154     194       810     168
 Duplicate restraint removed (2):      159     199       701      50
 Duplicate restraint removed (1):      161     201       702      51
 Duplicate restraint removed (2):      176     221       703      52
 Duplicate restraint removed (1):      177     222       659       4
 Duplicate restraint removed (2):      178     223       714      64
 Duplicate restraint removed (1):      179     224       705      54
 Duplicate restraint removed (1):      181     226       938      54
 Duplicate restraint removed (1):      190     240       935      51
 Duplicate restraint removed (1):      200     253       710      59
 Duplicate restraint removed (2):      207     264       734      87
 Duplicate restraint removed (1):      208     265       790     146
 Duplicate restraint removed (1):      209     266       708      57
 Duplicate restraint removed (1):      215     274       739      92
 Duplicate restraint removed (1):      217     276       713      62
 Duplicate restraint removed (2):      221     281       738      91
 Duplicate restraint removed (1):      222     282       711      60
 Duplicate restraint removed (1):      223     283       712      61
 Duplicate restraint removed (1):      224     284       719      70
 Duplicate restraint removed (1):      225     285       720      71
 Duplicate restraint removed (1):      226     288       735      88
 Duplicate restraint removed (1):      227     289       741      94
 Duplicate restraint removed (1):      233     296       736      89
 Duplicate restraint removed (2):      234     297       737      90
 Duplicate restraint removed (1):      235     298       744      97
 Duplicate restraint removed (1):      236     299       743      96
 Duplicate restraint removed (1):      237     300       751     106
 Duplicate restraint removed (2):      242     312       662       7
 Duplicate restraint removed (1):      243     313       745      98
 Duplicate restraint removed (2):      246     318       748     103
 Duplicate restraint removed (1):      247     319       760     115
 Duplicate restraint removed (1):      253     327       753     108
 Duplicate restraint removed (1):      254     328       779     135
 Duplicate restraint removed (2):      260     335       797     153
 Duplicate restraint removed (1):      261     337       704      53
 Duplicate restraint removed (2):      266     345       802     158
 Duplicate restraint removed (1):      274     354       805     161
 Duplicate restraint removed (1):      286     367       808     166
 Duplicate restraint removed (2):      287     368       800     156
 Duplicate restraint removed (2):      297     379       812     170
 Duplicate restraint removed (2):      299     381       811     169
 Duplicate restraint removed (2):      300     382       803     159
 Duplicate restraint removed (2):      301     383       804     160
 Duplicate restraint removed (2):      302     384       949      71
 Duplicate restraint removed (2):      304     387       925      29
 Duplicate restraint removed (2):      312     397       809     167
 Duplicate restraint removed (2):      314     400       956      79
 Duplicate restraint removed (2):      321     407       814     172
 Duplicate restraint removed (1):      322     408       821     180
 Duplicate restraint removed (1):      323     409       927      34
 Duplicate restraint removed (2):      324     410       934      50
 Duplicate restraint removed (1):      327     416       692      40
 Duplicate restraint removed (1):      338     431       815     173
 Duplicate restraint removed (1):      339     432       823     182
 Duplicate restraint removed (2):      341     434       930      39
 Duplicate restraint removed (2):      342     435       937      53
 Duplicate restraint removed (2):      347     446       687      35
 Duplicate restraint removed (2):      348     447       818     177
 Duplicate restraint removed (1):      356     455       820     179
 Duplicate restraint removed (1):      357     456       846     207
 Duplicate restraint removed (1):      358     457       851     213
 Duplicate restraint removed (1):      359     458       770     125
 Duplicate restraint removed (1):      360     459       771     126
 Duplicate restraint removed (1):      361     460       824     183
 Duplicate restraint removed (1):      365     466       831     190
 Duplicate restraint removed (1):      367     468       910      12
 Duplicate restraint removed (1):      372     473       833     192
 Duplicate restraint removed (1):      375     477       832     191
 Duplicate restraint removed (1):      381     483       657       2
 Duplicate restraint removed (1):      382     484       839     200
 Duplicate restraint removed (2):      385     489       834     193
 Duplicate restraint removed (2):      387     492       835     196
 Duplicate restraint removed (1):      392     497       844     205
 Duplicate restraint removed (1):      393     498       850     212
 Duplicate restraint removed (1):      403     511       847     208
 Duplicate restraint removed (1):      412     531       859     221
 Duplicate restraint removed (1):      413     532       905       6
 Duplicate restraint removed (2):      414     533       967      92
 Duplicate restraint removed (2):      415     534       960      83
 Duplicate restraint removed (2):      417     541       861     224
 Duplicate restraint removed (2):      418     542       856     218
 Duplicate restraint removed (2):      419     543       955      78
 Duplicate restraint removed (2):      423     550       865     228
 Duplicate restraint removed (1):      424     551       860     222
 Duplicate restraint removed (2):      425     552       928      35
 Duplicate restraint removed (2):      426     553       936      52
 Duplicate restraint removed (2):      436     566       863     226
 Duplicate restraint removed (1):      438     568       864     227
 Duplicate restraint removed (1):      441     571       878     243
 Duplicate restraint removed (2):      444     574       877     242
 Duplicate restraint removed (1):      445     575       731      83
 Duplicate restraint removed (2):      447     577       730      82
 Duplicate restraint removed (1):      460     591       867     231
 Duplicate restraint removed (1):      461     592       868     232
 Duplicate restraint removed (2):      462     593       984     112
 Duplicate restraint removed (2):      463     594       983     111
 Duplicate restraint removed (1):      464     595       875     240
 Duplicate restraint removed (1):      465     596       980     106
 Duplicate restraint removed (1):      466     597       981     107
 Duplicate restraint removed (2):      467     598       876     241
 Duplicate restraint removed (1):      470     603       880     246
 Duplicate restraint removed (1):      471     604       874     239
 Duplicate restraint removed (2):      475     609       658       3
 Duplicate restraint removed (1):      484     620       879     245
 Duplicate restraint removed (1):      491     630       882     248
 Duplicate restraint removed (2):      496     638       974     100
 Duplicate restraint removed (1):      497     639       975     101
 Duplicate restraint removed (1):      509     666       667      13
 Duplicate restraint removed (1):      510     667       673      19
 Duplicate restraint removed (1):      515     672       887     253
 Duplicate restraint removed (2):      516     673       722      74
 Duplicate restraint removed (2):      517     674       723      75
 Duplicate restraint removed (1):      549     719       889     255
 Duplicate restraint removed (1):      550     720       906       7
 Duplicate restraint removed (2):      562     736       791     147
 Duplicate restraint removed (1):      571     748       857     219
 Duplicate restraint removed (1):      572     749       849     211
 Duplicate restraint removed (1):      583     767       892     258
 Duplicate restraint removed (1):      591     775       976     102
 Duplicate restraint removed (1):      595     783       656       1
 Duplicate restraint removed (1):      598     789       884     250
 Duplicate restraint removed (2):      612     813       754     109
 Duplicate restraint removed (2):      617     820       697      46
 Duplicate restraint removed (1):      618     821       665      10
 Duplicate restraint removed (1):      623     831       755     110
 Duplicate restraint removed (1):      629     845       756     111
 Duplicate restraint removed (2):      634     851       698      47
 Duplicate restraint removed (1):      635     852       666      11
 Duplicate restraint removed (1):      645     866       746      99
 Duplicate restraint removed (1):      647     868       752     107
 CNSsolve> 
 CNSsolve>evaluate ($file = "NEWIT:unambig.tbl") 
 EVALUATE: symbol $FILE set to "NEWIT:unambig.tbl" (string)
 CNSsolve>set print $file end 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/finaldata/unambig.tbl opened.
 CNSsolve>aria analyse_restraints 
 ANALyse_restraints>      mode intra 
 ANALyse_restraints>      minn 1 maxn 1 
 ANALyse_restraints>      cutoff 1000 
 ANALyse_restraints>      level 1.01 
 ANALyse_restraints>      or-restraint * 
 ANALyse_restraints>end end 
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CNSsolve> 
 CNSsolve> 
 CNSsolve>evaluate ($file = "NEWIT:ambig.tbl") 
 EVALUATE: symbol $FILE set to "NEWIT:ambig.tbl" (string)
 CNSsolve>set print $file end 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/finaldata/ambig.tbl opened.
 CNSsolve>aria analyse_restraints 
 ANALyse_restraints>      mode intra 
 ANALyse_restraints>      minn 2 maxn $iterations.maxn 
 ANALyse_restraints>      cutoff 1000 
 ANALyse_restraints>      level 1.01 
 ANALyse_restraints>      or-restraint * 
 ANALyse_restraints>end end 
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CNSsolve> 
 CNSsolve> 
 CNSsolve>evaluate ($file = "NEWIT:merged.list") 
 EVALUATE: symbol $FILE set to "NEWIT:merged.list" (string)
 CNSsolve>set print $file end 
 ASSFIL: file /usr/lab/people/fkieken/ww1/run12/structures/it8/finaldata/merged.list opened.
 CNSsolve>aria analyse_restraints 
 ANALyse_restraints>      mode intra 
 ANALyse_restraints>      minn 1 maxn $iterations.maxn 
 ANALyse_restraints>      cutoff 1000 
 ANALyse_restraints>      level 1.01 
 ANALyse_restraints>      list * 
 ANALyse_restraints>end end 
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CHPR: d^-6, int     0.55487E-02    0.55487E-02    0.27000E+01
 CNSsolve> 
 CNSsolve> 
 CNSsolve>stop 
 HEAP: maximum use      =    18328588 current use      =           0 bytes
 HEAP: maximum overhead =         464 current overhead =          64 bytes
          ============================================================
           Maximum dynamic memory allocation:    18328588 bytes
           Maximum dynamic memory overhead:           464 bytes
           Program started at: 14:13:52 on 02-Mar-2010
           Program stopped at: 14:15:41 on 02-Mar-2010
           CPU time used:     109.2300 seconds
          ============================================================

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1   4.609   5.824  14.213
    2    H2   GLY   1           HT2      GLY   1   5.542   6.044  12.815
    3    H3   GLY   1           HT3      GLY   1   5.461   4.518  13.550
    4    HA2  GLY   1           HA1      GLY   1   4.075   4.576  11.577
    5    HA3  GLY   1           HA2      GLY   1   3.110   4.353  13.033
    6    H    SER   2           HN       SER   2   2.765   5.675  10.242
    7    HA   SER   2           HA       SER   2   1.565   8.158  11.258
    8    HB2  SER   2           HB2      SER   2   1.949   8.940   8.803
    9    HB3  SER   2           HB1      SER   2   3.321   8.929   9.911
   10    HG   SER   2           HG       SER   2   2.905   7.488   7.626
   11    HA   PRO   3           HA       PRO   3  -2.181   6.424   9.684
   12    HB2  PRO   3           HB2      PRO   3  -3.777   8.594   9.839
   13    HB3  PRO   3           HB1      PRO   3  -3.208   7.738  11.275
   14    HG2  PRO   3           HG2      PRO   3  -2.208  10.277  10.061
   15    HG3  PRO   3           HG1      PRO   3  -2.424   9.862  11.769
   16    HD2  PRO   3           HD2      PRO   3  -0.009   9.793  10.458
   17    HD3  PRO   3           HD1      PRO   3  -0.390   8.826  11.897
   18    H    SER   4           HN       SER   4  -1.950   5.908   7.554
   19    HA   SER   4           HA       SER   4  -2.174   8.036   5.557
   20    HB2  SER   4           HB2      SER   4  -1.610   5.083   5.155
   21    HB3  SER   4           HB1      SER   4  -1.490   6.350   3.935
   22    HG   SER   4           HG       SER   4   0.555   5.900   4.755
   23    HA   PRO   5           HA       PRO   5  -6.510   6.907   5.214
   24    HB2  PRO   5           HB2      PRO   5  -7.119   8.653   3.217
   25    HB3  PRO   5           HB1      PRO   5  -6.974   9.136   4.912
   26    HG2  PRO   5           HG2      PRO   5  -5.001   9.416   2.682
   27    HG3  PRO   5           HG1      PRO   5  -5.404  10.560   3.976
   28    HD2  PRO   5           HD2      PRO   5  -3.190   8.985   4.030
   29    HD3  PRO   5           HD1      PRO   5  -4.030   9.524   5.496
   30    H    LEU   6           HN       LEU   6  -5.811   4.818   4.409
   31    HA   LEU   6           HA       LEU   6  -5.834   4.593   1.474
   32    HB2  LEU   6           HB2      LEU   6  -4.660   2.753   3.564
   33    HB3  LEU   6           HB1      LEU   6  -4.686   2.419   1.841
   34    HG   LEU   6           HG       LEU   6  -3.269   4.755   3.119
   35   HD11  LEU   6          HD11      LEU   6  -1.213   3.535   2.687
   36   HD12  LEU   6          HD12      LEU   6  -2.134   2.174   2.046
   37   HD13  LEU   6          HD13      LEU   6  -2.268   2.604   3.751
   38   HD21  LEU   6          HD21      LEU   6  -3.952   5.193   0.827
   39   HD22  LEU   6          HD22      LEU   6  -3.220   3.677   0.300
   40   HD23  LEU   6          HD23      LEU   6  -2.203   4.978   0.918
   41    HA   PRO   7           HA       PRO   7  -9.453   1.896   1.420
   42    HB2  PRO   7           HB2      PRO   7  -8.152  -0.314   0.219
   43    HB3  PRO   7           HB1      PRO   7  -9.120   0.906  -0.590
   44    HG2  PRO   7           HG2      PRO   7  -6.197   0.656  -0.362
   45    HG3  PRO   7           HG1      PRO   7  -7.161   1.428  -1.631
   46    HD2  PRO   7           HD2      PRO   7  -5.746   2.850   0.173
   47    HD3  PRO   7           HD1      PRO   7  -7.292   3.430  -0.485
   48    HA   PRO   8           HA       PRO   8  -9.150  -0.644   5.021
   49    HB2  PRO   8           HB2      PRO   8 -11.010  -2.476   3.589
   50    HB3  PRO   8           HB1      PRO   8 -11.169  -1.727   5.183
   51    HG2  PRO   8           HG2      PRO   8 -12.590  -0.790   3.162
   52    HG3  PRO   8           HG1      PRO   8 -11.810   0.328   4.299
   53    HD2  PRO   8           HD2      PRO   8 -10.939  -0.471   1.545
   54    HD3  PRO   8           HD1      PRO   8 -10.965   1.140   2.292
   55    H    GLY   9           HN       GLY   9  -7.606  -1.982   5.577
   56    HA2  GLY   9           HA2      GLY   9  -6.582  -4.104   5.635
   57    HA3  GLY   9           HA1      GLY   9  -7.147  -4.395   3.996
   58    H    TRP  10           HN       TRP  10  -6.109  -1.526   3.417
   59    HA   TRP  10           HA       TRP  10  -3.494  -2.467   2.573
   60    HB2  TRP  10           HB2      TRP  10  -5.196  -0.091   1.911
   61    HB3  TRP  10           HB1      TRP  10  -3.483  -0.080   1.514
   62    HD1  TRP  10           HD1      TRP  10  -6.797  -1.574   0.388
   63    HE1  TRP  10           HE1      TRP  10  -6.419  -2.848  -1.824
   64    HE3  TRP  10           HE3      TRP  10  -1.699  -1.439   0.273
   65    HZ2  TRP  10           HZ2      TRP  10  -4.198  -3.674  -3.407
   66    HZ3  TRP  10           HZ3      TRP  10  -0.519  -2.489  -1.620
   67    HH2  TRP  10           HH2      TRP  10  -1.748  -3.585  -3.419
   68    H    GLU  11           HN       GLU  11  -1.553  -1.657   3.189
   69    HA   GLU  11           HA       GLU  11  -1.473   0.609   5.028
   70    HB2  GLU  11           HB2      GLU  11   0.226  -0.667   6.403
   71    HB3  GLU  11           HB1      GLU  11  -1.445  -1.181   6.576
   72    HG2  GLU  11           HG2      GLU  11  -1.079  -3.091   5.224
   73    HG3  GLU  11           HG1      GLU  11   0.522  -2.520   4.739
   74    H    GLU  12           HN       GLU  12   0.443   1.751   5.006
   75    HA   GLU  12           HA       GLU  12   2.032   1.420   2.601
   76    HB2  GLU  12           HB2      GLU  12   1.146   3.637   3.222
   77    HB3  GLU  12           HB1      GLU  12   2.055   3.577   4.722
   78    HG2  GLU  12           HG2      GLU  12   4.132   3.672   3.537
   79    HG3  GLU  12           HG1      GLU  12   3.301   3.527   1.989
   80    H    ARG  13           HN       ARG  13   3.977   0.435   2.592
   81    HA   ARG  13           HA       ARG  13   5.417   0.186   5.148
   82    HB2  ARG  13           HB2      ARG  13   4.794  -2.026   3.188
   83    HB3  ARG  13           HB1      ARG  13   5.982  -2.169   4.477
   84    HG2  ARG  13           HG2      ARG  13   3.038  -1.663   4.856
   85    HG3  ARG  13           HG1      ARG  13   3.855  -3.213   5.052
   86    HD2  ARG  13           HD2      ARG  13   5.182  -2.315   6.876
   87    HD3  ARG  13           HD1      ARG  13   4.443  -0.725   6.656
   88    HE   ARG  13           HE       ARG  13   2.457  -2.709   7.066
   89   HH11  ARG  13          HH11      ARG  13   4.945  -0.983   8.839
   90   HH12  ARG  13          HH12      ARG  13   4.051  -0.967  10.323
   91   HH21  ARG  13          HH21      ARG  13   1.259  -2.657   8.988
   92   HH22  ARG  13          HH22      ARG  13   1.944  -1.927  10.409
   93    H    GLN  14           HN       GLN  14   7.667  -0.598   4.801
   94    HA   GLN  14           HA       GLN  14   8.689  -0.297   2.098
   95    HB2  GLN  14           HB2      GLN  14  10.435   1.200   2.658
   96    HB3  GLN  14           HB1      GLN  14   8.986   1.907   3.364
   97    HG2  GLN  14           HG2      GLN  14   9.644   1.437   5.520
   98    HG3  GLN  14           HG1      GLN  14  10.704   0.116   5.022
   99   HE21  GLN  14          HE21      GLN  14  12.737   0.604   4.144
  100   HE22  GLN  14          HE22      GLN  14  13.503   2.136   4.445
  101    H    ASP  15           HN       ASP  15  10.586  -1.501   1.762
  102    HA   ASP  15           HA       ASP  15  11.210  -3.389   3.902
  103    HB2  ASP  15           HB2      ASP  15  12.544  -4.555   2.086
  104    HB3  ASP  15           HB1      ASP  15  10.803  -4.518   1.851
  105    H    VAL  16           HN       VAL  16  13.768  -4.017   3.541
  106    HA   VAL  16           HA       VAL  16  15.167  -1.906   4.760
  107    HB   VAL  16           HB       VAL  16  16.380  -4.272   3.352
  108   HG11  VAL  16          HG11      VAL  16  17.996  -2.566   3.983
  109   HG12  VAL  16          HG12      VAL  16  18.197  -4.006   4.980
  110   HG13  VAL  16          HG13      VAL  16  17.387  -2.584   5.639
  111   HG21  VAL  16          HG21      VAL  16  16.265  -5.425   5.527
  112   HG22  VAL  16          HG22      VAL  16  14.670  -5.060   4.871
  113   HG23  VAL  16          HG23      VAL  16  15.334  -4.071   6.171
  114    H    LEU  17           HN       LEU  17  14.604  -2.629   1.421
  115    HA   LEU  17           HA       LEU  17  16.961  -1.325   0.431
  116    HB2  LEU  17           HB2      LEU  17  14.427  -2.182  -0.965
  117    HB3  LEU  17           HB1      LEU  17  15.837  -1.534  -1.781
  118    HG   LEU  17           HG       LEU  17  15.729  -4.117  -0.212
  119   HD11  LEU  17          HD11      LEU  17  16.025  -3.597  -3.166
  120   HD12  LEU  17          HD12      LEU  17  14.589  -4.238  -2.369
  121   HD13  LEU  17          HD13      LEU  17  16.083  -5.176  -2.381
  122   HD21  LEU  17          HD21      LEU  17  17.905  -3.077   0.023
  123   HD22  LEU  17          HD22      LEU  17  18.000  -2.826  -1.720
  124   HD23  LEU  17          HD23      LEU  17  18.014  -4.463  -1.063
  125    H    GLY  18           HN       GLY  18  13.585  -0.375   1.054
  126    HA2  GLY  18           HA2      GLY  18  13.373   1.900   1.906
  127    HA3  GLY  18           HA1      GLY  18  14.599   2.392   0.743
  128    H    ARG  19           HN       ARG  19  13.059   0.373  -1.084
  129    HA   ARG  19           HA       ARG  19  11.390   2.276  -2.358
  130    HB2  ARG  19           HB2      ARG  19  10.798   0.570  -3.878
  131    HB3  ARG  19           HB1      ARG  19  12.481   0.297  -3.487
  132    HG2  ARG  19           HG2      ARG  19  11.191  -1.228  -1.626
  133    HG3  ARG  19           HG1      ARG  19  10.159  -1.339  -3.064
  134    HD2  ARG  19           HD2      ARG  19  12.043  -2.067  -4.405
  135    HD3  ARG  19           HD1      ARG  19  13.138  -1.835  -3.046
  136    HE   ARG  19           HE       ARG  19  11.451  -3.633  -2.030
  137   HH11  ARG  19          HH11      ARG  19  13.097  -3.500  -5.134
  138   HH12  ARG  19          HH12      ARG  19  13.172  -5.230  -5.311
  139   HH21  ARG  19          HH21      ARG  19  11.558  -5.912  -2.272
  140   HH22  ARG  19          HH22      ARG  19  12.309  -6.597  -3.687
  141    H    THR  20           HN       THR  20   9.431   2.910  -1.752
  142    HA   THR  20           HA       THR  20   8.296   1.649   0.568
  143    HB   THR  20           HB       THR  20   6.961   3.835  -1.019
  144    HG1  THR  20           HG1      THR  20   9.394   3.891   0.326
  145   HG21  THR  20          HG21      THR  20   6.225   4.555   1.202
  146   HG22  THR  20          HG22      THR  20   7.144   3.240   1.938
  147   HG23  THR  20          HG23      THR  20   5.762   2.879   0.900
  148    H    TYR  21           HN       TYR  21   7.328  -0.245   0.234
  149    HA   TYR  21           HA       TYR  21   5.378  -0.391  -1.987
  150    HB2  TYR  21           HB2      TYR  21   5.715  -2.727  -2.143
  151    HB3  TYR  21           HB1      TYR  21   7.328  -2.040  -2.004
  152    HD1  TYR  21           HD2      TYR  21   8.567  -2.273   0.162
  153    HD2  TYR  21           HD1      TYR  21   4.847  -4.214  -0.516
  154    HE1  TYR  21           HE2      TYR  21   9.009  -3.780   2.059
  155    HE2  TYR  21           HE1      TYR  21   5.278  -5.721   1.372
  156    HH   TYR  21           HH       TYR  21   7.108  -6.589   2.636
  157    H    TYR  22           HN       TYR  22   3.269  -0.914  -1.534
  158    HA   TYR  22           HA       TYR  22   2.501  -0.930   1.288
  159    HB2  TYR  22           HB2      TYR  22   0.725  -0.798  -1.157
  160    HB3  TYR  22           HB1      TYR  22   0.218  -0.581   0.505
  161    HD1  TYR  22           HD2      TYR  22   2.720   0.911  -1.863
  162    HD2  TYR  22           HD1      TYR  22  -0.127   1.552   1.232
  163    HE1  TYR  22           HE2      TYR  22   3.121   3.330  -2.003
  164    HE2  TYR  22           HE1      TYR  22   0.257   3.974   1.089
  165    HH   TYR  22           HH       TYR  22   2.133   5.491   0.349
  166    H    VAL  23           HN       VAL  23   0.685  -2.410   1.897
  167    HA   VAL  23           HA       VAL  23   0.488  -4.847   0.335
  168    HB   VAL  23           HB       VAL  23   2.377  -5.502   1.592
  169   HG11  VAL  23          HG11      VAL  23   1.024  -4.417   4.055
  170   HG12  VAL  23          HG12      VAL  23   2.388  -3.685   3.213
  171   HG13  VAL  23          HG13      VAL  23   2.580  -5.243   4.019
  172   HG21  VAL  23          HG21      VAL  23   0.614  -7.192   1.593
  173   HG22  VAL  23          HG22      VAL  23  -0.033  -6.521   3.091
  174   HG23  VAL  23          HG23      VAL  23   1.565  -7.269   3.078
  175    H    ASN  24           HN       ASN  24  -1.449  -5.786   0.518
  176    HA   ASN  24           HA       ASN  24  -3.346  -4.689   2.469
  177    HB2  ASN  24           HB2      ASN  24  -3.958  -4.771   0.024
  178    HB3  ASN  24           HB1      ASN  24  -3.901  -6.524   0.121
  179   HD21  ASN  24          HD21      ASN  24  -6.111  -4.611  -0.459
  180   HD22  ASN  24          HD22      ASN  24  -7.367  -5.016   0.656
  181    H    HIS  25           HN       HIS  25  -4.018  -5.850   4.168
  182    HA   HIS  25           HA       HIS  25  -2.619  -8.215   4.872
  183    HB2  HIS  25           HB2      HIS  25  -4.942  -6.762   6.098
  184    HB3  HIS  25           HB1      HIS  25  -4.362  -8.282   6.765
  185    HD1  HIS  25           HD1      HIS  25  -1.993  -8.281   7.836
  186    HD2  HIS  25           HD2      HIS  25  -3.379  -4.542   6.660
  187    HE1  HIS  25           HE1      HIS  25  -0.509  -6.614   8.990
  188    HE2  HIS  25           HE2      HIS  25  -1.207  -4.376   8.056
  189    H    GLU  26           HN       GLU  26  -5.556  -7.726   3.142
  190    HA   GLU  26           HA       GLU  26  -6.900 -10.110   3.928
  191    HB2  GLU  26           HB2      GLU  26  -7.929  -8.019   2.949
  192    HB3  GLU  26           HB1      GLU  26  -7.296  -8.514   1.393
  193    HG2  GLU  26           HG2      GLU  26  -9.146 -10.248   2.989
  194    HG3  GLU  26           HG1      GLU  26  -9.726  -9.013   1.875
  195    H    SER  27           HN       SER  27  -5.313  -9.283   0.822
  196    HA   SER  27           HA       SER  27  -5.137 -12.165   0.271
  197    HB2  SER  27           HB2      SER  27  -6.396 -10.764  -1.359
  198    HB3  SER  27           HB1      SER  27  -4.925  -9.844  -1.668
  199    HG   SER  27           HG       SER  27  -4.959 -12.644  -1.964
  200    H    ARG  28           HN       ARG  28  -3.321  -9.705   1.433
  201    HA   ARG  28           HA       ARG  28  -1.121  -9.300   1.737
  202    HB2  ARG  28           HB2      ARG  28  -0.834 -12.137   0.737
  203    HB3  ARG  28           HB1      ARG  28   0.477 -11.189   1.426
  204    HG2  ARG  28           HG2      ARG  28  -0.671 -11.022   3.531
  205    HG3  ARG  28           HG1      ARG  28  -2.079 -11.843   2.860
  206    HD2  ARG  28           HD2      ARG  28  -0.785 -13.385   4.184
  207    HD3  ARG  28           HD1      ARG  28  -0.710 -13.845   2.483
  208    HE   ARG  28           HE       ARG  28   1.476 -12.215   3.541
  209   HH11  ARG  28          HH11      ARG  28   0.277 -15.362   2.596
  210   HH12  ARG  28          HH12      ARG  28   1.860 -16.062   2.411
  211   HH21  ARG  28          HH21      ARG  28   3.581 -13.135   3.318
  212   HH22  ARG  28          HH22      ARG  28   3.740 -14.787   2.806
  213    H    THR  29           HN       THR  29  -2.475  -8.708  -0.759
  214    HA   THR  29           HA       THR  29  -0.611  -8.880  -2.899
  215    HB   THR  29           HB       THR  29  -2.760  -6.782  -2.616
  216    HG1  THR  29           HG1      THR  29  -3.394  -9.142  -3.946
  217   HG21  THR  29          HG21      THR  29  -2.864  -6.986  -5.062
  218   HG22  THR  29          HG22      THR  29  -1.590  -8.208  -5.009
  219   HG23  THR  29          HG23      THR  29  -1.250  -6.547  -4.517
  220    H    THR  30           HN       THR  30   1.174  -7.687  -3.199
  221    HA   THR  30           HA       THR  30   1.532  -5.294  -1.532
  222    HB   THR  30           HB       THR  30   3.973  -5.547  -2.085
  223    HG1  THR  30           HG1      THR  30   2.939  -7.571  -3.634
  224   HG21  THR  30          HG21      THR  30   3.135  -6.330   0.047
  225   HG22  THR  30          HG22      THR  30   4.336  -7.467  -0.565
  226   HG23  THR  30          HG23      THR  30   2.620  -7.853  -0.682
  227    H    GLN  31           HN       GLN  31   2.206  -3.356  -2.472
  228    HA   GLN  31           HA       GLN  31   2.273  -3.243  -5.403
  229    HB2  GLN  31           HB2      GLN  31  -0.065  -2.793  -4.611
  230    HB3  GLN  31           HB1      GLN  31   0.558  -1.419  -3.713
  231    HG2  GLN  31           HG2      GLN  31   1.237  -0.334  -5.744
  232    HG3  GLN  31           HG1      GLN  31   0.740  -1.734  -6.691
  233   HE21  GLN  31          HE21      GLN  31  -0.648  -0.394  -7.884
  234   HE22  GLN  31          HE22      GLN  31  -2.158   0.148  -7.229
  235    H    TRP  32           HN       TRP  32   3.591  -1.668  -6.206
  236    HA   TRP  32           HA       TRP  32   5.486  -0.503  -4.349
  237    HB2  TRP  32           HB2      TRP  32   6.029  -1.594  -6.566
  238    HB3  TRP  32           HB1      TRP  32   5.281  -0.220  -7.352
  239    HD1  TRP  32           HD1      TRP  32   6.605   2.208  -6.812
  240    HE1  TRP  32           HE1      TRP  32   9.134   2.624  -6.811
  241    HE3  TRP  32           HE3      TRP  32   8.133  -2.526  -5.917
  242    HZ2  TRP  32           HZ2      TRP  32  11.490   1.105  -6.490
  243    HZ3  TRP  32           HZ3      TRP  32  10.535  -2.992  -5.764
  244    HH2  TRP  32           HH2      TRP  32  12.184  -1.210  -6.046
  245    H    LYS  33           HN       LYS  33   2.681   0.408  -6.084
  246    HA   LYS  33           HA       LYS  33   3.173   3.260  -5.554
  247    HB2  LYS  33           HB2      LYS  33   1.173   2.069  -7.481
  248    HB3  LYS  33           HB1      LYS  33   1.628   3.764  -7.335
  249    HG2  LYS  33           HG2      LYS  33   3.387   1.511  -8.259
  250    HG3  LYS  33           HG1      LYS  33   2.670   2.773  -9.273
  251    HD2  LYS  33           HD2      LYS  33   3.957   4.475  -8.080
  252    HD3  LYS  33           HD1      LYS  33   4.642   3.235  -7.026
  253    HE2  LYS  33           HE2      LYS  33   6.246   3.799  -8.724
  254    HE3  LYS  33           HE1      LYS  33   5.654   2.167  -9.019
  255    HZ1  LYS  33           HZ1      LYS  33   4.731   4.613 -10.426
  256    HZ2  LYS  33           HZ2      LYS  33   4.189   3.037 -10.726
  257    HZ3  LYS  33           HZ3      LYS  33   5.800   3.456 -11.057
  258    H    ARG  34           HN       ARG  34   0.732   4.307  -5.553
  259    HA   ARG  34           HA       ARG  34  -0.372   3.272  -3.083
  260    HB2  ARG  34           HB2      ARG  34  -1.029   5.730  -4.707
  261    HB3  ARG  34           HB1      ARG  34  -1.806   5.316  -3.184
  262    HG2  ARG  34           HG2      ARG  34   0.432   5.372  -2.106
  263    HG3  ARG  34           HG1      ARG  34   1.095   5.963  -3.632
  264    HD2  ARG  34           HD2      ARG  34  -0.307   7.923  -3.526
  265    HD3  ARG  34           HD1      ARG  34  -1.103   7.314  -2.074
  266    HE   ARG  34           HE       ARG  34   1.454   7.392  -1.281
  267   HH11  ARG  34          HH11      ARG  34  -0.514   9.742  -2.975
  268   HH12  ARG  34          HH12      ARG  34   0.315  11.117  -2.300
  269   HH21  ARG  34          HH21      ARG  34   2.537   9.195  -0.370
  270   HH22  ARG  34          HH22      ARG  34   2.028  10.813  -0.795
  271    HA   PRO  35           HA       PRO  35  -3.644   1.043  -5.083
  272    HB2  PRO  35           HB2      PRO  35  -5.262   0.808  -2.883
  273    HB3  PRO  35           HB1      PRO  35  -3.851  -0.221  -3.185
  274    HG2  PRO  35           HG2      PRO  35  -4.105   2.170  -1.413
  275    HG3  PRO  35           HG1      PRO  35  -3.244   0.648  -1.121
  276    HD2  PRO  35           HD2      PRO  35  -1.979   2.920  -1.863
  277    HD3  PRO  35           HD1      PRO  35  -1.408   1.313  -2.340
  278    H    SER  36           HN       SER  36  -5.104   1.979  -6.352
  279    HA   SER  36           HA       SER  36  -6.338   4.448  -5.934
  280    HB2  SER  36           HB2      SER  36  -7.425   2.136  -7.567
  281    HB3  SER  36           HB1      SER  36  -7.768   3.852  -7.799
  282    HG   SER  36           HG       SER  36  -5.919   2.505  -8.994
  283    HA   PRO  37           HA       PRO  37  -9.395   3.500  -2.929
  284    HB2  PRO  37           HB2      PRO  37 -11.249   5.441  -4.062
  285    HB3  PRO  37           HB1      PRO  37 -10.296   5.545  -2.579
  286    HG2  PRO  37           HG2      PRO  37  -9.782   7.090  -4.745
  287    HG3  PRO  37           HG1      PRO  37  -8.507   6.541  -3.644
  288    HD2  PRO  37           HD2      PRO  37  -9.322   5.414  -6.301
  289    HD3  PRO  37           HD1      PRO  37  -7.687   5.738  -5.672
  290    H    GLU  38           HN       GLU  38  -9.689   2.284  -5.809
  291    HA   GLU  38           HA       GLU  38 -12.537   1.760  -5.838
  292    HB2  GLU  38           HB2      GLU  38 -12.049   0.445  -7.887
  293    HB3  GLU  38           HB1      GLU  38 -11.492   2.105  -7.990
  294    HG2  GLU  38           HG2      GLU  38  -9.201   1.239  -7.363
  295    HG3  GLU  38           HG1      GLU  38  -9.843  -0.380  -7.617
  296    H    ASP  39           HN       ASP  39 -12.429   0.872  -3.710
  297    HA   ASP  39           HA       ASP  39 -11.990  -2.020  -3.847
  298    HB2  ASP  39           HB2      ASP  39 -10.115  -1.219  -2.566
  299    HB3  ASP  39           HB1      ASP  39 -11.148  -0.205  -1.567
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1   3.223   6.910   7.700
    2    H2   GLY   1           HT2      GLY   1   4.914   7.013   7.578
    3    H3   GLY   1           HT3      GLY   1   4.034   6.099   6.452
    4    HA2  GLY   1           HA1      GLY   1   3.930   9.039   6.781
    5    HA3  GLY   1           HA2      GLY   1   4.698   8.172   5.459
    6    H    SER   2           HN       SER   2   3.426   9.099   3.887
    7    HA   SER   2           HA       SER   2   1.708   9.241   2.427
    8    HB2  SER   2           HB2      SER   2   0.594   6.896   3.983
    9    HB3  SER   2           HB1      SER   2  -0.010   7.462   2.425
   10    HG   SER   2           HG       SER   2   2.489   6.277   3.046
   11    HA   PRO   3           HA       PRO   3  -0.809  11.908   5.101
   12    HB2  PRO   3           HB2      PRO   3  -1.150  13.860   3.279
   13    HB3  PRO   3           HB1      PRO   3   0.360  13.674   4.180
   14    HG2  PRO   3           HG2      PRO   3  -0.304  12.782   1.400
   15    HG3  PRO   3           HG1      PRO   3   1.159  13.588   1.995
   16    HD2  PRO   3           HD2      PRO   3   1.017  10.903   1.571
   17    HD3  PRO   3           HD1      PRO   3   2.052  11.631   2.815
   18    H    SER   4           HN       SER   4  -1.582   9.985   2.524
   19    HA   SER   4           HA       SER   4  -4.365  10.930   2.443
   20    HB2  SER   4           HB2      SER   4  -2.919   9.193   0.420
   21    HB3  SER   4           HB1      SER   4  -4.553   9.842   0.268
   22    HG   SER   4           HG       SER   4  -3.332  11.962   0.617
   23    HA   PRO   5           HA       PRO   5  -5.437   7.234   4.687
   24    HB2  PRO   5           HB2      PRO   5  -8.072   7.527   3.376
   25    HB3  PRO   5           HB1      PRO   5  -7.666   7.491   5.094
   26    HG2  PRO   5           HG2      PRO   5  -8.392   9.761   3.877
   27    HG3  PRO   5           HG1      PRO   5  -7.168   9.748   5.161
   28    HD2  PRO   5           HD2      PRO   5  -6.811   9.935   2.195
   29    HD3  PRO   5           HD1      PRO   5  -5.935  10.778   3.491
   30    H    LEU   6           HN       LEU   6  -4.784   5.300   4.030
   31    HA   LEU   6           HA       LEU   6  -5.026   4.434   1.306
   32    HB2  LEU   6           HB2      LEU   6  -4.040   3.026   3.787
   33    HB3  LEU   6           HB1      LEU   6  -3.953   2.350   2.174
   34    HG   LEU   6           HG       LEU   6  -2.550   4.856   3.096
   35   HD11  LEU   6          HD11      LEU   6  -1.579   2.862   4.073
   36   HD12  LEU   6          HD12      LEU   6  -0.507   3.534   2.843
   37   HD13  LEU   6          HD13      LEU   6  -1.482   2.109   2.481
   38   HD21  LEU   6          HD21      LEU   6  -1.403   4.740   0.928
   39   HD22  LEU   6          HD22      LEU   6  -3.138   4.998   0.752
   40   HD23  LEU   6          HD23      LEU   6  -2.450   3.401   0.459
   41    HA   PRO   7           HA       PRO   7  -8.800   2.103   1.495
   42    HB2  PRO   7           HB2      PRO   7  -7.435  -0.163   0.182
   43    HB3  PRO   7           HB1      PRO   7  -8.790   0.813  -0.384
   44    HG2  PRO   7           HG2      PRO   7  -6.355   1.036  -1.470
   45    HG3  PRO   7           HG1      PRO   7  -7.445   2.422  -1.292
   46    HD2  PRO   7           HD2      PRO   7  -5.068   1.653   0.350
   47    HD3  PRO   7           HD1      PRO   7  -5.601   3.263  -0.177
   48    HA   PRO   8           HA       PRO   8  -8.830  -0.594   4.970
   49    HB2  PRO   8           HB2      PRO   8 -10.631  -2.402   3.444
   50    HB3  PRO   8           HB1      PRO   8 -10.885  -1.612   5.005
   51    HG2  PRO   8           HG2      PRO   8 -12.132  -0.738   2.832
   52    HG3  PRO   8           HG1      PRO   8 -11.498   0.399   4.034
   53    HD2  PRO   8           HD2      PRO   8 -10.373  -0.353   1.366
   54    HD3  PRO   8           HD1      PRO   8 -10.446   1.239   2.155
   55    H    GLY   9           HN       GLY   9  -7.259  -1.936   5.559
   56    HA2  GLY   9           HA2      GLY   9  -6.156  -4.016   5.628
   57    HA3  GLY   9           HA1      GLY   9  -6.797  -4.383   4.033
   58    H    TRP  10           HN       TRP  10  -5.826  -1.482   3.369
   59    HA   TRP  10           HA       TRP  10  -3.261  -2.389   2.380
   60    HB2  TRP  10           HB2      TRP  10  -4.979   0.012   1.889
   61    HB3  TRP  10           HB1      TRP  10  -3.278   0.036   1.420
   62    HD1  TRP  10           HD1      TRP  10  -6.585  -1.706   0.565
   63    HE1  TRP  10           HE1      TRP  10  -6.336  -2.851  -1.730
   64    HE3  TRP  10           HE3      TRP  10  -1.591  -0.958  -0.116
   65    HZ2  TRP  10           HZ2      TRP  10  -4.235  -3.362  -3.589
   66    HZ3  TRP  10           HZ3      TRP  10  -0.526  -1.792  -2.163
   67    HH2  TRP  10           HH2      TRP  10  -1.822  -2.973  -3.868
   68    H    GLU  11           HN       GLU  11  -1.609  -2.347   3.699
   69    HA   GLU  11           HA       GLU  11  -1.324  -0.040   5.492
   70    HB2  GLU  11           HB2      GLU  11   0.132  -1.515   6.854
   71    HB3  GLU  11           HB1      GLU  11  -1.534  -2.063   6.747
   72    HG2  GLU  11           HG2      GLU  11  -0.738  -3.591   4.877
   73    HG3  GLU  11           HG1      GLU  11   0.895  -3.192   5.406
   74    H    GLU  12           HN       GLU  12   0.465   1.158   5.474
   75    HA   GLU  12           HA       GLU  12   2.233   0.962   3.213
   76    HB2  GLU  12           HB2      GLU  12   1.464   3.137   3.997
   77    HB3  GLU  12           HB1      GLU  12   2.185   2.850   5.576
   78    HG2  GLU  12           HG2      GLU  12   4.390   2.601   4.241
   79    HG3  GLU  12           HG1      GLU  12   3.507   3.438   2.962
   80    H    ARG  13           HN       ARG  13   4.274   0.239   3.185
   81    HA   ARG  13           HA       ARG  13   5.644  -0.404   5.679
   82    HB2  ARG  13           HB2      ARG  13   4.853  -2.403   3.559
   83    HB3  ARG  13           HB1      ARG  13   6.175  -2.702   4.689
   84    HG2  ARG  13           HG2      ARG  13   3.347  -2.109   5.556
   85    HG3  ARG  13           HG1      ARG  13   3.965  -3.737   5.284
   86    HD2  ARG  13           HD2      ARG  13   4.064  -3.211   7.641
   87    HD3  ARG  13           HD1      ARG  13   5.695  -3.345   6.988
   88    HE   ARG  13           HE       ARG  13   4.696  -0.648   7.014
   89   HH11  ARG  13          HH11      ARG  13   6.216  -3.132   8.967
   90   HH12  ARG  13          HH12      ARG  13   7.005  -2.000  10.019
   91   HH21  ARG  13          HH21      ARG  13   5.756   0.848   8.387
   92   HH22  ARG  13          HH22      ARG  13   6.744   0.256   9.698
   93    H    GLN  14           HN       GLN  14   7.899  -0.289   5.459
   94    HA   GLN  14           HA       GLN  14   8.702   0.846   2.887
   95    HB2  GLN  14           HB2      GLN  14  10.599   1.813   4.022
   96    HB3  GLN  14           HB1      GLN  14   9.128   2.200   4.901
   97    HG2  GLN  14           HG2      GLN  14   9.654   0.779   6.660
   98    HG3  GLN  14           HG1      GLN  14  10.807  -0.146   5.696
   99   HE21  GLN  14          HE21      GLN  14  12.845   0.719   5.296
  100   HE22  GLN  14          HE22      GLN  14  13.503   1.989   6.265
  101    H    ASP  15           HN       ASP  15  10.265   0.047   1.620
  102    HA   ASP  15           HA       ASP  15  11.258  -2.615   2.170
  103    HB2  ASP  15           HB2      ASP  15  10.555  -1.964  -0.114
  104    HB3  ASP  15           HB1      ASP  15  11.831  -0.763  -0.153
  105    H    VAL  16           HN       VAL  16  13.658  -2.981   1.712
  106    HA   VAL  16           HA       VAL  16  15.106  -1.440   3.622
  107    HB   VAL  16           HB       VAL  16  15.342  -3.903   3.215
  108   HG11  VAL  16          HG11      VAL  16  15.477  -3.946   0.821
  109   HG12  VAL  16          HG12      VAL  16  16.937  -4.645   1.520
  110   HG13  VAL  16          HG13      VAL  16  16.973  -3.012   0.856
  111   HG21  VAL  16          HG21      VAL  16  16.882  -2.664   4.609
  112   HG22  VAL  16          HG22      VAL  16  17.856  -2.252   3.197
  113   HG23  VAL  16          HG23      VAL  16  17.728  -3.931   3.722
  114    H    LEU  17           HN       LEU  17  14.753  -1.344   0.169
  115    HA   LEU  17           HA       LEU  17  17.136   0.240  -0.195
  116    HB2  LEU  17           HB2      LEU  17  14.935  -0.639  -2.022
  117    HB3  LEU  17           HB1      LEU  17  16.077   0.590  -2.531
  118    HG   LEU  17           HG       LEU  17  17.873  -1.176  -1.839
  119   HD11  LEU  17          HD11      LEU  17  17.122  -3.483  -2.225
  120   HD12  LEU  17          HD12      LEU  17  15.454  -2.908  -2.287
  121   HD13  LEU  17          HD13      LEU  17  16.386  -2.755  -0.797
  122   HD21  LEU  17          HD21      LEU  17  17.823  -2.088  -4.119
  123   HD22  LEU  17          HD22      LEU  17  17.520  -0.350  -4.112
  124   HD23  LEU  17          HD23      LEU  17  16.179  -1.478  -4.323
  125    H    GLY  18           HN       GLY  18  13.721   0.901   0.376
  126    HA2  GLY  18           HA2      GLY  18  13.474   3.185   1.397
  127    HA3  GLY  18           HA1      GLY  18  14.376   3.770   0.005
  128    H    ARG  19           HN       ARG  19  12.963   1.657  -1.609
  129    HA   ARG  19           HA       ARG  19  10.660   2.938  -2.525
  130    HB2  ARG  19           HB2      ARG  19  11.442   0.003  -2.477
  131    HB3  ARG  19           HB1      ARG  19  10.025   0.596  -3.318
  132    HG2  ARG  19           HG2      ARG  19  11.291   1.718  -4.906
  133    HG3  ARG  19           HG1      ARG  19  12.757   1.628  -3.928
  134    HD2  ARG  19           HD2      ARG  19  13.203  -0.042  -5.399
  135    HD3  ARG  19           HD1      ARG  19  12.333  -0.961  -4.174
  136    HE   ARG  19           HE       ARG  19  10.745   0.116  -6.354
  137   HH11  ARG  19          HH11      ARG  19  12.359  -2.642  -4.914
  138   HH12  ARG  19          HH12      ARG  19  11.619  -3.792  -5.993
  139   HH21  ARG  19          HH21      ARG  19   9.778  -1.400  -7.783
  140   HH22  ARG  19          HH22      ARG  19  10.152  -3.087  -7.612
  141    H    THR  20           HN       THR  20   8.968   3.489  -1.150
  142    HA   THR  20           HA       THR  20   8.400   1.780   1.122
  143    HB   THR  20           HB       THR  20   6.697   4.088   0.184
  144    HG1  THR  20           HG1      THR  20   8.060   5.398   1.534
  145   HG21  THR  20          HG21      THR  20   7.263   2.937   2.922
  146   HG22  THR  20          HG22      THR  20   5.798   2.683   1.977
  147   HG23  THR  20          HG23      THR  20   6.186   4.296   2.573
  148    H    TYR  21           HN       TYR  21   7.485  -0.127   0.573
  149    HA   TYR  21           HA       TYR  21   5.518  -0.244  -1.577
  150    HB2  TYR  21           HB2      TYR  21   5.526  -2.635  -1.321
  151    HB3  TYR  21           HB1      TYR  21   7.178  -2.050  -1.338
  152    HD1  TYR  21           HD2      TYR  21   8.506  -2.068   0.763
  153    HD2  TYR  21           HD1      TYR  21   4.633  -3.803   0.545
  154    HE1  TYR  21           HE2      TYR  21   8.940  -3.273   2.857
  155    HE2  TYR  21           HE1      TYR  21   5.054  -5.012   2.644
  156    HH   TYR  21           HH       TYR  21   7.707  -4.294   4.669
  157    H    TYR  22           HN       TYR  22   3.532  -1.703  -1.121
  158    HA   TYR  22           HA       TYR  22   2.468  -1.287   1.585
  159    HB2  TYR  22           HB2      TYR  22   0.492  -1.146  -0.591
  160    HB3  TYR  22           HB1      TYR  22   0.543  -0.268   0.915
  161    HD1  TYR  22           HD1      TYR  22   1.946   1.809   1.097
  162    HD2  TYR  22           HD2      TYR  22   1.315  -0.198  -2.598
  163    HE1  TYR  22           HE1      TYR  22   2.681   3.817  -0.120
  164    HE2  TYR  22           HE2      TYR  22   2.049   1.797  -3.821
  165    HH   TYR  22           HH       TYR  22   3.668   4.340  -2.379
  166    H    VAL  23           HN       VAL  23   0.978  -2.878   2.222
  167    HA   VAL  23           HA       VAL  23   0.627  -5.098   0.346
  168    HB   VAL  23           HB       VAL  23   2.337  -5.926   1.748
  169   HG11  VAL  23          HG11      VAL  23   2.257  -5.865   4.194
  170   HG12  VAL  23          HG12      VAL  23   0.748  -4.954   4.117
  171   HG13  VAL  23          HG13      VAL  23   2.239  -4.243   3.500
  172   HG21  VAL  23          HG21      VAL  23   0.531  -7.533   1.427
  173   HG22  VAL  23          HG22      VAL  23  -0.279  -6.922   2.870
  174   HG23  VAL  23          HG23      VAL  23   1.274  -7.741   3.013
  175    H    ASN  24           HN       ASN  24  -1.384  -5.694   0.095
  176    HA   ASN  24           HA       ASN  24  -3.500  -4.671   1.752
  177    HB2  ASN  24           HB2      ASN  24  -3.847  -4.965  -0.667
  178    HB3  ASN  24           HB1      ASN  24  -3.553  -6.690  -0.507
  179   HD21  ASN  24          HD21      ASN  24  -5.798  -4.109   0.023
  180   HD22  ASN  24          HD22      ASN  24  -7.162  -5.102   0.401
  181    H    HIS  25           HN       HIS  25  -3.879  -5.527   3.672
  182    HA   HIS  25           HA       HIS  25  -2.709  -7.947   4.541
  183    HB2  HIS  25           HB2      HIS  25  -3.303  -5.859   5.903
  184    HB3  HIS  25           HB1      HIS  25  -4.939  -6.491   5.950
  185    HD1  HIS  25           HD1      HIS  25  -5.453  -8.243   7.676
  186    HD2  HIS  25           HD2      HIS  25  -1.404  -7.445   7.278
  187    HE1  HIS  25           HE1      HIS  25  -4.339  -9.473   9.563
  188    HE2  HIS  25           HE2      HIS  25  -1.872  -9.019   9.281
  189    H    GLU  26           HN       GLU  26  -5.591  -7.460   2.829
  190    HA   GLU  26           HA       GLU  26  -6.961  -9.748   3.973
  191    HB2  GLU  26           HB2      GLU  26  -8.272  -7.801   3.232
  192    HB3  GLU  26           HB1      GLU  26  -7.669  -8.009   1.595
  193    HG2  GLU  26           HG2      GLU  26  -9.918  -8.858   1.790
  194    HG3  GLU  26           HG1      GLU  26  -8.786 -10.167   1.449
  195    H    SER  27           HN       SER  27  -5.797  -8.871   0.710
  196    HA   SER  27           HA       SER  27  -5.791 -11.709   0.016
  197    HB2  SER  27           HB2      SER  27  -6.868 -10.129  -1.534
  198    HB3  SER  27           HB1      SER  27  -5.356  -9.244  -1.694
  199    HG   SER  27           HG       SER  27  -4.472 -11.316  -2.454
  200    H    ARG  28           HN       ARG  28  -3.781  -9.934   1.635
  201    HA   ARG  28           HA       ARG  28  -1.561  -9.578   1.881
  202    HB2  ARG  28           HB2      ARG  28  -0.220 -11.740   1.803
  203    HB3  ARG  28           HB1      ARG  28  -1.617 -11.685   2.865
  204    HG2  ARG  28           HG2      ARG  28  -1.927 -13.725   1.955
  205    HG3  ARG  28           HG1      ARG  28  -2.818 -12.753   0.785
  206    HD2  ARG  28           HD2      ARG  28  -1.436 -14.319  -0.406
  207    HD3  ARG  28           HD1      ARG  28  -0.752 -12.709  -0.631
  208    HE   ARG  28           HE       ARG  28   0.644 -13.579   1.463
  209   HH11  ARG  28          HH11      ARG  28  -0.130 -15.181  -1.553
  210   HH12  ARG  28          HH12      ARG  28   1.326 -16.130  -1.572
  211   HH21  ARG  28          HH21      ARG  28   2.531 -14.820   1.465
  212   HH22  ARG  28          HH22      ARG  28   2.830 -15.945   0.169
  213    H    THR  29           HN       THR  29  -2.312  -8.642  -0.549
  214    HA   THR  29           HA       THR  29  -0.285  -9.474  -2.474
  215    HB   THR  29           HB       THR  29  -2.463  -7.410  -2.851
  216    HG1  THR  29           HG1      THR  29  -3.059  -9.628  -4.150
  217   HG21  THR  29          HG21      THR  29  -0.822  -9.000  -4.822
  218   HG22  THR  29          HG22      THR  29  -0.620  -7.287  -4.458
  219   HG23  THR  29          HG23      THR  29  -2.099  -7.856  -5.235
  220    H    THR  30           HN       THR  30   1.575  -8.396  -2.680
  221    HA   THR  30           HA       THR  30   1.836  -5.729  -1.496
  222    HB   THR  30           HB       THR  30   3.969  -7.593  -2.573
  223    HG1  THR  30           HG1      THR  30   2.636  -7.971  -0.471
  224   HG21  THR  30          HG21      THR  30   5.549  -6.109  -1.420
  225   HG22  THR  30          HG22      THR  30   4.218  -5.045  -0.967
  226   HG23  THR  30          HG23      THR  30   4.649  -5.241  -2.665
  227    H    GLN  31           HN       GLN  31   1.925  -3.944  -2.740
  228    HA   GLN  31           HA       GLN  31   2.411  -4.253  -5.622
  229    HB2  GLN  31           HB2      GLN  31   0.143  -4.271  -5.791
  230    HB3  GLN  31           HB1      GLN  31  -0.093  -3.418  -4.277
  231    HG2  GLN  31           HG2      GLN  31   0.425  -1.310  -5.335
  232    HG3  GLN  31           HG1      GLN  31   0.810  -2.131  -6.846
  233   HE21  GLN  31          HE21      GLN  31  -1.247  -0.084  -6.081
  234   HE22  GLN  31          HE22      GLN  31  -2.758  -0.751  -6.617
  235    H    TRP  32           HN       TRP  32   3.379  -2.496  -6.629
  236    HA   TRP  32           HA       TRP  32   3.938  -0.234  -4.852
  237    HB2  TRP  32           HB2      TRP  32   5.758  -1.784  -6.439
  238    HB3  TRP  32           HB1      TRP  32   5.805  -0.083  -6.919
  239    HD1  TRP  32           HD1      TRP  32   5.420   1.425  -4.334
  240    HE1  TRP  32           HE1      TRP  32   7.101   1.316  -2.405
  241    HE3  TRP  32           HE3      TRP  32   7.750  -2.954  -5.518
  242    HZ2  TRP  32           HZ2      TRP  32   9.129  -0.399  -1.504
  243    HZ3  TRP  32           HZ3      TRP  32   9.594  -3.718  -4.073
  244    HH2  TRP  32           HH2      TRP  32  10.246  -2.485  -2.105
  245    H    LYS  33           HN       LYS  33   1.689   0.036  -5.893
  246    HA   LYS  33           HA       LYS  33   2.083   2.457  -7.444
  247    HB2  LYS  33           HB2      LYS  33   0.017   0.351  -8.129
  248    HB3  LYS  33           HB1      LYS  33  -0.070   2.015  -8.680
  249    HG2  LYS  33           HG2      LYS  33   2.169   1.654  -9.759
  250    HG3  LYS  33           HG1      LYS  33   1.962  -0.064  -9.414
  251    HD2  LYS  33           HD2      LYS  33   0.072   1.649 -11.031
  252    HD3  LYS  33           HD1      LYS  33   1.243   0.513 -11.699
  253    HE2  LYS  33           HE2      LYS  33  -0.917  -0.309  -9.776
  254    HE3  LYS  33           HE1      LYS  33  -1.143  -0.305 -11.523
  255    HZ1  LYS  33           HZ1      LYS  33   1.102  -1.754 -10.273
  256    HZ2  LYS  33           HZ2      LYS  33   0.427  -1.971 -11.808
  257    HZ3  LYS  33           HZ3      LYS  33  -0.426  -2.466 -10.426
  258    H    ARG  34           HN       ARG  34   1.036   4.097  -6.450
  259    HA   ARG  34           HA       ARG  34  -0.087   3.815  -3.935
  260    HB2  ARG  34           HB2      ARG  34   0.761   5.937  -4.998
  261    HB3  ARG  34           HB1      ARG  34  -0.760   6.031  -5.873
  262    HG2  ARG  34           HG2      ARG  34  -1.012   7.456  -4.031
  263    HG3  ARG  34           HG1      ARG  34  -1.891   5.987  -3.596
  264    HD2  ARG  34           HD2      ARG  34  -0.566   6.756  -1.717
  265    HD3  ARG  34           HD1      ARG  34   0.061   5.222  -2.319
  266    HE   ARG  34           HE       ARG  34   1.491   7.225  -3.603
  267   HH11  ARG  34          HH11      ARG  34   0.998   6.165  -0.297
  268   HH12  ARG  34          HH12      ARG  34   2.584   6.625   0.225
  269   HH21  ARG  34          HH21      ARG  34   3.583   7.809  -2.942
  270   HH22  ARG  34          HH22      ARG  34   4.083   7.520  -1.294
  271    HA   PRO  35           HA       PRO  35  -3.871   1.828  -5.288
  272    HB2  PRO  35           HB2      PRO  35  -4.887   1.402  -2.803
  273    HB3  PRO  35           HB1      PRO  35  -3.658   0.370  -3.544
  274    HG2  PRO  35           HG2      PRO  35  -3.328   2.553  -1.530
  275    HG3  PRO  35           HG1      PRO  35  -2.516   0.978  -1.623
  276    HD2  PRO  35           HD2      PRO  35  -1.337   3.287  -2.423
  277    HD3  PRO  35           HD1      PRO  35  -0.990   1.719  -3.179
  278    H    SER  36           HN       SER  36  -5.570   2.900  -6.015
  279    HA   SER  36           HA       SER  36  -6.594   5.293  -4.942
  280    HB2  SER  36           HB2      SER  36  -8.041   3.238  -6.634
  281    HB3  SER  36           HB1      SER  36  -8.420   4.958  -6.499
  282    HG   SER  36           HG       SER  36  -7.234   4.617  -8.369
  283    HA   PRO  37           HA       PRO  37  -8.906   3.821  -1.540
  284    HB2  PRO  37           HB2      PRO  37 -11.087   5.677  -1.866
  285    HB3  PRO  37           HB1      PRO  37  -9.688   5.813  -0.798
  286    HG2  PRO  37           HG2      PRO  37 -10.128   7.445  -2.952
  287    HG3  PRO  37           HG1      PRO  37  -8.522   7.095  -2.287
  288    HD2  PRO  37           HD2      PRO  37  -9.900   5.872  -4.657
  289    HD3  PRO  37           HD1      PRO  37  -8.209   6.401  -4.484
  290    H    GLU  38           HN       GLU  38  -9.670   2.693  -4.227
  291    HA   GLU  38           HA       GLU  38 -12.477   2.028  -3.707
  292    HB2  GLU  38           HB2      GLU  38 -12.534   1.388  -6.139
  293    HB3  GLU  38           HB1      GLU  38 -12.301   3.100  -5.823
  294    HG2  GLU  38           HG2      GLU  38  -9.806   2.662  -6.143
  295    HG3  GLU  38           HG1      GLU  38 -10.291   1.091  -6.784
  296    H    ASP  39           HN       ASP  39 -11.670   0.550  -2.131
  297    HA   ASP  39           HA       ASP  39 -11.376  -2.096  -3.289
  298    HB2  ASP  39           HB2      ASP  39  -9.032  -1.027  -2.767
  299    HB3  ASP  39           HB1      ASP  39  -9.450  -1.396  -1.098
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  -4.732  17.082   3.984
    2    H2   GLY   1           HT2      GLY   1  -4.901  17.335   5.654
    3    H3   GLY   1           HT3      GLY   1  -5.130  15.792   5.006
    4    HA2  GLY   1           HA1      GLY   1  -2.572  17.285   5.050
    5    HA3  GLY   1           HA2      GLY   1  -2.998  15.938   6.095
    6    H    SER   2           HN       SER   2  -0.900  15.210   5.068
    7    HA   SER   2           HA       SER   2  -0.863  14.412   2.360
    8    HB2  SER   2           HB2      SER   2   0.785  13.269   4.618
    9    HB3  SER   2           HB1      SER   2   1.188  13.279   2.899
   10    HG   SER   2           HG       SER   2   0.901  15.718   3.232
   11    HA   PRO   3           HA       PRO   3  -1.764   9.902   4.221
   12    HB2  PRO   3           HB2      PRO   3  -3.659  10.111   6.257
   13    HB3  PRO   3           HB1      PRO   3  -1.950   9.720   6.472
   14    HG2  PRO   3           HG2      PRO   3  -3.360  12.333   6.780
   15    HG3  PRO   3           HG1      PRO   3  -2.029  11.654   7.735
   16    HD2  PRO   3           HD2      PRO   3  -1.588  13.569   5.930
   17    HD3  PRO   3           HD1      PRO   3  -0.431  12.237   6.151
   18    H    SER   4           HN       SER   4  -2.858   9.657   2.333
   19    HA   SER   4           HA       SER   4  -5.531  10.730   2.018
   20    HB2  SER   4           HB2      SER   4  -3.990   8.880   0.183
   21    HB3  SER   4           HB1      SER   4  -5.394   9.858  -0.238
   22    HG   SER   4           HG       SER   4  -3.370  11.345   0.836
   23    HA   PRO   5           HA       PRO   5  -7.869   7.211   3.375
   24    HB2  PRO   5           HB2      PRO   5  -9.298   7.266   0.769
   25    HB3  PRO   5           HB1      PRO   5  -9.945   7.346   2.411
   26    HG2  PRO   5           HG2      PRO   5  -9.846   9.529   0.874
   27    HG3  PRO   5           HG1      PRO   5  -9.510   9.615   2.615
   28    HD2  PRO   5           HD2      PRO   5  -7.607   9.652   0.309
   29    HD3  PRO   5           HD1      PRO   5  -7.554  10.567   1.829
   30    H    LEU   6           HN       LEU   6  -6.609   5.435   3.426
   31    HA   LEU   6           HA       LEU   6  -5.976   4.034   0.949
   32    HB2  LEU   6           HB2      LEU   6  -5.128   3.476   3.798
   33    HB3  LEU   6           HB1      LEU   6  -4.577   2.590   2.391
   34    HG   LEU   6           HG       LEU   6  -4.034   5.510   2.952
   35   HD11  LEU   6          HD11      LEU   6  -1.725   4.781   3.285
   36   HD12  LEU   6          HD12      LEU   6  -2.212   3.102   3.049
   37   HD13  LEU   6          HD13      LEU   6  -2.809   4.012   4.436
   38   HD21  LEU   6          HD21      LEU   6  -4.208   5.044   0.549
   39   HD22  LEU   6          HD22      LEU   6  -3.032   3.739   0.718
   40   HD23  LEU   6          HD23      LEU   6  -2.547   5.407   1.020
   41    HA   PRO   7           HA       PRO   7  -9.495   1.376   1.320
   42    HB2  PRO   7           HB2      PRO   7  -7.709  -0.573  -0.055
   43    HB3  PRO   7           HB1      PRO   7  -9.325  -0.013  -0.503
   44    HG2  PRO   7           HG2      PRO   7  -7.204   0.870  -1.831
   45    HG3  PRO   7           HG1      PRO   7  -8.544   1.953  -1.414
   46    HD2  PRO   7           HD2      PRO   7  -5.867   1.672  -0.112
   47    HD3  PRO   7           HD1      PRO   7  -6.783   3.144  -0.484
   48    HA   PRO   8           HA       PRO   8  -8.999  -0.801   5.033
   49    HB2  PRO   8           HB2      PRO   8 -10.514  -3.089   4.458
   50    HB3  PRO   8           HB1      PRO   8 -11.115  -1.571   5.130
   51    HG2  PRO   8           HG2      PRO   8 -11.149  -2.545   2.316
   52    HG3  PRO   8           HG1      PRO   8 -12.353  -1.583   3.191
   53    HD2  PRO   8           HD2      PRO   8 -10.718  -0.455   1.402
   54    HD3  PRO   8           HD1      PRO   8 -11.169   0.394   2.896
   55    H    GLY   9           HN       GLY   9  -7.019  -1.545   5.416
   56    HA2  GLY   9           HA2      GLY   9  -5.812  -3.535   5.969
   57    HA3  GLY   9           HA1      GLY   9  -6.476  -4.294   4.533
   58    H    TRP  10           HN       TRP  10  -5.676  -1.323   3.478
   59    HA   TRP  10           HA       TRP  10  -3.115  -2.244   2.467
   60    HB2  TRP  10           HB2      TRP  10  -4.920   0.068   1.845
   61    HB3  TRP  10           HB1      TRP  10  -3.231   0.119   1.336
   62    HD1  TRP  10           HD1      TRP  10  -6.509  -1.723   0.642
   63    HE1  TRP  10           HE1      TRP  10  -6.264  -3.014  -1.576
   64    HE3  TRP  10           HE3      TRP  10  -1.539  -0.967  -0.153
   65    HZ2  TRP  10           HZ2      TRP  10  -4.202  -3.611  -3.425
   66    HZ3  TRP  10           HZ3      TRP  10  -0.502  -1.917  -2.162
   67    HH2  TRP  10           HH2      TRP  10  -1.806  -3.215  -3.768
   68    H    GLU  11           HN       GLU  11  -1.364  -2.001   3.703
   69    HA   GLU  11           HA       GLU  11  -1.110   0.488   5.260
   70    HB2  GLU  11           HB2      GLU  11   0.663  -0.844   6.530
   71    HB3  GLU  11           HB1      GLU  11  -1.014  -1.310   6.778
   72    HG2  GLU  11           HG2      GLU  11  -0.767  -3.185   5.316
   73    HG3  GLU  11           HG1      GLU  11   0.857  -2.669   4.858
   74    H    GLU  12           HN       GLU  12   0.712   1.741   5.063
   75    HA   GLU  12           HA       GLU  12   2.281   1.309   2.657
   76    HB2  GLU  12           HB2      GLU  12   1.313   3.534   3.045
   77    HB3  GLU  12           HB1      GLU  12   2.213   3.674   4.549
   78    HG2  GLU  12           HG2      GLU  12   4.303   3.668   3.350
   79    HG3  GLU  12           HG1      GLU  12   3.458   3.366   1.831
   80    H    ARG  13           HN       ARG  13   4.058   0.191   2.784
   81    HA   ARG  13           HA       ARG  13   5.636   0.245   5.272
   82    HB2  ARG  13           HB2      ARG  13   5.108  -1.980   3.295
   83    HB3  ARG  13           HB1      ARG  13   6.381  -2.069   4.518
   84    HG2  ARG  13           HG2      ARG  13   3.426  -1.785   5.036
   85    HG3  ARG  13           HG1      ARG  13   4.382  -3.256   5.220
   86    HD2  ARG  13           HD2      ARG  13   5.716  -2.182   6.958
   87    HD3  ARG  13           HD1      ARG  13   4.791  -0.693   6.756
   88    HE   ARG  13           HE       ARG  13   3.041  -2.851   7.296
   89   HH11  ARG  13          HH11      ARG  13   5.418  -0.811   8.880
   90   HH12  ARG  13          HH12      ARG  13   4.674  -0.955  10.443
   91   HH21  ARG  13          HH21      ARG  13   2.049  -3.016   9.337
   92   HH22  ARG  13          HH22      ARG  13   2.749  -2.203  10.713
   93    H    GLN  14           HN       GLN  14   7.977  -0.405   4.853
   94    HA   GLN  14           HA       GLN  14   8.868   0.812   2.324
   95    HB2  GLN  14           HB2      GLN  14   9.277   2.106   4.545
   96    HB3  GLN  14           HB1      GLN  14  10.518   0.899   4.828
   97    HG2  GLN  14           HG2      GLN  14  10.919   1.809   2.218
   98    HG3  GLN  14           HG1      GLN  14  10.562   3.237   3.182
   99   HE21  GLN  14          HE21      GLN  14  12.198   0.296   4.273
  100   HE22  GLN  14          HE22      GLN  14  13.710   1.060   4.613
  101    H    ASP  15           HN       ASP  15   9.877  -0.621   1.074
  102    HA   ASP  15           HA       ASP  15  10.899  -3.093   2.110
  103    HB2  ASP  15           HB2      ASP  15   9.999  -2.679  -0.258
  104    HB3  ASP  15           HB1      ASP  15  11.557  -1.917  -0.552
  105    H    VAL  16           HN       VAL  16  13.221  -3.715   1.688
  106    HA   VAL  16           HA       VAL  16  14.953  -1.825   2.892
  107    HB   VAL  16           HB       VAL  16  16.734  -3.395   2.423
  108   HG11  VAL  16          HG11      VAL  16  15.866  -5.304   3.703
  109   HG12  VAL  16          HG12      VAL  16  14.223  -4.724   3.420
  110   HG13  VAL  16          HG13      VAL  16  15.346  -3.761   4.381
  111   HG21  VAL  16          HG21      VAL  16  14.668  -4.963   0.882
  112   HG22  VAL  16          HG22      VAL  16  16.286  -5.533   1.290
  113   HG23  VAL  16          HG23      VAL  16  16.084  -4.157   0.208
  114    H    LEU  17           HN       LEU  17  13.972  -2.400  -0.343
  115    HA   LEU  17           HA       LEU  17  16.153  -1.135  -1.659
  116    HB2  LEU  17           HB2      LEU  17  13.283  -1.457  -2.534
  117    HB3  LEU  17           HB1      LEU  17  14.587  -0.901  -3.564
  118    HG   LEU  17           HG       LEU  17  14.366  -3.639  -2.314
  119   HD11  LEU  17          HD11      LEU  17  12.766  -3.290  -4.108
  120   HD12  LEU  17          HD12      LEU  17  14.047  -4.389  -4.624
  121   HD13  LEU  17          HD13      LEU  17  14.055  -2.709  -5.160
  122   HD21  LEU  17          HD21      LEU  17  16.695  -2.943  -2.514
  123   HD22  LEU  17          HD22      LEU  17  16.428  -2.508  -4.204
  124   HD23  LEU  17          HD23      LEU  17  16.312  -4.194  -3.696
  125    H    GLY  18           HN       GLY  18  13.441   0.043   0.144
  126    HA2  GLY  18           HA2      GLY  18  13.522   2.241   1.060
  127    HA3  GLY  18           HA1      GLY  18  14.427   2.772  -0.361
  128    H    ARG  19           HN       ARG  19  12.411   1.093  -1.968
  129    HA   ARG  19           HA       ARG  19  10.477   3.124  -2.463
  130    HB2  ARG  19           HB2      ARG  19  10.755   0.257  -3.317
  131    HB3  ARG  19           HB1      ARG  19   9.279   1.144  -3.654
  132    HG2  ARG  19           HG2      ARG  19  10.635   1.233  -5.589
  133    HG3  ARG  19           HG1      ARG  19  10.652   2.835  -4.858
  134    HD2  ARG  19           HD2      ARG  19  12.827   2.500  -3.973
  135    HD3  ARG  19           HD1      ARG  19  12.798   0.785  -4.376
  136    HE   ARG  19           HE       ARG  19  12.509   1.952  -6.783
  137   HH11  ARG  19          HH11      ARG  19  14.794   2.506  -4.181
  138   HH12  ARG  19          HH12      ARG  19  16.098   2.924  -5.244
  139   HH21  ARG  19          HH21      ARG  19  14.211   2.511  -8.185
  140   HH22  ARG  19          HH22      ARG  19  15.775   2.913  -7.525
  141    H    THR  20           HN       THR  20   8.567   3.466  -1.433
  142    HA   THR  20           HA       THR  20   7.826   1.878   0.794
  143    HB   THR  20           HB       THR  20   5.596   3.223   0.393
  144    HG1  THR  20           HG1      THR  20   6.442   3.873  -1.767
  145   HG21  THR  20          HG21      THR  20   8.150   4.635   1.160
  146   HG22  THR  20          HG22      THR  20   7.220   3.581   2.224
  147   HG23  THR  20          HG23      THR  20   6.514   5.087   1.640
  148    H    TYR  21           HN       TYR  21   7.269  -0.197   0.415
  149    HA   TYR  21           HA       TYR  21   5.351  -0.695  -1.743
  150    HB2  TYR  21           HB2      TYR  21   6.017  -2.922  -1.792
  151    HB3  TYR  21           HB1      TYR  21   7.518  -2.100  -1.397
  152    HD1  TYR  21           HD2      TYR  21   8.271  -2.073   1.013
  153    HD2  TYR  21           HD1      TYR  21   5.148  -4.606  -0.375
  154    HE1  TYR  21           HE2      TYR  21   8.551  -3.492   2.998
  155    HE2  TYR  21           HE1      TYR  21   5.407  -6.025   1.616
  156    HH   TYR  21           HH       TYR  21   7.173  -5.080   4.341
  157    H    TYR  22           HN       TYR  22   3.294  -1.116  -1.328
  158    HA   TYR  22           HA       TYR  22   2.464  -1.084   1.471
  159    HB2  TYR  22           HB2      TYR  22   0.752  -1.071  -1.008
  160    HB3  TYR  22           HB1      TYR  22   0.217  -0.735   0.626
  161    HD1  TYR  22           HD2      TYR  22   2.560   0.538  -1.974
  162    HD2  TYR  22           HD1      TYR  22   0.086   1.475   1.350
  163    HE1  TYR  22           HE2      TYR  22   2.993   2.929  -2.338
  164    HE2  TYR  22           HE1      TYR  22   0.511   3.871   1.005
  165    HH   TYR  22           HH       TYR  22   1.923   5.076  -1.852
  166    H    VAL  23           HN       VAL  23   0.757  -2.606   2.132
  167    HA   VAL  23           HA       VAL  23   0.524  -4.989   0.492
  168    HB   VAL  23           HB       VAL  23   2.331  -5.729   1.804
  169   HG11  VAL  23          HG11      VAL  23   2.467  -5.543   4.224
  170   HG12  VAL  23          HG12      VAL  23   0.928  -4.687   4.251
  171   HG13  VAL  23          HG13      VAL  23   2.333  -3.951   3.477
  172   HG21  VAL  23          HG21      VAL  23  -0.144  -6.697   3.217
  173   HG22  VAL  23          HG22      VAL  23   1.424  -7.500   3.197
  174   HG23  VAL  23          HG23      VAL  23   0.494  -7.342   1.707
  175    H    ASN  24           HN       ASN  24  -1.471  -5.663   0.417
  176    HA   ASN  24           HA       ASN  24  -3.440  -4.697   2.321
  177    HB2  ASN  24           HB2      ASN  24  -4.021  -4.773  -0.080
  178    HB3  ASN  24           HB1      ASN  24  -3.775  -6.516  -0.078
  179   HD21  ASN  24          HD21      ASN  24  -5.844  -3.911   0.922
  180   HD22  ASN  24          HD22      ASN  24  -7.208  -4.884   1.353
  181    H    HIS  25           HN       HIS  25  -4.567  -6.059   3.775
  182    HA   HIS  25           HA       HIS  25  -2.943  -8.272   4.655
  183    HB2  HIS  25           HB2      HIS  25  -5.415  -6.953   5.764
  184    HB3  HIS  25           HB1      HIS  25  -4.774  -8.430   6.467
  185    HD1  HIS  25           HD1      HIS  25  -4.048  -7.475   8.666
  186    HD2  HIS  25           HD2      HIS  25  -2.455  -5.422   5.418
  187    HE1  HIS  25           HE1      HIS  25  -2.338  -5.897   9.628
  188    HE2  HIS  25           HE2      HIS  25  -1.295  -4.751   7.639
  189    H    GLU  26           HN       GLU  26  -6.327  -7.980   3.532
  190    HA   GLU  26           HA       GLU  26  -6.848 -10.753   3.847
  191    HB2  GLU  26           HB2      GLU  26  -8.592  -8.937   3.660
  192    HB3  GLU  26           HB1      GLU  26  -8.225  -8.874   1.936
  193    HG2  GLU  26           HG2      GLU  26  -8.910 -11.166   1.662
  194    HG3  GLU  26           HG1      GLU  26  -9.162 -11.329   3.398
  195    H    SER  27           HN       SER  27  -6.296  -8.795   0.933
  196    HA   SER  27           HA       SER  27  -6.149 -11.101  -0.756
  197    HB2  SER  27           HB2      SER  27  -5.396  -8.229  -1.324
  198    HB3  SER  27           HB1      SER  27  -5.727  -9.480  -2.522
  199    HG   SER  27           HG       SER  27  -7.861  -9.534  -1.158
  200    H    ARG  28           HN       ARG  28  -3.968  -9.534   1.290
  201    HA   ARG  28           HA       ARG  28  -1.735  -9.730   1.715
  202    HB2  ARG  28           HB2      ARG  28  -1.777 -12.140  -0.078
  203    HB3  ARG  28           HB1      ARG  28  -0.678 -11.822   1.245
  204    HG2  ARG  28           HG2      ARG  28  -3.615 -12.172   1.692
  205    HG3  ARG  28           HG1      ARG  28  -2.527 -13.552   1.558
  206    HD2  ARG  28           HD2      ARG  28  -1.210 -12.707   3.430
  207    HD3  ARG  28           HD1      ARG  28  -2.280 -11.306   3.554
  208    HE   ARG  28           HE       ARG  28  -4.061 -13.202   3.836
  209   HH11  ARG  28          HH11      ARG  28  -0.846 -13.087   5.214
  210   HH12  ARG  28          HH12      ARG  28  -1.265 -14.082   6.573
  211   HH21  ARG  28          HH21      ARG  28  -4.613 -14.468   5.611
  212   HH22  ARG  28          HH22      ARG  28  -3.420 -14.858   6.814
  213    H    THR  29           HN       THR  29  -2.664  -8.257  -0.688
  214    HA   THR  29           HA       THR  29  -0.705  -8.861  -2.741
  215    HB   THR  29           HB       THR  29  -2.826  -6.705  -2.717
  216    HG1  THR  29           HG1      THR  29  -2.939  -9.437  -3.093
  217   HG21  THR  29          HG21      THR  29  -1.279  -7.959  -4.992
  218   HG22  THR  29          HG22      THR  29  -1.032  -6.332  -4.357
  219   HG23  THR  29          HG23      THR  29  -2.550  -6.746  -5.155
  220    H    THR  30           HN       THR  30   1.242  -8.019  -2.681
  221    HA   THR  30           HA       THR  30   1.736  -5.486  -1.331
  222    HB   THR  30           HB       THR  30   4.153  -6.056  -1.874
  223    HG1  THR  30           HG1      THR  30   4.076  -7.558  -3.451
  224   HG21  THR  30          HG21      THR  30   3.289  -6.441   0.342
  225   HG22  THR  30          HG22      THR  30   4.292  -7.816  -0.121
  226   HG23  THR  30          HG23      THR  30   2.536  -7.951  -0.173
  227    H    GLN  31           HN       GLN  31   2.518  -3.668  -2.391
  228    HA   GLN  31           HA       GLN  31   3.051  -3.767  -5.236
  229    HB2  GLN  31           HB2      GLN  31   0.587  -3.660  -5.146
  230    HB3  GLN  31           HB1      GLN  31   0.690  -2.206  -4.164
  231    HG2  GLN  31           HG2      GLN  31   1.701  -0.997  -5.991
  232    HG3  GLN  31           HG1      GLN  31   1.726  -2.457  -6.978
  233   HE21  GLN  31          HE21      GLN  31  -0.284   0.018  -5.568
  234   HE22  GLN  31          HE22      GLN  31  -1.681  -0.290  -6.544
  235    H    TRP  32           HN       TRP  32   4.451  -2.199  -5.817
  236    HA   TRP  32           HA       TRP  32   5.582  -0.490  -3.841
  237    HB2  TRP  32           HB2      TRP  32   5.938  -0.323  -6.843
  238    HB3  TRP  32           HB1      TRP  32   7.004   0.354  -5.619
  239    HD1  TRP  32           HD1      TRP  32   6.506  -2.675  -7.690
  240    HE1  TRP  32           HE1      TRP  32   8.162  -4.524  -7.000
  241    HE3  TRP  32           HE3      TRP  32   8.202  -0.641  -3.325
  242    HZ2  TRP  32           HZ2      TRP  32   9.953  -5.035  -4.890
  243    HZ3  TRP  32           HZ3      TRP  32   9.898  -1.869  -2.035
  244    HH2  TRP  32           HH2      TRP  32  10.756  -4.021  -2.803
  245    H    LYS  33           HN       LYS  33   3.206  -0.124  -6.339
  246    HA   LYS  33           HA       LYS  33   3.073   2.751  -6.125
  247    HB2  LYS  33           HB2      LYS  33   2.672   1.645  -8.274
  248    HB3  LYS  33           HB1      LYS  33   1.326   0.756  -7.582
  249    HG2  LYS  33           HG2      LYS  33   0.212   2.965  -7.166
  250    HG3  LYS  33           HG1      LYS  33   1.514   3.709  -8.092
  251    HD2  LYS  33           HD2      LYS  33   0.932   2.312 -10.022
  252    HD3  LYS  33           HD1      LYS  33  -0.387   1.593  -9.100
  253    HE2  LYS  33           HE2      LYS  33  -1.389   3.843  -8.859
  254    HE3  LYS  33           HE1      LYS  33  -0.104   4.493  -9.877
  255    HZ1  LYS  33           HZ1      LYS  33  -0.874   2.878 -11.614
  256    HZ2  LYS  33           HZ2      LYS  33  -1.953   4.135 -11.265
  257    HZ3  LYS  33           HZ3      LYS  33  -2.239   2.581 -10.647
  258    H    ARG  34           HN       ARG  34   1.427   3.912  -5.158
  259    HA   ARG  34           HA       ARG  34   0.118   2.770  -2.936
  260    HB2  ARG  34           HB2      ARG  34  -1.110   4.939  -2.821
  261    HB3  ARG  34           HB1      ARG  34   0.634   5.124  -2.921
  262    HG2  ARG  34           HG2      ARG  34   0.540   5.834  -5.158
  263    HG3  ARG  34           HG1      ARG  34  -1.128   5.288  -5.336
  264    HD2  ARG  34           HD2      ARG  34  -1.886   6.996  -3.802
  265    HD3  ARG  34           HD1      ARG  34  -0.223   7.510  -3.513
  266    HE   ARG  34           HE       ARG  34  -0.206   8.578  -5.574
  267   HH11  ARG  34          HH11      ARG  34  -3.191   6.769  -5.175
  268   HH12  ARG  34          HH12      ARG  34  -3.974   7.526  -6.526
  269   HH21  ARG  34          HH21      ARG  34  -1.249   9.598  -7.303
  270   HH22  ARG  34          HH22      ARG  34  -2.882   9.166  -7.717
  271    HA   PRO  35           HA       PRO  35  -3.591   1.042  -4.686
  272    HB2  PRO  35           HB2      PRO  35  -5.341   1.673  -2.644
  273    HB3  PRO  35           HB1      PRO  35  -4.249   0.284  -2.631
  274    HG2  PRO  35           HG2      PRO  35  -3.940   2.953  -1.330
  275    HG3  PRO  35           HG1      PRO  35  -3.509   1.346  -0.713
  276    HD2  PRO  35           HD2      PRO  35  -1.672   3.051  -1.688
  277    HD3  PRO  35           HD1      PRO  35  -1.525   1.295  -1.895
  278    H    SER  36           HN       SER  36  -5.369   1.688  -5.825
  279    HA   SER  36           HA       SER  36  -5.563   4.457  -6.455
  280    HB2  SER  36           HB2      SER  36  -7.309   2.121  -7.283
  281    HB3  SER  36           HB1      SER  36  -7.307   3.720  -8.034
  282    HG   SER  36           HG       SER  36  -4.950   3.263  -8.332
  283    HA   PRO  37           HA       PRO  37  -8.584   5.752  -3.596
  284    HB2  PRO  37           HB2      PRO  37  -9.897   7.494  -5.520
  285    HB3  PRO  37           HB1      PRO  37  -8.814   7.916  -4.192
  286    HG2  PRO  37           HG2      PRO  37  -8.110   8.176  -6.801
  287    HG3  PRO  37           HG1      PRO  37  -6.936   7.818  -5.520
  288    HD2  PRO  37           HD2      PRO  37  -8.253   5.942  -7.454
  289    HD3  PRO  37           HD1      PRO  37  -6.547   6.023  -6.950
  290    H    GLU  38           HN       GLU  38  -9.428   3.465  -5.466
  291    HA   GLU  38           HA       GLU  38 -12.295   3.880  -5.481
  292    HB2  GLU  38           HB2      GLU  38 -12.383   1.519  -6.342
  293    HB3  GLU  38           HB1      GLU  38 -11.527   2.658  -7.365
  294    HG2  GLU  38           HG2      GLU  38  -9.375   1.775  -6.454
  295    HG3  GLU  38           HG1      GLU  38 -10.308   0.565  -5.569
  296    H    ASP  39           HN       ASP  39 -12.322   4.334  -3.281
  297    HA   ASP  39           HA       ASP  39 -12.846   2.041  -1.608
  298    HB2  ASP  39           HB2      ASP  39 -10.518   2.283  -1.088
  299    HB3  ASP  39           HB1      ASP  39 -10.652   4.037  -1.005
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1   2.988  10.237   6.628
    2    H2   GLY   1           HT2      GLY   1   3.160  11.374   5.387
    3    H3   GLY   1           HT3      GLY   1   3.084   9.726   5.014
    4    HA2  GLY   1           HA1      GLY   1   0.808   9.621   5.826
    5    HA3  GLY   1           HA2      GLY   1   0.893  11.339   6.196
    6    H    SER   2           HN       SER   2   0.569   8.948   3.710
    7    HA   SER   2           HA       SER   2   0.724  10.703   1.486
    8    HB2  SER   2           HB2      SER   2  -0.582   7.998   1.830
    9    HB3  SER   2           HB1      SER   2  -0.422   8.825   0.280
   10    HG   SER   2           HG       SER   2   1.434   7.398   1.698
   11    HA   PRO   3           HA       PRO   3  -3.102  12.818   2.035
   12    HB2  PRO   3           HB2      PRO   3  -3.258  14.038  -0.355
   13    HB3  PRO   3           HB1      PRO   3  -2.031  14.471   0.840
   14    HG2  PRO   3           HG2      PRO   3  -1.781  12.731  -1.583
   15    HG3  PRO   3           HG1      PRO   3  -0.669  13.971  -0.978
   16    HD2  PRO   3           HD2      PRO   3  -0.322  11.299  -0.563
   17    HD3  PRO   3           HD1      PRO   3   0.285  12.552   0.541
   18    H    SER   4           HN       SER   4  -3.541  10.095   1.445
   19    HA   SER   4           HA       SER   4  -6.108  10.309   0.131
   20    HB2  SER   4           HB2      SER   4  -4.013   8.382  -0.919
   21    HB3  SER   4           HB1      SER   4  -5.701   8.428  -1.419
   22    HG   SER   4           HG       SER   4  -4.701  10.883  -1.648
   23    HA   PRO   5           HA       PRO   5  -6.835   7.580   3.624
   24    HB2  PRO   5           HB2      PRO   5  -9.464   7.076   2.952
   25    HB3  PRO   5           HB1      PRO   5  -8.921   8.478   3.878
   26    HG2  PRO   5           HG2      PRO   5  -9.565   8.260   0.968
   27    HG3  PRO   5           HG1      PRO   5  -9.945   9.568   2.105
   28    HD2  PRO   5           HD2      PRO   5  -7.922   9.765   0.347
   29    HD3  PRO   5           HD1      PRO   5  -7.816  10.464   1.977
   30    H    LEU   6           HN       LEU   6  -6.143   5.557   3.590
   31    HA   LEU   6           HA       LEU   6  -5.984   4.109   1.130
   32    HB2  LEU   6           HB2      LEU   6  -5.207   3.283   3.923
   33    HB3  LEU   6           HB1      LEU   6  -4.769   2.441   2.448
   34    HG   LEU   6           HG       LEU   6  -3.900   5.237   3.189
   35   HD11  LEU   6          HD11      LEU   6  -2.392   2.629   3.158
   36   HD12  LEU   6          HD12      LEU   6  -2.817   3.581   4.582
   37   HD13  LEU   6          HD13      LEU   6  -1.670   4.221   3.402
   38   HD21  LEU   6          HD21      LEU   6  -4.133   4.921   0.770
   39   HD22  LEU   6          HD22      LEU   6  -3.097   3.495   0.861
   40   HD23  LEU   6          HD23      LEU   6  -2.441   5.088   1.250
   41    HA   PRO   7           HA       PRO   7  -9.592   1.475   1.395
   42    HB2  PRO   7           HB2      PRO   7  -8.219  -0.648   0.133
   43    HB3  PRO   7           HB1      PRO   7  -9.288   0.517  -0.625
   44    HG2  PRO   7           HG2      PRO   7  -6.362   0.397  -0.598
   45    HG3  PRO   7           HG1      PRO   7  -7.443   1.184  -1.754
   46    HD2  PRO   7           HD2      PRO   7  -5.921   2.530   0.066
   47    HD3  PRO   7           HD1      PRO   7  -7.439   3.154  -0.603
   48    HA   PRO   8           HA       PRO   8  -9.035  -1.020   4.930
   49    HB2  PRO   8           HB2      PRO   8 -10.540  -3.240   4.309
   50    HB3  PRO   8           HB1      PRO   8 -11.207  -1.706   4.877
   51    HG2  PRO   8           HG2      PRO   8 -10.977  -2.757   2.087
   52    HG3  PRO   8           HG1      PRO   8 -12.320  -1.882   2.847
   53    HD2  PRO   8           HD2      PRO   8 -10.612  -0.653   1.189
   54    HD3  PRO   8           HD1      PRO   8 -11.270   0.177   2.613
   55    H    GLY   9           HN       GLY   9  -7.225  -2.007   5.457
   56    HA2  GLY   9           HA2      GLY   9  -6.034  -4.046   5.714
   57    HA3  GLY   9           HA1      GLY   9  -6.594  -4.543   4.128
   58    H    TRP  10           HN       TRP  10  -5.754  -1.523   3.491
   59    HA   TRP  10           HA       TRP  10  -3.168  -2.369   2.471
   60    HB2  TRP  10           HB2      TRP  10  -4.961  -0.022   1.948
   61    HB3  TRP  10           HB1      TRP  10  -3.276   0.013   1.439
   62    HD1  TRP  10           HD1      TRP  10  -6.638  -1.534   0.540
   63    HE1  TRP  10           HE1      TRP  10  -6.377  -2.807  -1.689
   64    HE3  TRP  10           HE3      TRP  10  -1.564  -1.298   0.070
   65    HZ2  TRP  10           HZ2      TRP  10  -4.274  -3.597  -3.413
   66    HZ3  TRP  10           HZ3      TRP  10  -0.507  -2.323  -1.894
   67    HH2  TRP  10           HH2      TRP  10  -1.835  -3.454  -3.598
   68    H    GLU  11           HN       GLU  11  -1.402  -2.103   3.675
   69    HA   GLU  11           HA       GLU  11  -1.247   0.304   5.368
   70    HB2  GLU  11           HB2      GLU  11   0.528  -0.958   6.630
   71    HB3  GLU  11           HB1      GLU  11  -1.098  -1.606   6.776
   72    HG2  GLU  11           HG2      GLU  11  -0.597  -3.378   5.268
   73    HG3  GLU  11           HG1      GLU  11   0.974  -2.671   4.870
   74    H    GLU  12           HN       GLU  12   0.476   1.626   5.267
   75    HA   GLU  12           HA       GLU  12   2.076   1.503   2.853
   76    HB2  GLU  12           HB2      GLU  12   1.016   3.607   3.615
   77    HB3  GLU  12           HB1      GLU  12   2.000   3.561   5.071
   78    HG2  GLU  12           HG2      GLU  12   3.994   3.912   3.825
   79    HG3  GLU  12           HG1      GLU  12   3.140   3.704   2.294
   80    H    ARG  13           HN       ARG  13   3.982   0.479   2.808
   81    HA   ARG  13           HA       ARG  13   5.462   0.183   5.339
   82    HB2  ARG  13           HB2      ARG  13   4.874  -1.862   3.199
   83    HB3  ARG  13           HB1      ARG  13   6.122  -2.091   4.422
   84    HG2  ARG  13           HG2      ARG  13   3.449  -1.379   5.434
   85    HG3  ARG  13           HG1      ARG  13   3.596  -2.963   4.668
   86    HD2  ARG  13           HD2      ARG  13   5.405  -1.952   6.856
   87    HD3  ARG  13           HD1      ARG  13   4.007  -2.996   7.118
   88    HE   ARG  13           HE       ARG  13   5.714  -4.153   5.191
   89   HH11  ARG  13          HH11      ARG  13   5.610  -3.461   8.620
   90   HH12  ARG  13          HH12      ARG  13   6.547  -4.859   9.046
   91   HH21  ARG  13          HH21      ARG  13   6.937  -5.989   5.761
   92   HH22  ARG  13          HH22      ARG  13   7.300  -6.285   7.433
   93    H    GLN  14           HN       GLN  14   7.776  -0.283   5.051
   94    HA   GLN  14           HA       GLN  14   8.818   0.851   2.542
   95    HB2  GLN  14           HB2      GLN  14  10.897   1.356   3.831
   96    HB3  GLN  14           HB1      GLN  14   9.488   2.230   4.405
   97    HG2  GLN  14           HG2      GLN  14   9.988   1.540   6.437
   98    HG3  GLN  14           HG1      GLN  14   9.530  -0.083   5.932
   99   HE21  GLN  14          HE21      GLN  14  11.811  -0.393   4.101
  100   HE22  GLN  14          HE22      GLN  14  13.190  -0.636   5.128
  101    H    ASP  15           HN       ASP  15   9.918  -0.444   1.250
  102    HA   ASP  15           HA       ASP  15  10.605  -3.110   2.155
  103    HB2  ASP  15           HB2      ASP  15   9.669  -2.669  -0.150
  104    HB3  ASP  15           HB1      ASP  15  11.166  -1.830  -0.536
  105    H    VAL  16           HN       VAL  16  12.771  -3.934   1.949
  106    HA   VAL  16           HA       VAL  16  14.748  -2.347   3.129
  107    HB   VAL  16           HB       VAL  16  15.040  -4.875   1.507
  108   HG11  VAL  16          HG11      VAL  16  17.151  -5.205   2.711
  109   HG12  VAL  16          HG12      VAL  16  16.962  -3.621   3.463
  110   HG13  VAL  16          HG13      VAL  16  17.184  -3.748   1.716
  111   HG21  VAL  16          HG21      VAL  16  14.760  -4.476   4.476
  112   HG22  VAL  16          HG22      VAL  16  15.057  -6.019   3.674
  113   HG23  VAL  16          HG23      VAL  16  13.541  -5.157   3.398
  114    H    LEU  17           HN       LEU  17  13.918  -2.981  -0.214
  115    HA   LEU  17           HA       LEU  17  16.256  -1.918  -1.394
  116    HB2  LEU  17           HB2      LEU  17  13.459  -2.144  -2.501
  117    HB3  LEU  17           HB1      LEU  17  14.882  -1.750  -3.447
  118    HG   LEU  17           HG       LEU  17  14.470  -4.351  -1.961
  119   HD11  LEU  17          HD11      LEU  17  12.902  -4.118  -3.810
  120   HD12  LEU  17          HD12      LEU  17  14.133  -5.333  -4.170
  121   HD13  LEU  17          HD13      LEU  17  14.234  -3.726  -4.900
  122   HD21  LEU  17          HD21      LEU  17  16.825  -3.741  -2.206
  123   HD22  LEU  17          HD22      LEU  17  16.584  -3.503  -3.935
  124   HD23  LEU  17          HD23      LEU  17  16.412  -5.111  -3.236
  125    H    GLY  18           HN       GLY  18  13.437  -0.408   0.013
  126    HA2  GLY  18           HA2      GLY  18  13.824   1.877   0.782
  127    HA3  GLY  18           HA1      GLY  18  14.655   2.187  -0.743
  128    H    ARG  19           HN       ARG  19  12.507   0.431  -1.986
  129    HA   ARG  19           HA       ARG  19  10.709   2.459  -2.786
  130    HB2  ARG  19           HB2      ARG  19  10.693  -0.534  -3.082
  131    HB3  ARG  19           HB1      ARG  19   9.333   0.439  -3.612
  132    HG2  ARG  19           HG2      ARG  19  10.720  -0.020  -5.483
  133    HG3  ARG  19           HG1      ARG  19  10.860   1.696  -5.092
  134    HD2  ARG  19           HD2      ARG  19  12.956   1.211  -3.874
  135    HD3  ARG  19           HD1      ARG  19  12.828  -0.474  -4.377
  136    HE   ARG  19           HE       ARG  19  12.736   0.835  -6.725
  137   HH11  ARG  19          HH11      ARG  19  14.951   1.000  -3.997
  138   HH12  ARG  19          HH12      ARG  19  16.316   1.473  -4.965
  139   HH21  ARG  19          HH21      ARG  19  14.503   1.523  -7.985
  140   HH22  ARG  19          HH22      ARG  19  16.048   1.785  -7.234
  141    H    THR  20           HN       THR  20   8.888   3.155  -1.790
  142    HA   THR  20           HA       THR  20   8.057   1.872   0.654
  143    HB   THR  20           HB       THR  20   6.515   3.986  -0.851
  144    HG1  THR  20           HG1      THR  20   8.977   4.152   0.453
  145   HG21  THR  20          HG21      THR  20   6.839   3.340   2.082
  146   HG22  THR  20          HG22      THR  20   5.405   3.036   1.095
  147   HG23  THR  20          HG23      THR  20   5.906   4.692   1.436
  148    H    TYR  21           HN       TYR  21   7.183  -0.087   0.364
  149    HA   TYR  21           HA       TYR  21   5.212  -0.425  -1.796
  150    HB2  TYR  21           HB2      TYR  21   5.642  -2.720  -1.777
  151    HB3  TYR  21           HB1      TYR  21   7.228  -2.022  -1.472
  152    HD1  TYR  21           HD2      TYR  21   7.968  -1.853   0.998
  153    HD2  TYR  21           HD1      TYR  21   4.789  -4.347  -0.325
  154    HE1  TYR  21           HE2      TYR  21   8.193  -3.205   3.036
  155    HE2  TYR  21           HE1      TYR  21   5.007  -5.713   1.711
  156    HH   TYR  21           HH       TYR  21   6.699  -4.721   4.417
  157    H    TYR  22           HN       TYR  22   3.115  -0.999  -1.368
  158    HA   TYR  22           HA       TYR  22   2.343  -1.007   1.462
  159    HB2  TYR  22           HB2      TYR  22   0.606  -0.837  -0.997
  160    HB3  TYR  22           HB1      TYR  22   0.043  -0.753   0.656
  161    HD1  TYR  22           HD2      TYR  22   2.450   0.968  -1.614
  162    HD2  TYR  22           HD1      TYR  22  -0.339   1.359   1.578
  163    HE1  TYR  22           HE2      TYR  22   2.763   3.405  -1.642
  164    HE2  TYR  22           HE1      TYR  22  -0.027   3.795   1.554
  165    HH   TYR  22           HH       TYR  22   1.453   5.435  -0.967
  166    H    VAL  23           HN       VAL  23   0.850  -2.637   2.200
  167    HA   VAL  23           HA       VAL  23   0.592  -4.959   0.450
  168    HB   VAL  23           HB       VAL  23   2.415  -5.726   1.686
  169   HG11  VAL  23          HG11      VAL  23   2.682  -5.514   4.094
  170   HG12  VAL  23          HG12      VAL  23   1.144  -4.655   4.195
  171   HG13  VAL  23          HG13      VAL  23   2.502  -3.931   3.328
  172   HG21  VAL  23          HG21      VAL  23  -0.024  -6.695   3.182
  173   HG22  VAL  23          HG22      VAL  23   1.551  -7.494   3.150
  174   HG23  VAL  23          HG23      VAL  23   0.600  -7.353   1.669
  175    H    ASN  24           HN       ASN  24  -1.376  -5.663   0.365
  176    HA   ASN  24           HA       ASN  24  -3.406  -4.659   2.167
  177    HB2  ASN  24           HB2      ASN  24  -3.841  -4.853  -0.263
  178    HB3  ASN  24           HB1      ASN  24  -3.598  -6.592  -0.158
  179   HD21  ASN  24          HD21      ASN  24  -5.715  -3.945   0.620
  180   HD22  ASN  24          HD22      ASN  24  -7.101  -4.911   0.995
  181    H    HIS  25           HN       HIS  25  -4.081  -5.704   3.948
  182    HA   HIS  25           HA       HIS  25  -2.823  -8.092   4.789
  183    HB2  HIS  25           HB2      HIS  25  -5.117  -6.481   5.858
  184    HB3  HIS  25           HB1      HIS  25  -4.695  -8.027   6.586
  185    HD1  HIS  25           HD1      HIS  25  -3.042  -7.907   8.410
  186    HD2  HIS  25           HD2      HIS  25  -2.769  -4.631   5.859
  187    HE1  HIS  25           HE1      HIS  25  -1.326  -6.378   9.439
  188    HE2  HIS  25           HE2      HIS  25  -1.063  -4.483   7.801
  189    H    GLU  26           HN       GLU  26  -5.911  -7.531   3.213
  190    HA   GLU  26           HA       GLU  26  -7.043 -10.043   3.947
  191    HB2  GLU  26           HB2      GLU  26  -8.523  -8.221   3.498
  192    HB3  GLU  26           HB1      GLU  26  -7.832  -7.971   1.901
  193    HG2  GLU  26           HG2      GLU  26  -8.856  -9.869   1.029
  194    HG3  GLU  26           HG1      GLU  26  -9.185 -10.543   2.625
  195    H    SER  27           HN       SER  27  -5.948  -8.809   0.758
  196    HA   SER  27           HA       SER  27  -5.906 -11.576  -0.204
  197    HB2  SER  27           HB2      SER  27  -6.993  -9.658  -1.495
  198    HB3  SER  27           HB1      SER  27  -5.359  -9.085  -1.825
  199    HG   SER  27           HG       SER  27  -6.451 -11.617  -2.533
  200    H    ARG  28           HN       ARG  28  -3.920  -9.780   1.474
  201    HA   ARG  28           HA       ARG  28  -1.708  -9.310   1.631
  202    HB2  ARG  28           HB2      ARG  28  -0.325 -11.360   1.770
  203    HB3  ARG  28           HB1      ARG  28  -1.808 -11.412   2.705
  204    HG2  ARG  28           HG2      ARG  28  -2.839 -12.794   0.977
  205    HG3  ARG  28           HG1      ARG  28  -1.333 -12.756   0.055
  206    HD2  ARG  28           HD2      ARG  28  -1.831 -13.967   2.758
  207    HD3  ARG  28           HD1      ARG  28  -1.348 -14.796   1.277
  208    HE   ARG  28           HE       ARG  28   0.348 -13.201   3.048
  209   HH11  ARG  28          HH11      ARG  28   0.044 -15.131   0.136
  210   HH12  ARG  28          HH12      ARG  28   1.767 -15.206  -0.136
  211   HH21  ARG  28          HH21      ARG  28   2.596 -13.325   2.711
  212   HH22  ARG  28          HH22      ARG  28   3.216 -14.187   1.335
  213    H    THR  29           HN       THR  29  -2.194  -8.214  -0.551
  214    HA   THR  29           HA       THR  29  -0.269  -9.171  -2.548
  215    HB   THR  29           HB       THR  29  -2.498  -7.173  -2.959
  216    HG1  THR  29           HG1      THR  29  -2.656  -9.832  -2.655
  217   HG21  THR  29          HG21      THR  29  -0.790  -8.729  -4.908
  218   HG22  THR  29          HG22      THR  29  -0.674  -7.000  -4.575
  219   HG23  THR  29          HG23      THR  29  -2.124  -7.655  -5.341
  220    H    THR  30           HN       THR  30   1.450  -7.959  -3.016
  221    HA   THR  30           HA       THR  30   1.840  -5.494  -1.503
  222    HB   THR  30           HB       THR  30   4.245  -5.780  -2.368
  223    HG1  THR  30           HG1      THR  30   3.343  -8.458  -2.803
  224   HG21  THR  30          HG21      THR  30   3.511  -6.262  -0.061
  225   HG22  THR  30          HG22      THR  30   4.773  -7.369  -0.602
  226   HG23  THR  30          HG23      THR  30   3.094  -7.904  -0.551
  227    H    GLN  31           HN       GLN  31   2.504  -3.561  -2.449
  228    HA   GLN  31           HA       GLN  31   2.414  -3.379  -5.373
  229    HB2  GLN  31           HB2      GLN  31   0.127  -2.964  -4.392
  230    HB3  GLN  31           HB1      GLN  31   0.809  -1.580  -3.553
  231    HG2  GLN  31           HG2      GLN  31   1.343  -0.539  -5.690
  232    HG3  GLN  31           HG1      GLN  31   0.688  -1.933  -6.540
  233   HE21  GLN  31          HE21      GLN  31  -0.827  -0.658  -7.594
  234   HE22  GLN  31          HE22      GLN  31  -2.215  -0.022  -6.788
  235    H    TRP  32           HN       TRP  32   3.974  -2.038  -6.136
  236    HA   TRP  32           HA       TRP  32   5.604  -0.567  -4.236
  237    HB2  TRP  32           HB2      TRP  32   5.860  -0.722  -7.253
  238    HB3  TRP  32           HB1      TRP  32   7.066  -0.098  -6.135
  239    HD1  TRP  32           HD1      TRP  32   6.139  -3.160  -7.932
  240    HE1  TRP  32           HE1      TRP  32   7.467  -5.186  -7.065
  241    HE3  TRP  32           HE3      TRP  32   8.016  -1.111  -3.656
  242    HZ2  TRP  32           HZ2      TRP  32   9.098  -5.826  -4.857
  243    HZ3  TRP  32           HZ3      TRP  32   9.450  -2.493  -2.221
  244    HH2  TRP  32           HH2      TRP  32   9.981  -4.805  -2.809
  245    H    LYS  33           HN       LYS  33   2.878  -0.035  -6.014
  246    HA   LYS  33           HA       LYS  33   3.242   2.872  -6.131
  247    HB2  LYS  33           HB2      LYS  33   1.058   1.121  -7.288
  248    HB3  LYS  33           HB1      LYS  33   1.172   2.862  -7.482
  249    HG2  LYS  33           HG2      LYS  33   3.239   0.918  -8.469
  250    HG3  LYS  33           HG1      LYS  33   1.917   1.560  -9.444
  251    HD2  LYS  33           HD2      LYS  33   4.106   3.168  -8.136
  252    HD3  LYS  33           HD1      LYS  33   3.950   2.819  -9.860
  253    HE2  LYS  33           HE2      LYS  33   1.777   4.003  -9.858
  254    HE3  LYS  33           HE1      LYS  33   2.044   4.431  -8.169
  255    HZ1  LYS  33           HZ1      LYS  33   3.342   5.448 -10.579
  256    HZ2  LYS  33           HZ2      LYS  33   4.277   5.346  -9.175
  257    HZ3  LYS  33           HZ3      LYS  33   2.856   6.274  -9.179
  258    H    ARG  34           HN       ARG  34   1.111   4.056  -5.554
  259    HA   ARG  34           HA       ARG  34   0.176   3.069  -2.984
  260    HB2  ARG  34           HB2      ARG  34  -0.647   5.597  -4.428
  261    HB3  ARG  34           HB1      ARG  34  -0.956   5.199  -2.746
  262    HG2  ARG  34           HG2      ARG  34   1.568   5.152  -2.454
  263    HG3  ARG  34           HG1      ARG  34   1.652   5.919  -4.040
  264    HD2  ARG  34           HD2      ARG  34   0.269   6.980  -1.577
  265    HD3  ARG  34           HD1      ARG  34   1.733   7.614  -2.325
  266    HE   ARG  34           HE       ARG  34  -0.760   7.591  -3.875
  267   HH11  ARG  34          HH11      ARG  34   1.741   9.384  -2.193
  268   HH12  ARG  34          HH12      ARG  34   1.275  10.919  -2.877
  269   HH21  ARG  34          HH21      ARG  34  -1.364   9.597  -4.786
  270   HH22  ARG  34          HH22      ARG  34  -0.512  11.045  -4.331
  271    HA   PRO  35           HA       PRO  35  -3.369   1.001  -4.590
  272    HB2  PRO  35           HB2      PRO  35  -5.101   1.576  -2.456
  273    HB3  PRO  35           HB1      PRO  35  -4.000   0.191  -2.568
  274    HG2  PRO  35           HG2      PRO  35  -3.632   2.777  -1.140
  275    HG3  PRO  35           HG1      PRO  35  -3.107   1.149  -0.677
  276    HD2  PRO  35           HD2      PRO  35  -1.388   2.966  -1.652
  277    HD3  PRO  35           HD1      PRO  35  -1.230   1.235  -2.023
  278    H    SER  36           HN       SER  36  -4.650   1.750  -6.122
  279    HA   SER  36           HA       SER  36  -5.511   4.421  -6.360
  280    HB2  SER  36           HB2      SER  36  -6.769   1.955  -7.595
  281    HB3  SER  36           HB1      SER  36  -6.869   3.605  -8.200
  282    HG   SER  36           HG       SER  36  -4.325   3.152  -8.000
  283    HA   PRO  37           HA       PRO  37  -9.011   4.536  -3.704
  284    HB2  PRO  37           HB2      PRO  37 -10.702   5.872  -5.683
  285    HB3  PRO  37           HB1      PRO  37  -9.976   6.524  -4.212
  286    HG2  PRO  37           HG2      PRO  37  -9.149   7.259  -6.671
  287    HG3  PRO  37           HG1      PRO  37  -8.041   7.158  -5.290
  288    HD2  PRO  37           HD2      PRO  37  -8.503   5.186  -7.499
  289    HD3  PRO  37           HD1      PRO  37  -6.965   5.755  -6.807
  290    H    GLU  38           HN       GLU  38  -8.884   2.096  -5.242
  291    HA   GLU  38           HA       GLU  38 -11.617   1.398  -5.882
  292    HB2  GLU  38           HB2      GLU  38  -9.335  -0.485  -5.218
  293    HB3  GLU  38           HB1      GLU  38 -10.807  -0.860  -6.101
  294    HG2  GLU  38           HG2      GLU  38 -10.083   0.494  -7.961
  295    HG3  GLU  38           HG1      GLU  38  -8.648   0.996  -7.067
  296    H    ASP  39           HN       ASP  39 -12.500   2.281  -3.953
  297    HA   ASP  39           HA       ASP  39 -12.507   0.575  -1.641
  298    HB2  ASP  39           HB2      ASP  39 -10.477   1.608  -1.040
  299    HB3  ASP  39           HB1      ASP  39 -10.956   3.157  -1.718
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1  -7.520  17.241  -0.650
    2    H2   GLY   1           HT2      GLY   1  -8.890  18.239  -0.623
    3    H3   GLY   1           HT3      GLY   1  -7.849  18.266  -1.959
    4    HA2  GLY   1           HA1      GLY   1  -9.472  15.929  -1.112
    5    HA3  GLY   1           HA2      GLY   1  -9.894  17.025  -2.421
    6    H    SER   2           HN       SER   2  -8.751  14.082  -1.874
    7    HA   SER   2           HA       SER   2  -7.756  13.615  -4.441
    8    HB2  SER   2           HB2      SER   2  -5.336  13.151  -3.802
    9    HB3  SER   2           HB1      SER   2  -5.775  14.857  -3.883
   10    HG   SER   2           HG       SER   2  -5.822  13.364  -1.467
   11    HA   PRO   3           HA       PRO   3  -8.260   9.417  -3.015
   12    HB2  PRO   3           HB2      PRO   3  -5.955   8.570  -4.635
   13    HB3  PRO   3           HB1      PRO   3  -7.658   8.130  -4.794
   14    HG2  PRO   3           HG2      PRO   3  -6.453   9.746  -6.571
   15    HG3  PRO   3           HG1      PRO   3  -8.147   9.973  -6.099
   16    HD2  PRO   3           HD2      PRO   3  -5.706  11.453  -5.177
   17    HD3  PRO   3           HD1      PRO   3  -7.308  12.086  -5.618
   18    H    SER   4           HN       SER   4  -6.984  10.766  -1.107
   19    HA   SER   4           HA       SER   4  -4.414   9.659  -0.472
   20    HB2  SER   4           HB2      SER   4  -6.265  11.253   1.311
   21    HB3  SER   4           HB1      SER   4  -4.534  10.997   1.536
   22    HG   SER   4           HG       SER   4  -4.108  12.250  -0.236
   23    HA   PRO   5           HA       PRO   5  -7.131   7.180   2.780
   24    HB2  PRO   5           HB2      PRO   5  -9.658   6.983   1.253
   25    HB3  PRO   5           HB1      PRO   5  -9.403   7.211   2.982
   26    HG2  PRO   5           HG2      PRO   5 -10.264   9.212   1.447
   27    HG3  PRO   5           HG1      PRO   5  -9.131   9.493   2.784
   28    HD2  PRO   5           HD2      PRO   5  -8.592   9.336  -0.156
   29    HD3  PRO   5           HD1      PRO   5  -7.915  10.445   1.057
   30    H    LEU   6           HN       LEU   6  -5.988   5.406   2.313
   31    HA   LEU   6           HA       LEU   6  -6.163   4.087  -0.240
   32    HB2  LEU   6           HB2      LEU   6  -4.637   2.401   0.931
   33    HB3  LEU   6           HB1      LEU   6  -4.016   4.012   0.638
   34    HG   LEU   6           HG       LEU   6  -4.574   4.550   3.043
   35   HD11  LEU   6          HD11      LEU   6  -4.913   1.562   3.224
   36   HD12  LEU   6          HD12      LEU   6  -6.185   2.763   3.449
   37   HD13  LEU   6          HD13      LEU   6  -4.839   2.678   4.588
   38   HD21  LEU   6          HD21      LEU   6  -2.311   4.111   2.320
   39   HD22  LEU   6          HD22      LEU   6  -2.574   2.374   2.448
   40   HD23  LEU   6          HD23      LEU   6  -2.580   3.375   3.899
   41    HA   PRO   7           HA       PRO   7  -9.240   1.060   0.499
   42    HB2  PRO   7           HB2      PRO   7  -7.413  -1.097  -0.356
   43    HB3  PRO   7           HB1      PRO   7  -8.913  -0.541  -1.099
   44    HG2  PRO   7           HG2      PRO   7  -6.571  -0.022  -2.255
   45    HG3  PRO   7           HG1      PRO   7  -7.889   1.169  -2.241
   46    HD2  PRO   7           HD2      PRO   7  -5.473   1.019  -0.460
   47    HD3  PRO   7           HD1      PRO   7  -6.140   2.417  -1.309
   48    HA   PRO   8           HA       PRO   8  -8.666  -0.464   4.605
   49    HB2  PRO   8           HB2      PRO   8 -10.670  -2.495   3.725
   50    HB3  PRO   8           HB1      PRO   8 -10.681  -1.452   5.152
   51    HG2  PRO   8           HG2      PRO   8 -12.240  -0.872   3.106
   52    HG3  PRO   8           HG1      PRO   8 -11.344   0.420   3.930
   53    HD2  PRO   8           HD2      PRO   8 -10.748  -0.922   1.319
   54    HD3  PRO   8           HD1      PRO   8 -10.624   0.794   1.759
   55    H    GLY   9           HN       GLY   9  -7.148  -1.732   5.384
   56    HA2  GLY   9           HA2      GLY   9  -6.205  -3.871   5.812
   57    HA3  GLY   9           HA1      GLY   9  -6.765  -4.403   4.234
   58    H    TRP  10           HN       TRP  10  -5.674  -1.624   3.279
   59    HA   TRP  10           HA       TRP  10  -3.054  -2.652   2.605
   60    HB2  TRP  10           HB2      TRP  10  -4.596  -0.184   1.839
   61    HB3  TRP  10           HB1      TRP  10  -2.903  -0.381   1.405
   62    HD1  TRP  10           HD1      TRP  10  -6.311  -2.106   0.787
   63    HE1  TRP  10           HE1      TRP  10  -6.168  -3.327  -1.478
   64    HE3  TRP  10           HE3      TRP  10  -1.410  -1.256  -0.243
   65    HZ2  TRP  10           HZ2      TRP  10  -4.186  -3.840  -3.454
   66    HZ3  TRP  10           HZ3      TRP  10  -0.459  -2.119  -2.323
   67    HH2  TRP  10           HH2      TRP  10  -1.818  -3.396  -3.908
   68    H    GLU  11           HN       GLU  11  -1.270  -2.310   3.747
   69    HA   GLU  11           HA       GLU  11  -1.173   0.062   5.493
   70    HB2  GLU  11           HB2      GLU  11   0.437  -1.054   6.843
   71    HB3  GLU  11           HB1      GLU  11  -0.840  -2.221   6.533
   72    HG2  GLU  11           HG2      GLU  11   0.460  -3.444   5.049
   73    HG3  GLU  11           HG1      GLU  11   1.610  -2.125   4.822
   74    H    GLU  12           HN       GLU  12   0.567   1.462   5.376
   75    HA   GLU  12           HA       GLU  12   2.129   1.395   2.944
   76    HB2  GLU  12           HB2      GLU  12   1.188   3.520   3.846
   77    HB3  GLU  12           HB1      GLU  12   2.235   3.353   5.251
   78    HG2  GLU  12           HG2      GLU  12   4.186   3.621   3.933
   79    HG3  GLU  12           HG1      GLU  12   3.265   3.506   2.435
   80    H    ARG  13           HN       ARG  13   3.836   0.141   2.867
   81    HA   ARG  13           HA       ARG  13   5.332  -0.393   5.349
   82    HB2  ARG  13           HB2      ARG  13   3.880  -2.279   4.706
   83    HB3  ARG  13           HB1      ARG  13   4.642  -2.329   3.121
   84    HG2  ARG  13           HG2      ARG  13   5.558  -4.068   4.474
   85    HG3  ARG  13           HG1      ARG  13   6.798  -2.836   4.252
   86    HD2  ARG  13           HD2      ARG  13   5.991  -1.877   6.471
   87    HD3  ARG  13           HD1      ARG  13   5.128  -3.396   6.683
   88    HE   ARG  13           HE       ARG  13   7.891  -3.794   6.054
   89   HH11  ARG  13          HH11      ARG  13   5.635  -3.115   8.644
   90   HH12  ARG  13          HH12      ARG  13   6.719  -3.637   9.899
   91   HH21  ARG  13          HH21      ARG  13   9.302  -4.501   7.661
   92   HH22  ARG  13          HH22      ARG  13   8.819  -4.458   9.335
   93    H    GLN  14           HN       GLN  14   7.588  -0.555   5.156
   94    HA   GLN  14           HA       GLN  14   8.600   0.453   2.608
   95    HB2  GLN  14           HB2      GLN  14  10.756   0.832   3.930
   96    HB3  GLN  14           HB1      GLN  14   9.393   1.875   4.284
   97    HG2  GLN  14           HG2      GLN  14  10.332   1.351   6.351
   98    HG3  GLN  14           HG1      GLN  14   8.907   0.336   6.239
   99   HE21  GLN  14          HE21      GLN  14  11.942  -0.314   4.582
  100   HE22  GLN  14          HE22      GLN  14  12.346  -1.719   5.497
  101    H    ASP  15           HN       ASP  15  10.020  -0.606   1.362
  102    HA   ASP  15           HA       ASP  15  10.454  -3.418   1.965
  103    HB2  ASP  15           HB2      ASP  15   9.688  -2.742  -0.288
  104    HB3  ASP  15           HB1      ASP  15  11.162  -1.813  -0.506
  105    H    VAL  16           HN       VAL  16  12.631  -4.310   1.406
  106    HA   VAL  16           HA       VAL  16  14.610  -3.071   3.016
  107    HB   VAL  16           HB       VAL  16  14.308  -5.521   2.661
  108   HG11  VAL  16          HG11      VAL  16  15.358  -6.591   0.726
  109   HG12  VAL  16          HG12      VAL  16  15.676  -5.003   0.026
  110   HG13  VAL  16          HG13      VAL  16  14.016  -5.552   0.252
  111   HG21  VAL  16          HG21      VAL  16  16.733  -6.041   2.686
  112   HG22  VAL  16          HG22      VAL  16  16.300  -4.692   3.734
  113   HG23  VAL  16          HG23      VAL  16  17.056  -4.384   2.173
  114    H    LEU  17           HN       LEU  17  13.868  -3.067  -0.396
  115    HA   LEU  17           HA       LEU  17  16.400  -1.957  -1.186
  116    HB2  LEU  17           HB2      LEU  17  13.783  -2.185  -2.675
  117    HB3  LEU  17           HB1      LEU  17  15.289  -1.637  -3.383
  118    HG   LEU  17           HG       LEU  17  14.778  -4.392  -2.258
  119   HD11  LEU  17          HD11      LEU  17  14.885  -5.127  -4.571
  120   HD12  LEU  17          HD12      LEU  17  15.119  -3.462  -5.106
  121   HD13  LEU  17          HD13      LEU  17  13.596  -3.947  -4.360
  122   HD21  LEU  17          HD21      LEU  17  17.187  -3.270  -3.681
  123   HD22  LEU  17          HD22      LEU  17  16.956  -4.955  -3.213
  124   HD23  LEU  17          HD23      LEU  17  17.103  -3.705  -1.976
  125    H    GLY  18           HN       GLY  18  13.374  -0.649  -0.007
  126    HA2  GLY  18           HA2      GLY  18  13.700   1.540   1.050
  127    HA3  GLY  18           HA1      GLY  18  14.651   2.001  -0.361
  128    H    ARG  19           HN       ARG  19  12.453   0.308  -1.805
  129    HA   ARG  19           HA       ARG  19  10.746   2.478  -2.511
  130    HB2  ARG  19           HB2      ARG  19  10.724  -0.476  -3.077
  131    HB3  ARG  19           HB1      ARG  19   9.354   0.527  -3.525
  132    HG2  ARG  19           HG2      ARG  19  10.730   0.259  -5.428
  133    HG3  ARG  19           HG1      ARG  19  10.903   1.922  -4.878
  134    HD2  ARG  19           HD2      ARG  19  13.013   1.338  -3.789
  135    HD3  ARG  19           HD1      ARG  19  12.838  -0.329  -4.334
  136    HE   ARG  19           HE       ARG  19  12.699   1.143  -6.630
  137   HH11  ARG  19          HH11      ARG  19  15.016   0.883  -4.014
  138   HH12  ARG  19          HH12      ARG  19  16.385   1.284  -4.997
  139   HH21  ARG  19          HH21      ARG  19  14.488   1.686  -7.946
  140   HH22  ARG  19          HH22      ARG  19  16.082   1.709  -7.258
  141    H    THR  20           HN       THR  20   9.332   3.272  -0.991
  142    HA   THR  20           HA       THR  20   8.159   1.589   0.985
  143    HB   THR  20           HB       THR  20   7.067   4.230  -0.021
  144    HG1  THR  20           HG1      THR  20   8.514   4.408   2.270
  145   HG21  THR  20          HG21      THR  20   6.112   4.414   2.212
  146   HG22  THR  20          HG22      THR  20   6.842   2.876   2.669
  147   HG23  THR  20          HG23      THR  20   5.574   2.918   1.444
  148    H    TYR  21           HN       TYR  21   7.054  -0.119   0.212
  149    HA   TYR  21           HA       TYR  21   5.012   0.365  -1.847
  150    HB2  TYR  21           HB2      TYR  21   4.834  -2.036  -2.049
  151    HB3  TYR  21           HB1      TYR  21   6.525  -1.571  -2.127
  152    HD1  TYR  21           HD2      TYR  21   7.922  -1.840   0.017
  153    HD2  TYR  21           HD1      TYR  21   4.132  -3.691  -0.543
  154    HE1  TYR  21           HE2      TYR  21   8.447  -3.449   1.801
  155    HE2  TYR  21           HE1      TYR  21   4.643  -5.292   1.248
  156    HH   TYR  21           HH       TYR  21   7.129  -4.889   3.425
  157    H    TYR  22           HN       TYR  22   3.069  -1.346  -1.367
  158    HA   TYR  22           HA       TYR  22   2.223  -1.032   1.436
  159    HB2  TYR  22           HB2      TYR  22   0.449  -0.749  -0.992
  160    HB3  TYR  22           HB1      TYR  22  -0.089  -0.738   0.675
  161    HD1  TYR  22           HD2      TYR  22   1.989   1.126  -1.767
  162    HD2  TYR  22           HD1      TYR  22  -0.174   1.270   1.889
  163    HE1  TYR  22           HE2      TYR  22   2.294   3.563  -1.693
  164    HE2  TYR  22           HE1      TYR  22   0.123   3.703   1.977
  165    HH   TYR  22           HH       TYR  22   1.086   5.519  -0.671
  166    H    VAL  23           HN       VAL  23   1.030  -2.755   2.250
  167    HA   VAL  23           HA       VAL  23   0.539  -4.968   0.395
  168    HB   VAL  23           HB       VAL  23   2.533  -5.625   1.547
  169   HG11  VAL  23          HG11      VAL  23   1.071  -5.054   4.117
  170   HG12  VAL  23          HG12      VAL  23   2.461  -4.179   3.467
  171   HG13  VAL  23          HG13      VAL  23   2.638  -5.854   3.987
  172   HG21  VAL  23          HG21      VAL  23   1.799  -7.685   2.640
  173   HG22  VAL  23          HG22      VAL  23   0.902  -7.382   1.151
  174   HG23  VAL  23          HG23      VAL  23   0.154  -7.055   2.716
  175    H    ASN  24           HN       ASN  24  -1.442  -5.659   0.431
  176    HA   ASN  24           HA       ASN  24  -3.306  -4.696   2.406
  177    HB2  ASN  24           HB2      ASN  24  -4.009  -4.860   0.072
  178    HB3  ASN  24           HB1      ASN  24  -3.678  -6.589   0.072
  179   HD21  ASN  24          HD21      ASN  24  -5.811  -4.084   1.204
  180   HD22  ASN  24          HD22      ASN  24  -7.118  -5.122   1.653
  181    H    HIS  25           HN       HIS  25  -4.009  -5.823   4.188
  182    HA   HIS  25           HA       HIS  25  -2.519  -8.192   4.844
  183    HB2  HIS  25           HB2      HIS  25  -4.586  -6.606   6.354
  184    HB3  HIS  25           HB1      HIS  25  -3.847  -8.064   7.002
  185    HD1  HIS  25           HD1      HIS  25  -3.046  -6.279   8.893
  186    HD2  HIS  25           HD2      HIS  25  -1.264  -6.011   5.145
  187    HE1  HIS  25           HE1      HIS  25  -0.958  -4.927   9.230
  188    HE2  HIS  25           HE2      HIS  25   0.214  -4.966   6.996
  189    H    GLU  26           HN       GLU  26  -5.538  -7.699   3.349
  190    HA   GLU  26           HA       GLU  26  -6.684 -10.169   4.366
  191    HB2  GLU  26           HB2      GLU  26  -8.065  -8.123   3.893
  192    HB3  GLU  26           HB1      GLU  26  -7.754  -8.379   2.183
  193    HG2  GLU  26           HG2      GLU  26  -8.889 -10.518   2.268
  194    HG3  GLU  26           HG1      GLU  26  -9.137 -10.334   4.003
  195    H    SER  27           HN       SER  27  -5.743  -8.902   1.166
  196    HA   SER  27           HA       SER  27  -5.766 -11.631   0.118
  197    HB2  SER  27           HB2      SER  27  -6.915  -9.852  -1.169
  198    HB3  SER  27           HB1      SER  27  -5.379  -9.000  -1.339
  199    HG   SER  27           HG       SER  27  -4.775 -11.306  -2.203
  200    H    ARG  28           HN       ARG  28  -3.598  -9.545   1.529
  201    HA   ARG  28           HA       ARG  28  -1.358  -9.562   1.850
  202    HB2  ARG  28           HB2      ARG  28  -1.426 -12.253   0.485
  203    HB3  ARG  28           HB1      ARG  28  -0.143 -11.639   1.516
  204    HG2  ARG  28           HG2      ARG  28  -2.972 -12.185   2.392
  205    HG3  ARG  28           HG1      ARG  28  -1.587 -13.240   2.680
  206    HD2  ARG  28           HD2      ARG  28  -0.551 -11.625   4.097
  207    HD3  ARG  28           HD1      ARG  28  -1.704 -10.381   3.618
  208    HE   ARG  28           HE       ARG  28  -3.272 -11.277   5.061
  209   HH11  ARG  28          HH11      ARG  28  -0.486 -13.371   4.871
  210   HH12  ARG  28          HH12      ARG  28  -0.927 -14.302   6.266
  211   HH21  ARG  28          HH21      ARG  28  -3.877 -12.526   6.893
  212   HH22  ARG  28          HH22      ARG  28  -2.822 -13.803   7.427
  213    H    THR  29           HN       THR  29  -2.448  -8.396  -0.542
  214    HA   THR  29           HA       THR  29  -0.589  -8.985  -2.679
  215    HB   THR  29           HB       THR  29  -2.723  -6.850  -2.610
  216    HG1  THR  29           HG1      THR  29  -3.919  -8.595  -3.800
  217   HG21  THR  29          HG21      THR  29  -1.066  -6.641  -4.414
  218   HG22  THR  29          HG22      THR  29  -2.654  -7.071  -5.047
  219   HG23  THR  29          HG23      THR  29  -1.400  -8.302  -4.912
  220    H    THR  30           HN       THR  30   1.204  -7.877  -3.114
  221    HA   THR  30           HA       THR  30   1.731  -5.403  -1.627
  222    HB   THR  30           HB       THR  30   4.131  -5.864  -2.277
  223    HG1  THR  30           HG1      THR  30   3.379  -7.432  -3.983
  224   HG21  THR  30          HG21      THR  30   3.225  -6.383  -0.048
  225   HG22  THR  30          HG22      THR  30   4.458  -7.544  -0.540
  226   HG23  THR  30          HG23      THR  30   2.752  -7.980  -0.623
  227    H    GLN  31           HN       GLN  31   1.947  -3.511  -2.684
  228    HA   GLN  31           HA       GLN  31   2.461  -3.556  -5.577
  229    HB2  GLN  31           HB2      GLN  31   0.039  -3.349  -5.301
  230    HB3  GLN  31           HB1      GLN  31   0.261  -2.004  -4.192
  231    HG2  GLN  31           HG2      GLN  31   1.175  -0.650  -5.976
  232    HG3  GLN  31           HG1      GLN  31   1.026  -2.001  -7.100
  233   HE21  GLN  31          HE21      GLN  31  -0.703   0.370  -5.221
  234   HE22  GLN  31          HE22      GLN  31  -2.203   0.231  -6.069
  235    H    TRP  32           HN       TRP  32   3.783  -1.927  -6.290
  236    HA   TRP  32           HA       TRP  32   5.152  -0.377  -4.291
  237    HB2  TRP  32           HB2      TRP  32   5.452  -0.269  -7.301
  238    HB3  TRP  32           HB1      TRP  32   6.570   0.393  -6.120
  239    HD1  TRP  32           HD1      TRP  32   6.119  -2.549  -8.232
  240    HE1  TRP  32           HE1      TRP  32   7.625  -4.500  -7.472
  241    HE3  TRP  32           HE3      TRP  32   7.493  -0.773  -3.638
  242    HZ2  TRP  32           HZ2      TRP  32   9.184  -5.184  -5.233
  243    HZ3  TRP  32           HZ3      TRP  32   9.002  -2.142  -2.252
  244    HH2  TRP  32           HH2      TRP  32   9.828  -4.301  -3.034
  245    H    LYS  33           HN       LYS  33   2.568   0.144  -6.532
  246    HA   LYS  33           HA       LYS  33   2.782   3.002  -6.620
  247    HB2  LYS  33           HB2      LYS  33   0.539   1.132  -7.373
  248    HB3  LYS  33           HB1      LYS  33   0.438   2.877  -7.532
  249    HG2  LYS  33           HG2      LYS  33   2.398   2.786  -9.045
  250    HG3  LYS  33           HG1      LYS  33   2.293   1.022  -8.987
  251    HD2  LYS  33           HD2      LYS  33   0.034   1.109  -9.873
  252    HD3  LYS  33           HD1      LYS  33   0.072   2.872  -9.863
  253    HE2  LYS  33           HE2      LYS  33   1.971   2.773 -11.466
  254    HE3  LYS  33           HE1      LYS  33   1.764   1.023 -11.535
  255    HZ1  LYS  33           HZ1      LYS  33   0.615   1.994 -13.376
  256    HZ2  LYS  33           HZ2      LYS  33  -0.204   3.089 -12.368
  257    HZ3  LYS  33           HZ3      LYS  33  -0.554   1.432 -12.277
  258    H    ARG  34           HN       ARG  34   0.914   4.374  -5.944
  259    HA   ARG  34           HA       ARG  34   0.154   3.781  -3.199
  260    HB2  ARG  34           HB2      ARG  34  -0.581   6.208  -4.852
  261    HB3  ARG  34           HB1      ARG  34  -0.623   6.054  -3.102
  262    HG2  ARG  34           HG2      ARG  34   1.842   6.092  -4.832
  263    HG3  ARG  34           HG1      ARG  34   1.274   7.392  -3.781
  264    HD2  ARG  34           HD2      ARG  34   1.562   5.936  -1.838
  265    HD3  ARG  34           HD1      ARG  34   2.131   4.644  -2.892
  266    HE   ARG  34           HE       ARG  34   3.578   7.207  -2.714
  267   HH11  ARG  34          HH11      ARG  34   3.464   3.722  -2.503
  268   HH12  ARG  34          HH12      ARG  34   5.160   3.536  -2.190
  269   HH21  ARG  34          HH21      ARG  34   5.816   6.998  -2.322
  270   HH22  ARG  34          HH22      ARG  34   6.510   5.425  -2.109
  271    HA   PRO  35           HA       PRO  35  -3.526   1.853  -5.025
  272    HB2  PRO  35           HB2      PRO  35  -4.622   1.090  -2.626
  273    HB3  PRO  35           HB1      PRO  35  -3.399   0.156  -3.501
  274    HG2  PRO  35           HG2      PRO  35  -3.047   2.064  -1.220
  275    HG3  PRO  35           HG1      PRO  35  -2.294   0.478  -1.479
  276    HD2  PRO  35           HD2      PRO  35  -0.956   2.734  -1.977
  277    HD3  PRO  35           HD1      PRO  35  -0.775   1.316  -3.022
  278    H    SER  36           HN       SER  36  -5.010   3.216  -5.734
  279    HA   SER  36           HA       SER  36  -6.335   5.154  -4.073
  280    HB2  SER  36           HB2      SER  36  -7.107   4.016  -6.775
  281    HB3  SER  36           HB1      SER  36  -7.770   5.479  -6.043
  282    HG   SER  36           HG       SER  36  -5.006   5.371  -6.259
  283    HA   PRO  37           HA       PRO  37  -9.473   2.578  -2.344
  284    HB2  PRO  37           HB2      PRO  37 -11.744   4.178  -3.249
  285    HB3  PRO  37           HB1      PRO  37 -11.084   3.994  -1.622
  286    HG2  PRO  37           HG2      PRO  37 -10.864   6.300  -3.007
  287    HG3  PRO  37           HG1      PRO  37  -9.610   5.747  -1.880
  288    HD2  PRO  37           HD2      PRO  37  -9.698   5.508  -4.873
  289    HD3  PRO  37           HD1      PRO  37  -8.352   6.019  -3.826
  290    H    GLU  38           HN       GLU  38  -8.908   2.234  -5.332
  291    HA   GLU  38           HA       GLU  38 -11.364   1.080  -6.330
  292    HB2  GLU  38           HB2      GLU  38  -9.873   0.352  -8.247
  293    HB3  GLU  38           HB1      GLU  38  -9.984   2.089  -7.997
  294    HG2  GLU  38           HG2      GLU  38  -7.828   2.022  -6.800
  295    HG3  GLU  38           HG1      GLU  38  -7.723   0.297  -7.145
  296    H    ASP  39           HN       ASP  39 -11.598  -0.276  -4.488
  297    HA   ASP  39           HA       ASP  39 -10.402  -2.890  -4.921
  298    HB2  ASP  39           HB2      ASP  39  -8.874  -2.094  -3.281
  299    HB3  ASP  39           HB1      ASP  39 -10.155  -1.347  -2.334
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1  -3.934  19.047  -5.858
    2    H2   GLY   1           HT2      GLY   1  -3.905  17.598  -6.746
    3    H3   GLY   1           HT3      GLY   1  -2.545  18.609  -6.723
    4    HA2  GLY   1           HA1      GLY   1  -2.281  16.659  -5.282
    5    HA3  GLY   1           HA2      GLY   1  -2.159  18.189  -4.422
    6    H    SER   2           HN       SER   2  -2.724  15.866  -3.073
    7    HA   SER   2           HA       SER   2  -5.007  16.509  -1.605
    8    HB2  SER   2           HB2      SER   2  -6.265  15.758  -3.607
    9    HB3  SER   2           HB1      SER   2  -5.447  14.197  -3.528
   10    HG   SER   2           HG       SER   2  -6.377  14.158  -1.280
   11    HA   PRO   3           HA       PRO   3  -2.481  13.725   0.943
   12    HB2  PRO   3           HB2      PRO   3  -4.774  14.266   2.766
   13    HB3  PRO   3           HB1      PRO   3  -3.037  14.379   3.078
   14    HG2  PRO   3           HG2      PRO   3  -4.512  16.577   2.768
   15    HG3  PRO   3           HG1      PRO   3  -2.868  16.478   2.111
   16    HD2  PRO   3           HD2      PRO   3  -5.491  16.255   0.695
   17    HD3  PRO   3           HD1      PRO   3  -3.983  17.028   0.164
   18    H    SER   4           HN       SER   4  -2.717  11.685   0.211
   19    HA   SER   4           HA       SER   4  -5.387  10.633  -0.222
   20    HB2  SER   4           HB2      SER   4  -3.799  10.417  -2.030
   21    HB3  SER   4           HB1      SER   4  -2.656   9.578  -0.983
   22    HG   SER   4           HG       SER   4  -4.819   8.173  -0.795
   23    HA   PRO   5           HA       PRO   5  -5.095   7.966   3.401
   24    HB2  PRO   5           HB2      PRO   5  -7.699   7.239   3.307
   25    HB3  PRO   5           HB1      PRO   5  -7.174   8.761   4.044
   26    HG2  PRO   5           HG2      PRO   5  -8.319   8.264   1.322
   27    HG3  PRO   5           HG1      PRO   5  -8.692   9.565   2.467
   28    HD2  PRO   5           HD2      PRO   5  -7.032   9.896   0.344
   29    HD3  PRO   5           HD1      PRO   5  -6.844  10.792   1.862
   30    H    LEU   6           HN       LEU   6  -5.730   5.571   3.499
   31    HA   LEU   6           HA       LEU   6  -5.594   4.480   0.780
   32    HB2  LEU   6           HB2      LEU   6  -4.359   2.529   1.863
   33    HB3  LEU   6           HB1      LEU   6  -3.493   4.025   1.588
   34    HG   LEU   6           HG       LEU   6  -3.909   4.588   4.014
   35   HD11  LEU   6          HD11      LEU   6  -5.754   3.052   4.433
   36   HD12  LEU   6          HD12      LEU   6  -4.410   2.753   5.534
   37   HD13  LEU   6          HD13      LEU   6  -4.680   1.679   4.163
   38   HD21  LEU   6          HD21      LEU   6  -1.756   3.839   3.214
   39   HD22  LEU   6          HD22      LEU   6  -2.266   2.155   3.327
   40   HD23  LEU   6          HD23      LEU   6  -2.087   3.121   4.792
   41    HA   PRO   7           HA       PRO   7  -9.160   2.041   1.344
   42    HB2  PRO   7           HB2      PRO   7  -7.675  -0.228   0.151
   43    HB3  PRO   7           HB1      PRO   7  -9.134   0.585  -0.411
   44    HG2  PRO   7           HG2      PRO   7  -6.838   0.967  -1.676
   45    HG3  PRO   7           HG1      PRO   7  -7.971   2.304  -1.409
   46    HD2  PRO   7           HD2      PRO   7  -5.474   1.620   0.103
   47    HD3  PRO   7           HD1      PRO   7  -6.037   3.202  -0.478
   48    HA   PRO   8           HA       PRO   8  -9.005  -0.317   5.000
   49    HB2  PRO   8           HB2      PRO   8 -10.850  -2.288   4.549
   50    HB3  PRO   8           HB1      PRO   8 -11.266  -0.617   4.941
   51    HG2  PRO   8           HG2      PRO   8 -11.176  -1.972   2.277
   52    HG3  PRO   8           HG1      PRO   8 -12.374  -0.829   2.911
   53    HD2  PRO   8           HD2      PRO   8 -10.450  -0.066   1.190
   54    HD3  PRO   8           HD1      PRO   8 -11.032   1.005   2.481
   55    H    GLY   9           HN       GLY   9  -7.287  -1.488   5.502
   56    HA2  GLY   9           HA2      GLY   9  -6.396  -3.662   5.884
   57    HA3  GLY   9           HA1      GLY   9  -7.080  -4.175   4.346
   58    H    TRP  10           HN       TRP  10  -5.848  -1.277   3.580
   59    HA   TRP  10           HA       TRP  10  -3.452  -2.480   2.511
   60    HB2  TRP  10           HB2      TRP  10  -4.886   0.088   2.074
   61    HB3  TRP  10           HB1      TRP  10  -3.163   0.023   1.692
   62    HD1  TRP  10           HD1      TRP  10  -6.516  -1.479   0.620
   63    HE1  TRP  10           HE1      TRP  10  -6.227  -2.566  -1.694
   64    HE3  TRP  10           HE3      TRP  10  -1.462  -1.019   0.166
   65    HZ2  TRP  10           HZ2      TRP  10  -4.113  -3.151  -3.478
   66    HZ3  TRP  10           HZ3      TRP  10  -0.372  -1.873  -1.868
   67    HH2  TRP  10           HH2      TRP  10  -1.672  -2.920  -3.657
   68    H    GLU  11           HN       GLU  11  -1.540  -2.366   3.208
   69    HA   GLU  11           HA       GLU  11  -1.019  -0.888   5.686
   70    HB2  GLU  11           HB2      GLU  11  -0.855  -3.251   5.931
   71    HB3  GLU  11           HB1      GLU  11   0.052  -3.408   4.437
   72    HG2  GLU  11           HG2      GLU  11   1.625  -3.708   6.093
   73    HG3  GLU  11           HG1      GLU  11   1.832  -2.031   5.572
   74    H    GLU  12           HN       GLU  12   0.328   0.832   5.525
   75    HA   GLU  12           HA       GLU  12   1.899   1.177   3.104
   76    HB2  GLU  12           HB2      GLU  12   0.608   3.079   3.969
   77    HB3  GLU  12           HB1      GLU  12   1.516   3.016   5.475
   78    HG2  GLU  12           HG2      GLU  12   3.584   3.480   4.196
   79    HG3  GLU  12           HG1      GLU  12   2.598   3.676   2.746
   80    H    ARG  13           HN       ARG  13   3.790   0.104   3.073
   81    HA   ARG  13           HA       ARG  13   5.548   0.375   5.427
   82    HB2  ARG  13           HB2      ARG  13   5.302  -1.984   3.550
   83    HB3  ARG  13           HB1      ARG  13   6.487  -1.844   4.849
   84    HG2  ARG  13           HG2      ARG  13   3.499  -2.122   5.102
   85    HG3  ARG  13           HG1      ARG  13   4.746  -3.268   5.602
   86    HD2  ARG  13           HD2      ARG  13   4.248  -0.535   6.784
   87    HD3  ARG  13           HD1      ARG  13   3.838  -2.081   7.519
   88    HE   ARG  13           HE       ARG  13   6.283  -2.528   7.577
   89   HH11  ARG  13          HH11      ARG  13   5.092   0.752   7.340
   90   HH12  ARG  13          HH12      ARG  13   6.465   1.462   8.138
   91   HH21  ARG  13          HH21      ARG  13   8.094  -1.637   8.657
   92   HH22  ARG  13          HH22      ARG  13   8.186   0.086   8.905
   93    H    GLN  14           HN       GLN  14   7.901   0.041   4.829
   94    HA   GLN  14           HA       GLN  14   8.438   0.899   2.077
   95    HB2  GLN  14           HB2      GLN  14  10.342   2.312   2.957
   96    HB3  GLN  14           HB1      GLN  14   8.732   2.923   3.291
   97    HG2  GLN  14           HG2      GLN  14   9.748   3.261   5.310
   98    HG3  GLN  14           HG1      GLN  14   9.047   1.666   5.566
   99   HE21  GLN  14          HE21      GLN  14  11.837   2.273   3.567
  100   HE22  GLN  14          HE22      GLN  14  12.976   1.466   4.579
  101    H    ASP  15           HN       ASP  15  10.154  -0.015   1.093
  102    HA   ASP  15           HA       ASP  15  11.245  -2.369   2.413
  103    HB2  ASP  15           HB2      ASP  15  10.242  -2.331   0.048
  104    HB3  ASP  15           HB1      ASP  15  11.732  -1.514  -0.405
  105    H    VAL  16           HN       VAL  16  13.582  -2.871   2.028
  106    HA   VAL  16           HA       VAL  16  15.264  -0.736   2.820
  107    HB   VAL  16           HB       VAL  16  17.133  -2.290   2.385
  108   HG11  VAL  16          HG11      VAL  16  16.005  -2.294   4.535
  109   HG12  VAL  16          HG12      VAL  16  16.522  -3.925   4.107
  110   HG13  VAL  16          HG13      VAL  16  14.829  -3.462   3.930
  111   HG21  VAL  16          HG21      VAL  16  16.704  -4.593   1.718
  112   HG22  VAL  16          HG22      VAL  16  16.199  -3.474   0.451
  113   HG23  VAL  16          HG23      VAL  16  14.993  -4.222   1.499
  114    H    LEU  17           HN       LEU  17  14.179  -1.929  -0.218
  115    HA   LEU  17           HA       LEU  17  16.098  -0.763  -1.924
  116    HB2  LEU  17           HB2      LEU  17  13.151  -1.266  -2.350
  117    HB3  LEU  17           HB1      LEU  17  14.255  -0.771  -3.616
  118    HG   LEU  17           HG       LEU  17  14.477  -3.343  -2.055
  119   HD11  LEU  17          HD11      LEU  17  12.497  -3.347  -3.463
  120   HD12  LEU  17          HD12      LEU  17  13.731  -4.395  -4.161
  121   HD13  LEU  17          HD13      LEU  17  13.446  -2.793  -4.841
  122   HD21  LEU  17          HD21      LEU  17  16.628  -2.547  -2.854
  123   HD22  LEU  17          HD22      LEU  17  15.962  -2.302  -4.469
  124   HD23  LEU  17          HD23      LEU  17  16.106  -3.934  -3.812
  125    H    GLY  18           HN       GLY  18  13.374   0.547  -0.152
  126    HA2  GLY  18           HA2      GLY  18  13.385   2.878   0.442
  127    HA3  GLY  18           HA1      GLY  18  14.171   3.230  -1.100
  128    H    ARG  19           HN       ARG  19  12.178   1.064  -2.121
  129    HA   ARG  19           HA       ARG  19  10.109   2.846  -2.959
  130    HB2  ARG  19           HB2      ARG  19   9.775  -0.117  -3.006
  131    HB3  ARG  19           HB1      ARG  19   9.211   1.079  -4.161
  132    HG2  ARG  19           HG2      ARG  19  12.005   0.032  -3.819
  133    HG3  ARG  19           HG1      ARG  19  10.894  -0.226  -5.158
  134    HD2  ARG  19           HD2      ARG  19  11.429   2.576  -4.619
  135    HD3  ARG  19           HD1      ARG  19  12.858   1.653  -5.075
  136    HE   ARG  19           HE       ARG  19  10.413   1.842  -6.710
  137   HH11  ARG  19          HH11      ARG  19  13.891   1.631  -6.374
  138   HH12  ARG  19          HH12      ARG  19  14.190   1.484  -8.083
  139   HH21  ARG  19          HH21      ARG  19  10.799   1.668  -8.981
  140   HH22  ARG  19          HH22      ARG  19  12.425   1.493  -9.556
  141    H    THR  20           HN       THR  20   8.169   3.236  -1.867
  142    HA   THR  20           HA       THR  20   7.746   1.914   0.638
  143    HB   THR  20           HB       THR  20   5.335   3.089   0.006
  144    HG1  THR  20           HG1      THR  20   6.865   5.194  -0.747
  145   HG21  THR  20          HG21      THR  20   6.521   3.367   2.109
  146   HG22  THR  20          HG22      THR  20   6.114   4.950   1.448
  147   HG23  THR  20          HG23      THR  20   7.761   4.335   1.310
  148    H    TYR  21           HN       TYR  21   7.276  -0.177   0.597
  149    HA   TYR  21           HA       TYR  21   5.471  -1.143  -1.495
  150    HB2  TYR  21           HB2      TYR  21   6.266  -3.314  -1.168
  151    HB3  TYR  21           HB1      TYR  21   7.701  -2.327  -0.943
  152    HD1  TYR  21           HD2      TYR  21   8.582  -1.961   1.368
  153    HD2  TYR  21           HD1      TYR  21   5.429  -4.715   0.582
  154    HE1  TYR  21           HE2      TYR  21   8.967  -3.023   3.552
  155    HE2  TYR  21           HE1      TYR  21   5.812  -5.776   2.769
  156    HH   TYR  21           HH       TYR  21   7.751  -4.353   5.191
  157    H    TYR  22           HN       TYR  22   3.419  -1.578  -1.084
  158    HA   TYR  22           HA       TYR  22   2.629  -1.608   1.748
  159    HB2  TYR  22           HB2      TYR  22   0.664  -1.129  -0.420
  160    HB3  TYR  22           HB1      TYR  22   0.651  -0.550   1.223
  161    HD1  TYR  22           HD1      TYR  22   2.429   1.247   1.828
  162    HD2  TYR  22           HD2      TYR  22   1.298   0.282  -2.154
  163    HE1  TYR  22           HE1      TYR  22   3.272   3.422   1.068
  164    HE2  TYR  22           HE2      TYR  22   2.147   2.456  -2.928
  165    HH   TYR  22           HH       TYR  22   4.188   4.339  -1.249
  166    H    VAL  23           HN       VAL  23   1.130  -3.159   2.446
  167    HA   VAL  23           HA       VAL  23   0.647  -5.327   0.530
  168    HB   VAL  23           HB       VAL  23   2.387  -6.092   2.014
  169   HG11  VAL  23          HG11      VAL  23   2.093  -6.269   4.424
  170   HG12  VAL  23          HG12      VAL  23   0.518  -5.489   4.302
  171   HG13  VAL  23          HG13      VAL  23   1.981  -4.588   3.898
  172   HG21  VAL  23          HG21      VAL  23   0.775  -7.757   1.327
  173   HG22  VAL  23          HG22      VAL  23  -0.273  -7.348   2.686
  174   HG23  VAL  23          HG23      VAL  23   1.304  -8.086   2.976
  175    H    ASN  24           HN       ASN  24  -1.393  -5.645   0.169
  176    HA   ASN  24           HA       ASN  24  -3.462  -4.637   1.873
  177    HB2  ASN  24           HB2      ASN  24  -3.836  -4.806  -0.530
  178    HB3  ASN  24           HB1      ASN  24  -3.544  -6.543  -0.482
  179   HD21  ASN  24          HD21      ASN  24  -5.774  -3.984   0.270
  180   HD22  ASN  24          HD22      ASN  24  -7.149  -4.994   0.547
  181    H    HIS  25           HN       HIS  25  -4.116  -5.578   3.717
  182    HA   HIS  25           HA       HIS  25  -2.956  -8.010   4.585
  183    HB2  HIS  25           HB2      HIS  25  -5.020  -6.164   5.719
  184    HB3  HIS  25           HB1      HIS  25  -4.711  -7.711   6.493
  185    HD1  HIS  25           HD1      HIS  25  -2.869  -7.753   8.141
  186    HD2  HIS  25           HD2      HIS  25  -2.610  -4.473   5.598
  187    HE1  HIS  25           HE1      HIS  25  -0.982  -6.344   9.040
  188    HE2  HIS  25           HE2      HIS  25  -0.977  -4.276   7.606
  189    H    GLU  26           HN       GLU  26  -5.697  -7.542   2.644
  190    HA   GLU  26           HA       GLU  26  -7.158  -9.824   3.654
  191    HB2  GLU  26           HB2      GLU  26  -8.315  -7.829   2.731
  192    HB3  GLU  26           HB1      GLU  26  -7.625  -8.182   1.156
  193    HG2  GLU  26           HG2      GLU  26  -9.173 -10.354   2.411
  194    HG3  GLU  26           HG1      GLU  26 -10.081  -8.931   1.907
  195    H    SER  27           HN       SER  27  -5.627  -9.038   0.513
  196    HA   SER  27           HA       SER  27  -5.569 -11.914  -0.074
  197    HB2  SER  27           HB2      SER  27  -6.593 -10.293  -1.703
  198    HB3  SER  27           HB1      SER  27  -4.989  -9.604  -1.942
  199    HG   SER  27           HG       SER  27  -5.780 -11.328  -3.449
  200    H    ARG  28           HN       ARG  28  -3.620  -9.567   1.179
  201    HA   ARG  28           HA       ARG  28  -1.436  -9.437   1.751
  202    HB2  ARG  28           HB2      ARG  28  -1.193 -12.223   0.619
  203    HB3  ARG  28           HB1      ARG  28  -0.038 -11.432   1.679
  204    HG2  ARG  28           HG2      ARG  28  -1.698 -11.382   3.463
  205    HG3  ARG  28           HG1      ARG  28  -2.873 -12.152   2.395
  206    HD2  ARG  28           HD2      ARG  28  -0.306 -13.318   3.459
  207    HD3  ARG  28           HD1      ARG  28  -1.950 -13.858   3.787
  208    HE   ARG  28           HE       ARG  28  -0.767 -14.023   1.089
  209   HH11  ARG  28          HH11      ARG  28  -2.531 -15.443   3.753
  210   HH12  ARG  28          HH12      ARG  28  -2.705 -16.984   2.973
  211   HH21  ARG  28          HH21      ARG  28  -1.045 -16.029   0.045
  212   HH22  ARG  28          HH22      ARG  28  -1.904 -17.310   0.850
  213    H    THR  29           HN       THR  29  -2.428  -8.676  -0.909
  214    HA   THR  29           HA       THR  29  -0.318  -9.103  -2.788
  215    HB   THR  29           HB       THR  29  -2.367  -6.882  -2.842
  216    HG1  THR  29           HG1      THR  29  -2.651  -9.503  -3.951
  217   HG21  THR  29          HG21      THR  29  -0.550  -6.708  -4.479
  218   HG22  THR  29          HG22      THR  29  -2.093  -7.051  -5.266
  219   HG23  THR  29          HG23      THR  29  -0.906  -8.339  -5.050
  220    H    THR  30           HN       THR  30   1.655  -8.238  -2.536
  221    HA   THR  30           HA       THR  30   1.982  -5.637  -1.274
  222    HB   THR  30           HB       THR  30   4.449  -6.094  -1.776
  223    HG1  THR  30           HG1      THR  30   3.925  -7.785  -3.358
  224   HG21  THR  30          HG21      THR  30   2.946  -7.997   0.034
  225   HG22  THR  30          HG22      THR  30   3.489  -6.371   0.449
  226   HG23  THR  30          HG23      THR  30   4.672  -7.638   0.126
  227    H    GLN  31           HN       GLN  31   2.102  -3.807  -2.378
  228    HA   GLN  31           HA       GLN  31   2.704  -3.928  -5.255
  229    HB2  GLN  31           HB2      GLN  31   0.264  -3.805  -4.853
  230    HB3  GLN  31           HB1      GLN  31   0.501  -2.310  -3.963
  231    HG2  GLN  31           HG2      GLN  31   1.285  -1.207  -5.957
  232    HG3  GLN  31           HG1      GLN  31   1.181  -2.715  -6.864
  233   HE21  GLN  31          HE21      GLN  31  -0.622  -0.136  -5.374
  234   HE22  GLN  31          HE22      GLN  31  -2.132  -0.490  -6.146
  235    H    TRP  32           HN       TRP  32   3.988  -2.293  -6.027
  236    HA   TRP  32           HA       TRP  32   5.231  -0.521  -4.106
  237    HB2  TRP  32           HB2      TRP  32   5.619  -0.554  -7.110
  238    HB3  TRP  32           HB1      TRP  32   6.699   0.140  -5.908
  239    HD1  TRP  32           HD1      TRP  32   6.138  -2.939  -7.866
  240    HE1  TRP  32           HE1      TRP  32   7.740  -4.802  -7.110
  241    HE3  TRP  32           HE3      TRP  32   7.794  -0.842  -3.526
  242    HZ2  TRP  32           HZ2      TRP  32   9.472  -5.313  -4.940
  243    HZ3  TRP  32           HZ3      TRP  32   9.423  -2.074  -2.164
  244    HH2  TRP  32           HH2      TRP  32  10.239  -4.273  -2.853
  245    H    LYS  33           HN       LYS  33   2.705  -0.426  -6.430
  246    HA   LYS  33           HA       LYS  33   2.717   2.423  -6.785
  247    HB2  LYS  33           HB2      LYS  33   1.956   1.064  -8.624
  248    HB3  LYS  33           HB1      LYS  33   0.758   0.272  -7.612
  249    HG2  LYS  33           HG2      LYS  33  -0.292   1.873  -9.082
  250    HG3  LYS  33           HG1      LYS  33  -0.447   2.394  -7.405
  251    HD2  LYS  33           HD2      LYS  33   1.409   3.953  -7.715
  252    HD3  LYS  33           HD1      LYS  33   1.579   3.426  -9.393
  253    HE2  LYS  33           HE2      LYS  33  -0.827   4.784  -8.170
  254    HE3  LYS  33           HE1      LYS  33   0.338   5.519  -9.271
  255    HZ1  LYS  33           HZ1      LYS  33  -1.661   4.847 -10.441
  256    HZ2  LYS  33           HZ2      LYS  33  -1.466   3.252  -9.913
  257    HZ3  LYS  33           HZ3      LYS  33  -0.335   3.931 -10.972
  258    H    ARG  34           HN       ARG  34   1.699   3.891  -5.611
  259    HA   ARG  34           HA       ARG  34   0.408   3.446  -3.189
  260    HB2  ARG  34           HB2      ARG  34   1.365   5.609  -3.955
  261    HB3  ARG  34           HB1      ARG  34   0.042   5.770  -5.100
  262    HG2  ARG  34           HG2      ARG  34  -0.420   7.135  -3.192
  263    HG3  ARG  34           HG1      ARG  34  -1.537   5.765  -3.186
  264    HD2  ARG  34           HD2      ARG  34  -0.177   4.618  -1.555
  265    HD3  ARG  34           HD1      ARG  34   1.023   5.904  -1.612
  266    HE   ARG  34           HE       ARG  34  -1.627   6.761  -0.843
  267   HH11  ARG  34          HH11      ARG  34   1.499   5.622   0.190
  268   HH12  ARG  34          HH12      ARG  34   1.325   6.185   1.831
  269   HH21  ARG  34          HH21      ARG  34  -1.864   7.578   1.312
  270   HH22  ARG  34          HH22      ARG  34  -0.573   7.331   2.444
  271    HA   PRO  35           HA       PRO  35  -3.557   2.009  -4.770
  272    HB2  PRO  35           HB2      PRO  35  -4.795   1.796  -2.354
  273    HB3  PRO  35           HB1      PRO  35  -3.667   0.575  -2.967
  274    HG2  PRO  35           HG2      PRO  35  -3.185   2.769  -0.995
  275    HG3  PRO  35           HG1      PRO  35  -2.609   1.093  -0.969
  276    HD2  PRO  35           HD2      PRO  35  -1.056   3.187  -1.750
  277    HD3  PRO  35           HD1      PRO  35  -0.859   1.546  -2.389
  278    H    SER  36           HN       SER  36  -4.818   3.508  -5.690
  279    HA   SER  36           HA       SER  36  -5.432   6.027  -4.654
  280    HB2  SER  36           HB2      SER  36  -7.099   4.326  -6.529
  281    HB3  SER  36           HB1      SER  36  -7.215   6.077  -6.338
  282    HG   SER  36           HG       SER  36  -5.936   5.372  -8.164
  283    HA   PRO  37           HA       PRO  37  -8.200   5.018  -1.413
  284    HB2  PRO  37           HB2      PRO  37  -9.659   7.509  -1.722
  285    HB3  PRO  37           HB1      PRO  37  -8.485   7.064  -0.480
  286    HG2  PRO  37           HG2      PRO  37  -8.006   8.951  -2.387
  287    HG3  PRO  37           HG1      PRO  37  -6.726   7.980  -1.638
  288    HD2  PRO  37           HD2      PRO  37  -8.064   7.636  -4.295
  289    HD3  PRO  37           HD1      PRO  37  -6.346   7.458  -3.868
  290    H    GLU  38           HN       GLU  38  -9.087   4.484  -4.309
  291    HA   GLU  38           HA       GLU  38 -11.967   4.760  -4.140
  292    HB2  GLU  38           HB2      GLU  38 -11.896   3.512  -6.330
  293    HB3  GLU  38           HB1      GLU  38 -11.025   5.040  -6.322
  294    HG2  GLU  38           HG2      GLU  38  -8.923   3.939  -6.205
  295    HG3  GLU  38           HG1      GLU  38  -9.687   2.387  -5.872
  296    H    ASP  39           HN       ASP  39 -11.985   3.543  -2.120
  297    HA   ASP  39           HA       ASP  39 -12.978   0.964  -2.401
  298    HB2  ASP  39           HB2      ASP  39 -10.615   0.377  -2.932
  299    HB3  ASP  39           HB1      ASP  39 -10.134   0.965  -1.344
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1   2.426   8.077   9.191
    2    H2   GLY   1           HT2      GLY   1   2.616   8.186   7.504
    3    H3   GLY   1           HT3      GLY   1   1.404   7.202   8.160
    4    HA2  GLY   1           HA1      GLY   1   1.527  10.149   8.467
    5    HA3  GLY   1           HA2      GLY   1   0.535   9.318   7.275
    6    H    SER   2           HN       SER   2  -0.876  10.865   8.829
    7    HA   SER   2           HA       SER   2  -1.984   9.071  10.880
    8    HB2  SER   2           HB2      SER   2  -2.064  12.100  10.844
    9    HB3  SER   2           HB1      SER   2  -2.808  11.070  12.067
   10    HG   SER   2           HG       SER   2  -0.955  11.118  13.033
   11    HA   PRO   3           HA       PRO   3  -5.832  10.660   8.675
   12    HB2  PRO   3           HB2      PRO   3  -5.850  12.828   7.114
   13    HB3  PRO   3           HB1      PRO   3  -5.805  12.961   8.874
   14    HG2  PRO   3           HG2      PRO   3  -3.652  13.413   6.894
   15    HG3  PRO   3           HG1      PRO   3  -3.895  14.150   8.485
   16    HD2  PRO   3           HD2      PRO   3  -2.157  12.000   7.823
   17    HD3  PRO   3           HD1      PRO   3  -2.514  12.638   9.438
   18    H    SER   4           HN       SER   4  -3.423   9.354   7.298
   19    HA   SER   4           HA       SER   4  -3.502   9.707   4.538
   20    HB2  SER   4           HB2      SER   4  -2.855   7.141   6.002
   21    HB3  SER   4           HB1      SER   4  -2.259   7.645   4.420
   22    HG   SER   4           HG       SER   4  -1.112   9.299   5.412
   23    HA   PRO   5           HA       PRO   5  -7.398   7.635   3.766
   24    HB2  PRO   5           HB2      PRO   5  -7.483   8.567   1.127
   25    HB3  PRO   5           HB1      PRO   5  -8.181   9.367   2.534
   26    HG2  PRO   5           HG2      PRO   5  -6.007  10.266   0.959
   27    HG3  PRO   5           HG1      PRO   5  -6.591  10.969   2.475
   28    HD2  PRO   5           HD2      PRO   5  -4.283   9.171   1.988
   29    HD3  PRO   5           HD1      PRO   5  -4.532  10.374   3.271
   30    H    LEU   6           HN       LEU   6  -6.429   5.519   3.818
   31    HA   LEU   6           HA       LEU   6  -5.746   4.476   1.148
   32    HB2  LEU   6           HB2      LEU   6  -4.926   3.420   3.858
   33    HB3  LEU   6           HB1      LEU   6  -4.518   2.686   2.317
   34    HG   LEU   6           HG       LEU   6  -3.631   5.410   3.262
   35   HD11  LEU   6          HD11      LEU   6  -2.096   2.827   2.971
   36   HD12  LEU   6          HD12      LEU   6  -2.539   3.608   4.488
   37   HD13  LEU   6          HD13      LEU   6  -1.403   4.393   3.392
   38   HD21  LEU   6          HD21      LEU   6  -2.872   3.871   0.777
   39   HD22  LEU   6          HD22      LEU   6  -2.211   5.429   1.284
   40   HD23  LEU   6          HD23      LEU   6  -3.913   5.297   0.831
   41    HA   PRO   7           HA       PRO   7  -9.277   1.814   1.296
   42    HB2  PRO   7           HB2      PRO   7  -7.679  -0.378   0.241
   43    HB3  PRO   7           HB1      PRO   7  -9.007   0.482  -0.508
   44    HG2  PRO   7           HG2      PRO   7  -6.399   0.698  -1.275
   45    HG3  PRO   7           HG1      PRO   7  -7.621   1.944  -1.555
   46    HD2  PRO   7           HD2      PRO   7  -5.412   1.869   0.404
   47    HD3  PRO   7           HD1      PRO   7  -6.224   3.262  -0.329
   48    HA   PRO   8           HA       PRO   8  -9.001  -0.608   4.987
   49    HB2  PRO   8           HB2      PRO   8 -10.779  -2.633   4.335
   50    HB3  PRO   8           HB1      PRO   8 -11.238  -1.058   4.987
   51    HG2  PRO   8           HG2      PRO   8 -11.242  -2.015   2.158
   52    HG3  PRO   8           HG1      PRO   8 -12.414  -0.981   2.992
   53    HD2  PRO   8           HD2      PRO   8 -10.603   0.030   1.296
   54    HD3  PRO   8           HD1      PRO   8 -11.092   0.909   2.762
   55    H    GLY   9           HN       GLY   9  -7.295  -1.819   5.455
   56    HA2  GLY   9           HA2      GLY   9  -6.328  -3.994   5.595
   57    HA3  GLY   9           HA1      GLY   9  -6.944  -4.340   3.986
   58    H    TRP  10           HN       TRP  10  -5.912  -1.465   3.319
   59    HA   TRP  10           HA       TRP  10  -3.272  -2.363   2.469
   60    HB2  TRP  10           HB2      TRP  10  -5.003   0.006   1.823
   61    HB3  TRP  10           HB1      TRP  10  -3.297   0.006   1.394
   62    HD1  TRP  10           HD1      TRP  10  -6.598  -1.769   0.524
   63    HE1  TRP  10           HE1      TRP  10  -6.309  -2.929  -1.759
   64    HE3  TRP  10           HE3      TRP  10  -1.605  -0.958  -0.173
   65    HZ2  TRP  10           HZ2      TRP  10  -4.229  -3.425  -3.604
   66    HZ3  TRP  10           HZ3      TRP  10  -0.547  -1.803  -2.221
   67    HH2  TRP  10           HH2      TRP  10  -1.827  -3.010  -3.903
   68    H    GLU  11           HN       GLU  11  -1.435  -1.871   3.510
   69    HA   GLU  11           HA       GLU  11  -1.444   0.540   5.209
   70    HB2  GLU  11           HB2      GLU  11   0.000  -0.597   6.806
   71    HB3  GLU  11           HB1      GLU  11  -1.508  -1.476   6.609
   72    HG2  GLU  11           HG2      GLU  11  -0.491  -3.191   5.425
   73    HG3  GLU  11           HG1      GLU  11   0.937  -2.218   5.055
   74    H    GLU  12           HN       GLU  12   0.675   1.467   5.582
   75    HA   GLU  12           HA       GLU  12   2.270   1.476   3.145
   76    HB2  GLU  12           HB2      GLU  12   1.597   3.632   4.065
   77    HB3  GLU  12           HB1      GLU  12   2.291   3.211   5.624
   78    HG2  GLU  12           HG2      GLU  12   4.521   3.045   4.381
   79    HG3  GLU  12           HG1      GLU  12   3.710   3.899   3.071
   80    H    ARG  13           HN       ARG  13   4.048   0.234   3.017
   81    HA   ARG  13           HA       ARG  13   5.649  -0.203   5.453
   82    HB2  ARG  13           HB2      ARG  13   4.791  -2.196   3.363
   83    HB3  ARG  13           HB1      ARG  13   6.168  -2.490   4.420
   84    HG2  ARG  13           HG2      ARG  13   3.358  -1.975   5.373
   85    HG3  ARG  13           HG1      ARG  13   4.053  -3.576   5.135
   86    HD2  ARG  13           HD2      ARG  13   4.262  -3.127   7.437
   87    HD3  ARG  13           HD1      ARG  13   5.869  -2.877   6.764
   88    HE   ARG  13           HE       ARG  13   4.657  -0.409   6.731
   89   HH11  ARG  13          HH11      ARG  13   5.422  -2.790   9.178
   90   HH12  ARG  13          HH12      ARG  13   5.639  -1.607  10.430
   91   HH21  ARG  13          HH21      ARG  13   4.941   1.148   8.386
   92   HH22  ARG  13          HH22      ARG  13   5.374   0.615   9.983
   93    H    GLN  14           HN       GLN  14   7.933  -0.473   5.062
   94    HA   GLN  14           HA       GLN  14   8.769   0.480   2.397
   95    HB2  GLN  14           HB2      GLN  14  10.867   1.213   3.440
   96    HB3  GLN  14           HB1      GLN  14   9.479   1.992   4.177
   97    HG2  GLN  14           HG2      GLN  14   9.637   0.662   6.116
   98    HG3  GLN  14           HG1      GLN  14  10.768  -0.452   5.347
   99   HE21  GLN  14          HE21      GLN  14  12.923   0.134   5.128
  100   HE22  GLN  14          HE22      GLN  14  13.606   1.468   6.014
  101    H    ASP  15           HN       ASP  15  10.193  -0.700   1.212
  102    HA   ASP  15           HA       ASP  15  11.124  -3.209   2.412
  103    HB2  ASP  15           HB2      ASP  15   9.815  -2.979   0.081
  104    HB3  ASP  15           HB1      ASP  15  11.468  -2.743  -0.477
  105    H    VAL  16           HN       VAL  16  13.333  -3.895   1.487
  106    HA   VAL  16           HA       VAL  16  15.115  -1.798   2.313
  107    HB   VAL  16           HB       VAL  16  16.883  -3.410   2.141
  108   HG11  VAL  16          HG11      VAL  16  14.392  -4.666   3.278
  109   HG12  VAL  16          HG12      VAL  16  15.464  -3.537   4.109
  110   HG13  VAL  16          HG13      VAL  16  16.047  -5.141   3.660
  111   HG21  VAL  16          HG21      VAL  16  16.492  -5.691   1.292
  112   HG22  VAL  16          HG22      VAL  16  16.275  -4.467   0.038
  113   HG23  VAL  16          HG23      VAL  16  14.867  -5.213   0.797
  114    H    LEU  17           HN       LEU  17  13.655  -2.391  -0.550
  115    HA   LEU  17           HA       LEU  17  15.859  -1.706  -2.279
  116    HB2  LEU  17           HB2      LEU  17  12.891  -1.911  -2.805
  117    HB3  LEU  17           HB1      LEU  17  14.064  -1.471  -4.030
  118    HG   LEU  17           HG       LEU  17  15.182  -3.750  -3.399
  119   HD11  LEU  17          HD11      LEU  17  13.578  -5.454  -2.727
  120   HD12  LEU  17          HD12      LEU  17  12.345  -4.212  -2.496
  121   HD13  LEU  17          HD13      LEU  17  13.780  -4.231  -1.470
  122   HD21  LEU  17          HD21      LEU  17  12.606  -3.596  -4.962
  123   HD22  LEU  17          HD22      LEU  17  13.825  -4.860  -5.100
  124   HD23  LEU  17          HD23      LEU  17  14.214  -3.209  -5.573
  125    H    GLY  18           HN       GLY  18  13.499  -0.031  -0.378
  126    HA2  GLY  18           HA2      GLY  18  14.115   2.217   0.267
  127    HA3  GLY  18           HA1      GLY  18  14.730   2.469  -1.365
  128    H    ARG  19           HN       ARG  19  12.249   0.971  -2.313
  129    HA   ARG  19           HA       ARG  19  10.477   3.250  -2.199
  130    HB2  ARG  19           HB2      ARG  19   9.026   1.523  -3.653
  131    HB3  ARG  19           HB1      ARG  19  10.213   2.593  -4.329
  132    HG2  ARG  19           HG2      ARG  19  10.905  -0.195  -3.567
  133    HG3  ARG  19           HG1      ARG  19  10.183   0.196  -5.117
  134    HD2  ARG  19           HD2      ARG  19  12.156   1.975  -5.173
  135    HD3  ARG  19           HD1      ARG  19  12.911   0.802  -4.095
  136    HE   ARG  19           HE       ARG  19  11.758  -0.206  -6.576
  137   HH11  ARG  19          HH11      ARG  19  14.654   0.782  -4.852
  138   HH12  ARG  19          HH12      ARG  19  15.730  -0.071  -5.917
  139   HH21  ARG  19          HH21      ARG  19  13.175  -1.279  -7.999
  140   HH22  ARG  19          HH22      ARG  19  14.895  -1.187  -7.748
  141    H    THR  20           HN       THR  20   8.356   3.184  -1.375
  142    HA   THR  20           HA       THR  20   8.080   1.358   0.834
  143    HB   THR  20           HB       THR  20   5.883   2.671   1.113
  144    HG1  THR  20           HG1      THR  20   5.794   3.599  -0.947
  145   HG21  THR  20          HG21      THR  20   7.039   4.517   2.196
  146   HG22  THR  20          HG22      THR  20   8.514   4.117   1.314
  147   HG23  THR  20          HG23      THR  20   7.865   2.991   2.508
  148    H    TYR  21           HN       TYR  21   7.387  -0.630   0.388
  149    HA   TYR  21           HA       TYR  21   5.350  -1.029  -1.654
  150    HB2  TYR  21           HB2      TYR  21   5.635  -3.364  -1.375
  151    HB3  TYR  21           HB1      TYR  21   7.248  -2.680  -1.242
  152    HD1  TYR  21           HD2      TYR  21   8.319  -2.499   1.007
  153    HD2  TYR  21           HD1      TYR  21   4.671  -4.602   0.402
  154    HE1  TYR  21           HE2      TYR  21   8.627  -3.641   3.163
  155    HE2  TYR  21           HE1      TYR  21   4.970  -5.750   2.552
  156    HH   TYR  21           HH       TYR  21   7.334  -4.794   4.852
  157    H    TYR  22           HN       TYR  22   3.226  -1.033  -1.257
  158    HA   TYR  22           HA       TYR  22   2.352  -0.986   1.525
  159    HB2  TYR  22           HB2      TYR  22   0.569  -0.888  -0.899
  160    HB3  TYR  22           HB1      TYR  22   0.193  -0.363   0.731
  161    HD1  TYR  22           HD1      TYR  22   1.087   1.742   1.604
  162    HD2  TYR  22           HD2      TYR  22   1.775   0.544  -2.419
  163    HE1  TYR  22           HE1      TYR  22   1.746   4.037   1.040
  164    HE2  TYR  22           HE2      TYR  22   2.449   2.837  -2.996
  165    HH   TYR  22           HH       TYR  22   3.065   5.213  -0.619
  166    H    VAL  23           HN       VAL  23   0.872  -2.539   2.350
  167    HA   VAL  23           HA       VAL  23   0.639  -4.954   0.709
  168    HB   VAL  23           HB       VAL  23   2.342  -5.616   2.157
  169   HG11  VAL  23          HG11      VAL  23   2.355  -5.230   4.566
  170   HG12  VAL  23          HG12      VAL  23   0.837  -4.342   4.428
  171   HG13  VAL  23          HG13      VAL  23   2.297  -3.717   3.660
  172   HG21  VAL  23          HG21      VAL  23   0.554  -7.253   2.128
  173   HG22  VAL  23          HG22      VAL  23  -0.222  -6.458   3.502
  174   HG23  VAL  23          HG23      VAL  23   1.351  -7.241   3.702
  175    H    ASN  24           HN       ASN  24  -1.329  -5.647   0.465
  176    HA   ASN  24           HA       ASN  24  -3.466  -4.705   2.188
  177    HB2  ASN  24           HB2      ASN  24  -3.876  -4.856  -0.233
  178    HB3  ASN  24           HB1      ASN  24  -3.530  -6.586  -0.186
  179   HD21  ASN  24          HD21      ASN  24  -5.806  -4.096   0.611
  180   HD22  ASN  24          HD22      ASN  24  -7.133  -5.143   0.982
  181    H    HIS  25           HN       HIS  25  -4.272  -5.820   3.856
  182    HA   HIS  25           HA       HIS  25  -2.857  -8.114   4.758
  183    HB2  HIS  25           HB2      HIS  25  -5.246  -6.622   5.798
  184    HB3  HIS  25           HB1      HIS  25  -4.678  -8.092   6.577
  185    HD1  HIS  25           HD1      HIS  25  -4.636  -5.527   8.178
  186    HD2  HIS  25           HD2      HIS  25  -1.427  -6.830   5.882
  187    HE1  HIS  25           HE1      HIS  25  -2.600  -4.430   9.166
  188    HE2  HIS  25           HE2      HIS  25  -0.715  -5.045   7.611
  189    H    GLU  26           HN       GLU  26  -5.832  -7.775   2.963
  190    HA   GLU  26           HA       GLU  26  -6.933 -10.277   3.823
  191    HB2  GLU  26           HB2      GLU  26  -8.324  -8.393   2.983
  192    HB3  GLU  26           HB1      GLU  26  -7.644  -8.655   1.379
  193    HG2  GLU  26           HG2      GLU  26  -8.567 -10.930   1.384
  194    HG3  GLU  26           HG1      GLU  26  -9.299 -10.617   2.956
  195    H    SER  27           HN       SER  27  -5.628  -9.163   0.705
  196    HA   SER  27           HA       SER  27  -5.458 -11.924  -0.195
  197    HB2  SER  27           HB2      SER  27  -4.907 -10.846  -2.390
  198    HB3  SER  27           HB1      SER  27  -6.471 -10.370  -1.727
  199    HG   SER  27           HG       SER  27  -4.411  -8.818  -2.391
  200    H    ARG  28           HN       ARG  28  -3.507  -9.764   1.383
  201    HA   ARG  28           HA       ARG  28  -1.302  -9.587   1.846
  202    HB2  ARG  28           HB2      ARG  28  -1.279 -12.374   0.711
  203    HB3  ARG  28           HB1      ARG  28   0.162 -11.607   1.353
  204    HG2  ARG  28           HG2      ARG  28  -0.578 -12.844   3.148
  205    HG3  ARG  28           HG1      ARG  28  -1.281 -11.261   3.482
  206    HD2  ARG  28           HD2      ARG  28  -2.937 -12.973   3.869
  207    HD3  ARG  28           HD1      ARG  28  -3.396 -12.017   2.457
  208    HE   ARG  28           HE       ARG  28  -1.938 -14.197   1.528
  209   HH11  ARG  28          HH11      ARG  28  -4.964 -13.623   3.204
  210   HH12  ARG  28          HH12      ARG  28  -5.721 -15.051   2.569
  211   HH21  ARG  28          HH21      ARG  28  -2.956 -16.074   0.702
  212   HH22  ARG  28          HH22      ARG  28  -4.578 -16.447   1.195
  213    H    THR  29           HN       THR  29  -2.425  -8.745  -0.747
  214    HA   THR  29           HA       THR  29  -0.346  -9.068  -2.695
  215    HB   THR  29           HB       THR  29  -2.616  -7.063  -2.660
  216    HG1  THR  29           HG1      THR  29  -2.450  -9.715  -3.710
  217   HG21  THR  29          HG21      THR  29  -0.845  -6.505  -4.253
  218   HG22  THR  29          HG22      THR  29  -2.306  -7.030  -5.093
  219   HG23  THR  29          HG23      THR  29  -0.932  -8.127  -4.935
  220    H    THR  30           HN       THR  30   1.520  -8.018  -2.675
  221    HA   THR  30           HA       THR  30   1.730  -5.436  -1.310
  222    HB   THR  30           HB       THR  30   4.228  -5.819  -1.722
  223    HG1  THR  30           HG1      THR  30   4.600  -8.223  -1.921
  224   HG21  THR  30          HG21      THR  30   2.748  -7.807   0.006
  225   HG22  THR  30          HG22      THR  30   3.152  -6.151   0.459
  226   HG23  THR  30          HG23      THR  30   4.437  -7.327   0.187
  227    H    GLN  31           HN       GLN  31   2.466  -3.597  -2.383
  228    HA   GLN  31           HA       GLN  31   2.898  -3.724  -5.252
  229    HB2  GLN  31           HB2      GLN  31   0.446  -3.731  -5.018
  230    HB3  GLN  31           HB1      GLN  31   0.531  -2.258  -4.066
  231    HG2  GLN  31           HG2      GLN  31   1.336  -1.020  -5.964
  232    HG3  GLN  31           HG1      GLN  31   1.412  -2.493  -6.934
  233   HE21  GLN  31          HE21      GLN  31  -0.677  -0.138  -5.449
  234   HE22  GLN  31          HE22      GLN  31  -2.112  -0.567  -6.327
  235    H    TRP  32           HN       TRP  32   4.072  -2.038  -6.022
  236    HA   TRP  32           HA       TRP  32   5.192  -0.127  -4.192
  237    HB2  TRP  32           HB2      TRP  32   5.394  -0.382  -7.202
  238    HB3  TRP  32           HB1      TRP  32   6.265   0.818  -6.260
  239    HD1  TRP  32           HD1      TRP  32   7.073  -2.143  -7.946
  240    HE1  TRP  32           HE1      TRP  32   8.997  -3.453  -6.868
  241    HE3  TRP  32           HE3      TRP  32   6.996   0.029  -3.343
  242    HZ2  TRP  32           HZ2      TRP  32  10.325  -3.524  -4.362
  243    HZ3  TRP  32           HZ3      TRP  32   8.623  -0.702  -1.671
  244    HH2  TRP  32           HH2      TRP  32  10.250  -2.449  -2.166
  245    H    LYS  33           HN       LYS  33   2.851  -0.129  -6.771
  246    HA   LYS  33           HA       LYS  33   2.504   2.658  -6.994
  247    HB2  LYS  33           HB2      LYS  33   1.885   1.137  -8.787
  248    HB3  LYS  33           HB1      LYS  33   0.700   0.355  -7.753
  249    HG2  LYS  33           HG2      LYS  33  -0.372   1.823  -9.337
  250    HG3  LYS  33           HG1      LYS  33  -0.608   2.410  -7.693
  251    HD2  LYS  33           HD2      LYS  33   1.093   4.089  -8.002
  252    HD3  LYS  33           HD1      LYS  33   1.501   3.435  -9.590
  253    HE2  LYS  33           HE2      LYS  33   0.106   5.427  -9.793
  254    HE3  LYS  33           HE1      LYS  33  -0.732   4.000 -10.402
  255    HZ1  LYS  33           HZ1      LYS  33  -1.578   4.001  -7.889
  256    HZ2  LYS  33           HZ2      LYS  33  -2.381   4.824  -9.129
  257    HZ3  LYS  33           HZ3      LYS  33  -1.335   5.668  -8.094
  258    H    ARG  34           HN       ARG  34   1.398   4.038  -5.753
  259    HA   ARG  34           HA       ARG  34   0.020   3.202  -3.433
  260    HB2  ARG  34           HB2      ARG  34  -0.747   5.559  -3.272
  261    HB3  ARG  34           HB1      ARG  34   0.988   5.402  -3.480
  262    HG2  ARG  34           HG2      ARG  34   0.810   6.034  -5.802
  263    HG3  ARG  34           HG1      ARG  34  -0.952   6.069  -5.684
  264    HD2  ARG  34           HD2      ARG  34  -0.842   7.876  -4.080
  265    HD3  ARG  34           HD1      ARG  34   0.918   7.812  -4.077
  266    HE   ARG  34           HE       ARG  34   0.379   8.283  -6.668
  267   HH11  ARG  34          HH11      ARG  34  -0.806   9.806  -3.747
  268   HH12  ARG  34          HH12      ARG  34  -0.998  11.368  -4.487
  269   HH21  ARG  34          HH21      ARG  34   0.101  10.329  -7.644
  270   HH22  ARG  34          HH22      ARG  34  -0.487  11.660  -6.694
  271    HA   PRO  35           HA       PRO  35  -3.748   2.009  -5.305
  272    HB2  PRO  35           HB2      PRO  35  -5.254   1.690  -3.081
  273    HB3  PRO  35           HB1      PRO  35  -3.935   0.593  -3.505
  274    HG2  PRO  35           HG2      PRO  35  -4.006   2.777  -1.482
  275    HG3  PRO  35           HG1      PRO  35  -3.176   1.213  -1.424
  276    HD2  PRO  35           HD2      PRO  35  -1.985   3.648  -2.031
  277    HD3  PRO  35           HD1      PRO  35  -1.309   2.062  -2.426
  278    H    SER  36           HN       SER  36  -5.445   3.012  -6.199
  279    HA   SER  36           HA       SER  36  -6.166   5.684  -5.500
  280    HB2  SER  36           HB2      SER  36  -7.614   3.696  -7.274
  281    HB3  SER  36           HB1      SER  36  -7.839   5.447  -7.265
  282    HG   SER  36           HG       SER  36  -6.479   4.989  -8.934
  283    HA   PRO  37           HA       PRO  37  -9.500   4.857  -2.670
  284    HB2  PRO  37           HB2      PRO  37 -11.407   6.626  -3.978
  285    HB3  PRO  37           HB1      PRO  37 -10.511   6.873  -2.478
  286    HG2  PRO  37           HG2      PRO  37 -10.019   8.304  -4.732
  287    HG3  PRO  37           HG1      PRO  37  -8.765   7.926  -3.537
  288    HD2  PRO  37           HD2      PRO  37  -9.364   6.568  -6.143
  289    HD3  PRO  37           HD1      PRO  37  -7.794   7.047  -5.458
  290    H    GLU  38           HN       GLU  38  -9.655   3.806  -5.738
  291    HA   GLU  38           HA       GLU  38 -12.364   2.756  -5.594
  292    HB2  GLU  38           HB2      GLU  38 -11.701   1.709  -7.819
  293    HB3  GLU  38           HB1      GLU  38 -11.795   3.465  -7.778
  294    HG2  GLU  38           HG2      GLU  38  -9.371   3.607  -7.589
  295    HG3  GLU  38           HG1      GLU  38  -9.256   1.851  -7.542
  296    H    ASP  39           HN       ASP  39 -11.837   1.583  -3.630
  297    HA   ASP  39           HA       ASP  39 -10.115  -0.742  -3.952
  298    HB2  ASP  39           HB2      ASP  39 -10.411  -1.086  -1.562
  299    HB3  ASP  39           HB1      ASP  39  -9.968   0.582  -1.871
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1  -6.664  21.251   5.296
    2    H2   GLY   1           HT2      GLY   1  -5.584  19.950   5.169
    3    H3   GLY   1           HT3      GLY   1  -7.193  19.771   4.667
    4    HA2  GLY   1           HA1      GLY   1  -6.843  21.446   2.933
    5    HA3  GLY   1           HA2      GLY   1  -5.159  21.534   3.425
    6    H    SER   2           HN       SER   2  -7.628  19.541   1.980
    7    HA   SER   2           HA       SER   2  -7.583  17.817   0.516
    8    HB2  SER   2           HB2      SER   2  -4.855  18.892  -0.221
    9    HB3  SER   2           HB1      SER   2  -5.902  17.895  -1.231
   10    HG   SER   2           HG       SER   2  -7.190  19.566  -1.604
   11    HA   PRO   3           HA       PRO   3  -5.026  14.955   2.999
   12    HB2  PRO   3           HB2      PRO   3  -7.004  13.321   3.786
   13    HB3  PRO   3           HB1      PRO   3  -6.709  14.866   4.591
   14    HG2  PRO   3           HG2      PRO   3  -8.825  14.121   2.631
   15    HG3  PRO   3           HG1      PRO   3  -8.911  15.221   4.016
   16    HD2  PRO   3           HD2      PRO   3  -8.582  15.974   1.339
   17    HD3  PRO   3           HD1      PRO   3  -8.282  17.000   2.754
   18    H    SER   4           HN       SER   4  -4.769  12.545   2.734
   19    HA   SER   4           HA       SER   4  -5.906  11.501   0.258
   20    HB2  SER   4           HB2      SER   4  -3.735  12.492  -0.331
   21    HB3  SER   4           HB1      SER   4  -2.939  11.468   0.862
   22    HG   SER   4           HG       SER   4  -3.650   9.653  -0.340
   23    HA   PRO   5           HA       PRO   5  -6.101   8.101   3.181
   24    HB2  PRO   5           HB2      PRO   5  -8.445   7.196   1.887
   25    HB3  PRO   5           HB1      PRO   5  -8.369   8.244   3.306
   26    HG2  PRO   5           HG2      PRO   5  -9.340   8.987   0.798
   27    HG3  PRO   5           HG1      PRO   5  -8.838  10.105   2.076
   28    HD2  PRO   5           HD2      PRO   5  -7.285   9.147  -0.299
   29    HD3  PRO   5           HD1      PRO   5  -7.382  10.780   0.408
   30    H    LEU   6           HN       LEU   6  -6.496   5.699   2.876
   31    HA   LEU   6           HA       LEU   6  -5.802   4.739   0.201
   32    HB2  LEU   6           HB2      LEU   6  -4.314   2.990   1.295
   33    HB3  LEU   6           HB1      LEU   6  -3.673   4.610   1.183
   34    HG   LEU   6           HG       LEU   6  -4.451   4.895   3.617
   35   HD11  LEU   6          HD11      LEU   6  -4.609   2.853   4.925
   36   HD12  LEU   6          HD12      LEU   6  -4.488   1.888   3.454
   37   HD13  LEU   6          HD13      LEU   6  -5.890   2.924   3.715
   38   HD21  LEU   6          HD21      LEU   6  -2.235   2.963   2.957
   39   HD22  LEU   6          HD22      LEU   6  -2.403   3.879   4.456
   40   HD23  LEU   6          HD23      LEU   6  -2.119   4.722   2.934
   41    HA   PRO   7           HA       PRO   7  -8.966   1.732   0.651
   42    HB2  PRO   7           HB2      PRO   7  -7.262  -0.528   0.102
   43    HB3  PRO   7           HB1      PRO   7  -8.495   0.184  -0.920
   44    HG2  PRO   7           HG2      PRO   7  -5.686   0.358  -1.198
   45    HG3  PRO   7           HG1      PRO   7  -6.926   1.139  -2.184
   46    HD2  PRO   7           HD2      PRO   7  -5.123   2.347  -0.345
   47    HD3  PRO   7           HD1      PRO   7  -6.397   3.127  -1.293
   48    HA   PRO   8           HA       PRO   8  -8.411   0.404   4.871
   49    HB2  PRO   8           HB2      PRO   8 -10.662  -1.227   4.907
   50    HB3  PRO   8           HB1      PRO   8 -10.650   0.503   5.257
   51    HG2  PRO   8           HG2      PRO   8 -11.375  -0.921   2.739
   52    HG3  PRO   8           HG1      PRO   8 -12.109   0.522   3.467
   53    HD2  PRO   8           HD2      PRO   8 -10.445   0.686   1.360
   54    HD3  PRO   8           HD1      PRO   8 -10.469   1.927   2.627
   55    H    GLY   9           HN       GLY   9  -7.092  -1.135   5.564
   56    HA2  GLY   9           HA2      GLY   9  -6.550  -3.443   5.912
   57    HA3  GLY   9           HA1      GLY   9  -7.288  -3.813   4.360
   58    H    TRP  10           HN       TRP  10  -5.792  -1.231   3.404
   59    HA   TRP  10           HA       TRP  10  -3.350  -2.622   2.683
   60    HB2  TRP  10           HB2      TRP  10  -4.631  -0.045   1.812
   61    HB3  TRP  10           HB1      TRP  10  -2.914  -0.313   1.524
   62    HD1  TRP  10           HD1      TRP  10  -6.308  -1.978   0.656
   63    HE1  TRP  10           HE1      TRP  10  -6.024  -3.257  -1.568
   64    HE3  TRP  10           HE3      TRP  10  -1.305  -1.260  -0.022
   65    HZ2  TRP  10           HZ2      TRP  10  -3.928  -3.858  -3.358
   66    HZ3  TRP  10           HZ3      TRP  10  -0.230  -2.215  -2.012
   67    HH2  TRP  10           HH2      TRP  10  -1.516  -3.496  -3.652
   68    H    GLU  11           HN       GLU  11  -1.579  -2.525   3.812
   69    HA   GLU  11           HA       GLU  11  -1.304  -0.410   5.834
   70    HB2  GLU  11           HB2      GLU  11   0.375  -2.036   6.834
   71    HB3  GLU  11           HB1      GLU  11  -1.311  -2.533   6.876
   72    HG2  GLU  11           HG2      GLU  11  -0.969  -3.985   4.996
   73    HG3  GLU  11           HG1      GLU  11   0.691  -3.413   4.810
   74    H    GLU  12           HN       GLU  12   0.460   0.835   5.955
   75    HA   GLU  12           HA       GLU  12   2.143   1.069   3.640
   76    HB2  GLU  12           HB2      GLU  12   1.247   3.003   4.987
   77    HB3  GLU  12           HB1      GLU  12   2.328   2.521   6.286
   78    HG2  GLU  12           HG2      GLU  12   4.244   2.872   4.772
   79    HG3  GLU  12           HG1      GLU  12   3.124   3.456   3.539
   80    H    ARG  13           HN       ARG  13   4.003  -0.024   3.374
   81    HA   ARG  13           HA       ARG  13   5.378  -1.027   5.777
   82    HB2  ARG  13           HB2      ARG  13   4.679  -2.527   3.260
   83    HB3  ARG  13           HB1      ARG  13   5.869  -3.105   4.420
   84    HG2  ARG  13           HG2      ARG  13   3.011  -2.512   5.135
   85    HG3  ARG  13           HG1      ARG  13   3.573  -4.096   4.609
   86    HD2  ARG  13           HD2      ARG  13   3.560  -4.189   6.948
   87    HD3  ARG  13           HD1      ARG  13   5.248  -3.970   6.505
   88    HE   ARG  13           HE       ARG  13   4.219  -1.432   6.958
   89   HH11  ARG  13          HH11      ARG  13   4.619  -4.387   8.797
   90   HH12  ARG  13          HH12      ARG  13   4.857  -3.574  10.308
   91   HH21  ARG  13          HH21      ARG  13   4.505  -0.350   8.965
   92   HH22  ARG  13          HH22      ARG  13   4.794  -1.270  10.407
   93    H    GLN  14           HN       GLN  14   7.633  -1.239   5.602
   94    HA   GLN  14           HA       GLN  14   8.773   0.276   3.381
   95    HB2  GLN  14           HB2      GLN  14  10.869   0.238   4.799
   96    HB3  GLN  14           HB1      GLN  14   9.513   1.153   5.444
   97    HG2  GLN  14           HG2      GLN  14   9.184  -0.277   7.174
   98    HG3  GLN  14           HG1      GLN  14   9.762  -1.680   6.276
   99   HE21  GLN  14          HE21      GLN  14  12.208  -0.558   5.416
  100   HE22  GLN  14          HE22      GLN  14  13.236  -0.398   6.799
  101    H    ASP  15           HN       ASP  15   9.940  -0.633   1.832
  102    HA   ASP  15           HA       ASP  15  10.536  -3.449   1.933
  103    HB2  ASP  15           HB2      ASP  15  10.299  -3.135  -0.279
  104    HB3  ASP  15           HB1      ASP  15  10.403  -1.400  -0.085
  105    H    VAL  16           HN       VAL  16  12.667  -4.275   1.634
  106    HA   VAL  16           HA       VAL  16  14.466  -3.377   3.553
  107    HB   VAL  16           HB       VAL  16  14.705  -5.606   3.058
  108   HG11  VAL  16          HG11      VAL  16  14.902  -6.552   0.796
  109   HG12  VAL  16          HG12      VAL  16  14.770  -4.928   0.118
  110   HG13  VAL  16          HG13      VAL  16  13.410  -5.632   0.991
  111   HG21  VAL  16          HG21      VAL  16  16.827  -4.228   1.446
  112   HG22  VAL  16          HG22      VAL  16  16.909  -5.909   1.977
  113   HG23  VAL  16          HG23      VAL  16  16.891  -4.605   3.168
  114    H    LEU  17           HN       LEU  17  14.332  -2.779   0.068
  115    HA   LEU  17           HA       LEU  17  16.903  -1.543  -0.062
  116    HB2  LEU  17           HB2      LEU  17  14.574  -1.394  -1.982
  117    HB3  LEU  17           HB1      LEU  17  16.197  -0.825  -2.318
  118    HG   LEU  17           HG       LEU  17  15.443  -3.701  -1.777
  119   HD11  LEU  17          HD11      LEU  17  16.159  -2.293  -4.346
  120   HD12  LEU  17          HD12      LEU  17  14.577  -2.937  -3.910
  121   HD13  LEU  17          HD13      LEU  17  15.936  -4.032  -4.158
  122   HD21  LEU  17          HD21      LEU  17  17.735  -4.196  -2.475
  123   HD22  LEU  17          HD22      LEU  17  17.712  -3.169  -1.043
  124   HD23  LEU  17          HD23      LEU  17  18.070  -2.472  -2.624
  125    H    GLY  18           HN       GLY  18  13.615  -0.348   0.572
  126    HA2  GLY  18           HA2      GLY  18  13.808   1.592   2.171
  127    HA3  GLY  18           HA1      GLY  18  14.877   2.311   0.968
  128    H    ARG  19           HN       ARG  19  12.639   0.594  -0.674
  129    HA   ARG  19           HA       ARG  19  11.071   2.926  -1.340
  130    HB2  ARG  19           HB2      ARG  19  10.893   0.046  -2.241
  131    HB3  ARG  19           HB1      ARG  19   9.806   1.307  -2.792
  132    HG2  ARG  19           HG2      ARG  19  11.399   1.040  -4.482
  133    HG3  ARG  19           HG1      ARG  19  11.841   2.527  -3.641
  134    HD2  ARG  19           HD2      ARG  19  13.618   1.465  -2.500
  135    HD3  ARG  19           HD1      ARG  19  13.043  -0.132  -2.967
  136    HE   ARG  19           HE       ARG  19  13.609   0.675  -5.337
  137   HH11  ARG  19          HH11      ARG  19  15.351   1.646  -2.461
  138   HH12  ARG  19          HH12      ARG  19  16.861   1.844  -3.286
  139   HH21  ARG  19          HH21      ARG  19  15.609   0.942  -6.426
  140   HH22  ARG  19          HH22      ARG  19  17.015   1.440  -5.529
  141    H    THR  20           HN       THR  20   9.370   3.531  -0.066
  142    HA   THR  20           HA       THR  20   8.212   1.637   1.744
  143    HB   THR  20           HB       THR  20   7.001   4.308   0.983
  144    HG1  THR  20           HG1      THR  20   8.574   5.279   2.037
  145   HG21  THR  20          HG21      THR  20   6.173   4.246   3.303
  146   HG22  THR  20          HG22      THR  20   6.936   2.671   3.525
  147   HG23  THR  20          HG23      THR  20   5.614   2.855   2.373
  148    H    TYR  21           HN       TYR  21   7.246  -0.023   0.740
  149    HA   TYR  21           HA       TYR  21   5.270   0.544  -1.360
  150    HB2  TYR  21           HB2      TYR  21   5.251  -1.811  -1.825
  151    HB3  TYR  21           HB1      TYR  21   6.933  -1.331  -1.635
  152    HD1  TYR  21           HD1      TYR  21   8.145  -1.922   0.465
  153    HD2  TYR  21           HD2      TYR  21   4.258  -3.430  -0.389
  154    HE1  TYR  21           HE1      TYR  21   8.464  -3.685   2.145
  155    HE2  TYR  21           HE2      TYR  21   4.569  -5.193   1.294
  156    HH   TYR  21           HH       TYR  21   6.364  -6.374   2.420
  157    H    TYR  22           HN       TYR  22   3.293  -1.119  -1.148
  158    HA   TYR  22           HA       TYR  22   2.332  -1.067   1.638
  159    HB2  TYR  22           HB2      TYR  22   0.494  -0.676  -0.699
  160    HB3  TYR  22           HB1      TYR  22   0.185  -0.353   0.990
  161    HD1  TYR  22           HD2      TYR  22   1.170   1.648   2.077
  162    HD2  TYR  22           HD1      TYR  22   1.505   0.997  -2.113
  163    HE1  TYR  22           HE2      TYR  22   1.740   4.018   1.762
  164    HE2  TYR  22           HE1      TYR  22   2.071   3.368  -2.441
  165    HH   TYR  22           HH       TYR  22   2.863   5.457   0.142
  166    H    VAL  23           HN       VAL  23   0.816  -2.735   2.144
  167    HA   VAL  23           HA       VAL  23   0.431  -4.790   0.100
  168    HB   VAL  23           HB       VAL  23   2.365  -5.621   1.270
  169   HG11  VAL  23          HG11      VAL  23   0.818  -5.287   3.824
  170   HG12  VAL  23          HG12      VAL  23   2.176  -4.288   3.297
  171   HG13  VAL  23          HG13      VAL  23   2.425  -5.995   3.663
  172   HG21  VAL  23          HG21      VAL  23   1.514  -7.726   2.198
  173   HG22  VAL  23          HG22      VAL  23   0.704  -7.293   0.693
  174   HG23  VAL  23          HG23      VAL  23  -0.110  -7.038   2.238
  175    H    ASN  24           HN       ASN  24  -1.518  -5.829   0.248
  176    HA   ASN  24           HA       ASN  24  -3.487  -4.688   2.019
  177    HB2  ASN  24           HB2      ASN  24  -3.999  -5.315  -0.332
  178    HB3  ASN  24           HB1      ASN  24  -3.750  -7.006   0.087
  179   HD21  ASN  24          HD21      ASN  24  -5.862  -4.265   0.371
  180   HD22  ASN  24          HD22      ASN  24  -7.221  -5.132   1.006
  181    H    HIS  25           HN       HIS  25  -4.659  -5.822   3.637
  182    HA   HIS  25           HA       HIS  25  -2.969  -7.656   5.085
  183    HB2  HIS  25           HB2      HIS  25  -4.304  -5.783   6.124
  184    HB3  HIS  25           HB1      HIS  25  -5.747  -6.740   5.825
  185    HD1  HIS  25           HD1      HIS  25  -6.464  -8.087   7.756
  186    HD2  HIS  25           HD2      HIS  25  -2.374  -7.338   7.844
  187    HE1  HIS  25           HE1      HIS  25  -5.627  -9.133   9.880
  188    HE2  HIS  25           HE2      HIS  25  -3.201  -8.483  10.004
  189    H    GLU  26           HN       GLU  26  -6.098  -7.842   3.456
  190    HA   GLU  26           HA       GLU  26  -6.441 -10.618   4.252
  191    HB2  GLU  26           HB2      GLU  26  -8.417  -9.249   4.222
  192    HB3  GLU  26           HB1      GLU  26  -8.112  -8.761   2.560
  193    HG2  GLU  26           HG2      GLU  26  -8.534 -10.997   1.780
  194    HG3  GLU  26           HG1      GLU  26  -8.704 -11.569   3.438
  195    H    SER  27           HN       SER  27  -6.321  -8.892   1.126
  196    HA   SER  27           HA       SER  27  -5.951 -11.338  -0.337
  197    HB2  SER  27           HB2      SER  27  -7.144  -9.394  -1.292
  198    HB3  SER  27           HB1      SER  27  -5.646  -8.463  -1.251
  199    HG   SER  27           HG       SER  27  -5.244 -10.808  -2.509
  200    H    ARG  28           HN       ARG  28  -3.921  -8.977   1.131
  201    HA   ARG  28           HA       ARG  28  -1.709  -8.922   1.565
  202    HB2  ARG  28           HB2      ARG  28  -1.961 -11.822   0.787
  203    HB3  ARG  28           HB1      ARG  28  -0.520 -11.134   1.522
  204    HG2  ARG  28           HG2      ARG  28  -1.672 -10.648   3.533
  205    HG3  ARG  28           HG1      ARG  28  -3.238 -10.981   2.794
  206    HD2  ARG  28           HD2      ARG  28  -2.508 -12.800   4.261
  207    HD3  ARG  28           HD1      ARG  28  -2.668 -13.327   2.585
  208    HE   ARG  28           HE       ARG  28  -0.007 -12.509   3.163
  209   HH11  ARG  28          HH11      ARG  28  -2.268 -15.144   3.600
  210   HH12  ARG  28          HH12      ARG  28  -1.024 -16.354   3.754
  211   HH21  ARG  28          HH21      ARG  28   1.618 -14.061   3.374
  212   HH22  ARG  28          HH22      ARG  28   1.202 -15.731   3.634
  213    H    THR  29           HN       THR  29  -2.637  -8.301  -1.153
  214    HA   THR  29           HA       THR  29  -0.376  -9.004  -2.829
  215    HB   THR  29           HB       THR  29  -2.607  -8.807  -3.868
  216    HG1  THR  29           HG1      THR  29  -1.945  -7.410  -5.591
  217   HG21  THR  29          HG21      THR  29  -3.649  -6.603  -4.154
  218   HG22  THR  29          HG22      THR  29  -2.430  -5.895  -3.095
  219   HG23  THR  29          HG23      THR  29  -3.573  -7.075  -2.454
  220    H    THR  30           HN       THR  30   1.120  -7.479  -3.646
  221    HA   THR  30           HA       THR  30   1.497  -5.143  -1.889
  222    HB   THR  30           HB       THR  30   3.944  -5.371  -2.578
  223    HG1  THR  30           HG1      THR  30   3.603  -8.081  -2.988
  224   HG21  THR  30          HG21      THR  30   2.662  -7.540  -0.920
  225   HG22  THR  30          HG22      THR  30   3.205  -5.959  -0.360
  226   HG23  THR  30          HG23      THR  30   4.382  -7.145  -0.918
  227    H    GLN  31           HN       GLN  31   2.087  -3.175  -2.805
  228    HA   GLN  31           HA       GLN  31   2.452  -3.029  -5.690
  229    HB2  GLN  31           HB2      GLN  31  -0.009  -2.867  -5.282
  230    HB3  GLN  31           HB1      GLN  31   0.281  -1.430  -4.313
  231    HG2  GLN  31           HG2      GLN  31   1.077  -0.225  -6.211
  232    HG3  GLN  31           HG1      GLN  31   1.063  -1.679  -7.206
  233   HE21  GLN  31          HE21      GLN  31  -0.850   0.806  -5.724
  234   HE22  GLN  31          HE22      GLN  31  -2.323   0.475  -6.578
  235    H    TRP  32           HN       TRP  32   3.723  -1.366  -6.323
  236    HA   TRP  32           HA       TRP  32   5.056   0.139  -4.231
  237    HB2  TRP  32           HB2      TRP  32   6.515  -0.825  -5.821
  238    HB3  TRP  32           HB1      TRP  32   5.534  -0.288  -7.173
  239    HD1  TRP  32           HD1      TRP  32   6.874   1.408  -8.513
  240    HE1  TRP  32           HE1      TRP  32   8.395   3.413  -8.002
  241    HE3  TRP  32           HE3      TRP  32   6.913   1.125  -3.402
  242    HZ2  TRP  32           HZ2      TRP  32   9.467   4.702  -5.753
  243    HZ3  TRP  32           HZ3      TRP  32   8.231   2.784  -2.154
  244    HH2  TRP  32           HH2      TRP  32   9.478   4.540  -3.308
  245    H    LYS  33           HN       LYS  33   2.824   0.654  -6.842
  246    HA   LYS  33           HA       LYS  33   2.918   3.539  -6.620
  247    HB2  LYS  33           HB2      LYS  33   0.897   1.844  -8.109
  248    HB3  LYS  33           HB1      LYS  33   1.273   3.544  -8.379
  249    HG2  LYS  33           HG2      LYS  33   3.486   2.958  -9.181
  250    HG3  LYS  33           HG1      LYS  33   3.178   1.254  -8.844
  251    HD2  LYS  33           HD2      LYS  33   2.664   1.247 -11.056
  252    HD3  LYS  33           HD1      LYS  33   1.092   1.748 -10.439
  253    HE2  LYS  33           HE2      LYS  33   3.237   3.674 -11.304
  254    HE3  LYS  33           HE1      LYS  33   1.976   3.083 -12.383
  255    HZ1  LYS  33           HZ1      LYS  33   1.550   4.630  -9.887
  256    HZ2  LYS  33           HZ2      LYS  33   0.322   4.039 -10.891
  257    HZ3  LYS  33           HZ3      LYS  33   1.389   5.226 -11.461
  258    H    ARG  34           HN       ARG  34   1.292   4.815  -5.707
  259    HA   ARG  34           HA       ARG  34   0.098   3.860  -3.380
  260    HB2  ARG  34           HB2      ARG  34  -0.500   6.324  -5.012
  261    HB3  ARG  34           HB1      ARG  34  -1.252   5.996  -3.458
  262    HG2  ARG  34           HG2      ARG  34   0.967   5.955  -2.405
  263    HG3  ARG  34           HG1      ARG  34   1.695   6.345  -3.964
  264    HD2  ARG  34           HD2      ARG  34   0.532   8.453  -4.032
  265    HD3  ARG  34           HD1      ARG  34  -0.352   8.053  -2.561
  266    HE   ARG  34           HE       ARG  34   1.902   8.064  -1.449
  267   HH11  ARG  34          HH11      ARG  34   1.285   9.931  -4.348
  268   HH12  ARG  34          HH12      ARG  34   2.490  11.130  -3.969
  269   HH21  ARG  34          HH21      ARG  34   3.482   9.646  -0.966
  270   HH22  ARG  34          HH22      ARG  34   3.726  10.967  -2.066
  271    HA   PRO  35           HA       PRO  35  -3.298   1.651  -5.117
  272    HB2  PRO  35           HB2      PRO  35  -4.458   0.899  -2.788
  273    HB3  PRO  35           HB1      PRO  35  -2.980   0.152  -3.401
  274    HG2  PRO  35           HG2      PRO  35  -3.330   2.210  -1.270
  275    HG3  PRO  35           HG1      PRO  35  -2.188   0.858  -1.351
  276    HD2  PRO  35           HD2      PRO  35  -1.542   3.467  -1.912
  277    HD3  PRO  35           HD1      PRO  35  -0.665   2.064  -2.545
  278    H    SER  36           HN       SER  36  -5.246   2.248  -5.826
  279    HA   SER  36           HA       SER  36  -6.644   4.461  -4.596
  280    HB2  SER  36           HB2      SER  36  -7.418   2.671  -6.921
  281    HB3  SER  36           HB1      SER  36  -8.276   4.135  -6.438
  282    HG   SER  36           HG       SER  36  -5.617   4.594  -6.769
  283    HA   PRO  37           HA       PRO  37  -9.150   2.126  -1.889
  284    HB2  PRO  37           HB2      PRO  37 -11.524   3.734  -2.462
  285    HB3  PRO  37           HB1      PRO  37 -10.510   3.712  -1.016
  286    HG2  PRO  37           HG2      PRO  37 -10.551   5.809  -2.711
  287    HG3  PRO  37           HG1      PRO  37  -9.086   5.337  -1.831
  288    HD2  PRO  37           HD2      PRO  37  -9.861   4.736  -4.666
  289    HD3  PRO  37           HD1      PRO  37  -8.297   5.291  -4.021
  290    H    GLU  38           HN       GLU  38  -9.548   1.753  -5.044
  291    HA   GLU  38           HA       GLU  38 -12.015   0.262  -5.072
  292    HB2  GLU  38           HB2      GLU  38 -11.100  -0.485  -7.343
  293    HB3  GLU  38           HB1      GLU  38 -11.447   1.227  -7.154
  294    HG2  GLU  38           HG2      GLU  38  -9.123   1.729  -6.848
  295    HG3  GLU  38           HG1      GLU  38  -8.712   0.015  -6.843
  296    H    ASP  39           HN       ASP  39 -11.427  -0.998  -3.198
  297    HA   ASP  39           HA       ASP  39  -9.981  -3.439  -3.934
  298    HB2  ASP  39           HB2      ASP  39  -8.442  -1.860  -2.692
  299    HB3  ASP  39           HB1      ASP  39  -9.519  -2.004  -1.309
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1  -9.306  16.693   2.306
    2    H2   GLY   1           HT2      GLY   1  -9.421  15.191   1.536
    3    H3   GLY   1           HT3      GLY   1 -10.445  16.465   1.070
    4    HA2  GLY   1           HA1      GLY   1  -8.640  16.117  -0.528
    5    HA3  GLY   1           HA2      GLY   1  -8.614  17.717   0.206
    6    H    SER   2           HN       SER   2  -7.470  14.487   1.235
    7    HA   SER   2           HA       SER   2  -4.777  15.619   1.502
    8    HB2  SER   2           HB2      SER   2  -5.956  15.757   3.706
    9    HB3  SER   2           HB1      SER   2  -6.157  14.009   3.664
   10    HG   SER   2           HG       SER   2  -3.586  15.167   3.422
   11    HA   PRO   3           HA       PRO   3  -3.971  11.649  -0.460
   12    HB2  PRO   3           HB2      PRO   3  -1.168  12.454  -0.386
   13    HB3  PRO   3           HB1      PRO   3  -2.217  12.212  -1.784
   14    HG2  PRO   3           HG2      PRO   3  -1.327  14.663  -1.014
   15    HG3  PRO   3           HG1      PRO   3  -2.882  14.412  -1.831
   16    HD2  PRO   3           HD2      PRO   3  -2.316  14.839   1.078
   17    HD3  PRO   3           HD1      PRO   3  -3.628  15.495   0.079
   18    H    SER   4           HN       SER   4  -4.539  10.867   1.770
   19    HA   SER   4           HA       SER   4  -2.151   9.787   3.081
   20    HB2  SER   4           HB2      SER   4  -2.973  11.713   4.393
   21    HB3  SER   4           HB1      SER   4  -4.544  10.924   4.542
   22    HG   SER   4           HG       SER   4  -2.052  10.053   5.581
   23    HA   PRO   5           HA       PRO   5  -5.918   6.861   4.136
   24    HB2  PRO   5           HB2      PRO   5  -7.834   7.600   2.001
   25    HB3  PRO   5           HB1      PRO   5  -8.132   7.212   3.700
   26    HG2  PRO   5           HG2      PRO   5  -8.309   9.719   2.831
   27    HG3  PRO   5           HG1      PRO   5  -7.605   9.352   4.417
   28    HD2  PRO   5           HD2      PRO   5  -6.229  10.021   1.842
   29    HD3  PRO   5           HD1      PRO   5  -5.868  10.573   3.490
   30    H    LEU   6           HN       LEU   6  -6.289   4.830   3.265
   31    HA   LEU   6           HA       LEU   6  -5.853   4.380   0.429
   32    HB2  LEU   6           HB2      LEU   6  -4.335   2.387   1.104
   33    HB3  LEU   6           HB1      LEU   6  -3.648   3.993   1.010
   34    HG   LEU   6           HG       LEU   6  -3.901   4.151   3.511
   35   HD11  LEU   6          HD11      LEU   6  -5.587   2.435   3.844
   36   HD12  LEU   6          HD12      LEU   6  -4.123   2.058   4.759
   37   HD13  LEU   6          HD13      LEU   6  -4.465   1.204   3.252
   38   HD21  LEU   6          HD21      LEU   6  -2.160   1.936   2.444
   39   HD22  LEU   6          HD22      LEU   6  -1.922   2.806   3.960
   40   HD23  LEU   6          HD23      LEU   6  -1.770   3.651   2.420
   41    HA   PRO   7           HA       PRO   7  -9.000   1.279   0.570
   42    HB2  PRO   7           HB2      PRO   7  -7.349  -0.959  -0.120
   43    HB3  PRO   7           HB1      PRO   7  -8.493  -0.104  -1.132
   44    HG2  PRO   7           HG2      PRO   7  -5.597   0.080  -1.042
   45    HG3  PRO   7           HG1      PRO   7  -6.715   0.685  -2.272
   46    HD2  PRO   7           HD2      PRO   7  -5.281   2.266  -0.544
   47    HD3  PRO   7           HD1      PRO   7  -6.790   2.758  -1.339
   48    HA   PRO   8           HA       PRO   8  -8.725  -0.631   4.582
   49    HB2  PRO   8           HB2      PRO   8 -10.947  -2.313   3.589
   50    HB3  PRO   8           HB1      PRO   8 -10.889  -1.244   4.996
   51    HG2  PRO   8           HG2      PRO   8 -12.276  -0.562   2.821
   52    HG3  PRO   8           HG1      PRO   8 -11.365   0.642   3.750
   53    HD2  PRO   8           HD2      PRO   8 -10.644  -0.684   1.161
   54    HD3  PRO   8           HD1      PRO   8 -10.457   1.015   1.652
   55    H    GLY   9           HN       GLY   9  -7.383  -2.178   5.195
   56    HA2  GLY   9           HA2      GLY   9  -6.747  -4.480   5.347
   57    HA3  GLY   9           HA1      GLY   9  -7.361  -4.722   3.715
   58    H    TRP  10           HN       TRP  10  -5.916  -1.955   3.301
   59    HA   TRP  10           HA       TRP  10  -3.326  -3.122   2.591
   60    HB2  TRP  10           HB2      TRP  10  -4.691  -0.528   1.864
   61    HB3  TRP  10           HB1      TRP  10  -2.994  -0.826   1.511
   62    HD1  TRP  10           HD1      TRP  10  -6.452  -2.371   0.658
   63    HE1  TRP  10           HE1      TRP  10  -6.279  -3.406  -1.690
   64    HE3  TRP  10           HE3      TRP  10  -1.499  -1.526  -0.214
   65    HZ2  TRP  10           HZ2      TRP  10  -4.276  -3.791  -3.664
   66    HZ3  TRP  10           HZ3      TRP  10  -0.537  -2.227  -2.363
   67    HH2  TRP  10           HH2      TRP  10  -1.898  -3.346  -4.049
   68    H    GLU  11           HN       GLU  11  -1.354  -2.102   3.235
   69    HA   GLU  11           HA       GLU  11  -1.566  -0.032   5.262
   70    HB2  GLU  11           HB2      GLU  11  -0.202  -1.178   6.862
   71    HB3  GLU  11           HB1      GLU  11  -1.556  -2.207   6.442
   72    HG2  GLU  11           HG2      GLU  11  -0.042  -3.385   4.834
   73    HG3  GLU  11           HG1      GLU  11   1.289  -2.477   5.555
   74    H    GLU  12           HN       GLU  12   0.243   1.230   5.505
   75    HA   GLU  12           HA       GLU  12   2.052   1.244   3.253
   76    HB2  GLU  12           HB2      GLU  12   1.009   3.327   4.152
   77    HB3  GLU  12           HB1      GLU  12   1.910   3.099   5.643
   78    HG2  GLU  12           HG2      GLU  12   3.978   3.435   4.546
   79    HG3  GLU  12           HG1      GLU  12   3.218   3.395   2.958
   80    H    ARG  13           HN       ARG  13   4.074   0.520   3.273
   81    HA   ARG  13           HA       ARG  13   5.231  -0.425   5.807
   82    HB2  ARG  13           HB2      ARG  13   4.919  -1.996   3.241
   83    HB3  ARG  13           HB1      ARG  13   5.874  -2.524   4.622
   84    HG2  ARG  13           HG2      ARG  13   2.952  -1.909   4.862
   85    HG3  ARG  13           HG1      ARG  13   3.536  -3.486   4.339
   86    HD2  ARG  13           HD2      ARG  13   3.155  -3.639   6.665
   87    HD3  ARG  13           HD1      ARG  13   4.901  -3.569   6.443
   88    HE   ARG  13           HE       ARG  13   3.822  -0.973   6.915
   89   HH11  ARG  13          HH11      ARG  13   4.550  -3.993   8.526
   90   HH12  ARG  13          HH12      ARG  13   4.892  -3.252  10.063
   91   HH21  ARG  13          HH21      ARG  13   4.218   0.022   8.969
   92   HH22  ARG  13          HH22      ARG  13   4.676  -0.977  10.318
   93    H    GLN  14           HN       GLN  14   7.557  -0.832   5.658
   94    HA   GLN  14           HA       GLN  14   8.803   0.408   3.299
   95    HB2  GLN  14           HB2      GLN  14  10.637   1.195   4.742
   96    HB3  GLN  14           HB1      GLN  14   9.092   1.904   5.180
   97    HG2  GLN  14           HG2      GLN  14   9.458   1.292   7.263
   98    HG3  GLN  14           HG1      GLN  14   9.342  -0.391   6.755
   99   HE21  GLN  14          HE21      GLN  14  11.770  -0.362   5.171
  100   HE22  GLN  14          HE22      GLN  14  13.086  -0.303   6.291
  101    H    ASP  15           HN       ASP  15  10.407  -0.710   2.339
  102    HA   ASP  15           HA       ASP  15  11.031  -3.326   3.508
  103    HB2  ASP  15           HB2      ASP  15  11.669  -4.015   1.227
  104    HB3  ASP  15           HB1      ASP  15   9.996  -3.483   1.318
  105    H    VAL  16           HN       VAL  16  13.269  -4.084   2.394
  106    HA   VAL  16           HA       VAL  16  15.255  -2.438   3.607
  107    HB   VAL  16           HB       VAL  16  15.348  -4.925   3.549
  108   HG11  VAL  16          HG11      VAL  16  14.614  -5.237   1.236
  109   HG12  VAL  16          HG12      VAL  16  16.137  -6.061   1.564
  110   HG13  VAL  16          HG13      VAL  16  16.134  -4.543   0.669
  111   HG21  VAL  16          HG21      VAL  16  17.742  -3.529   2.359
  112   HG22  VAL  16          HG22      VAL  16  17.757  -5.098   3.156
  113   HG23  VAL  16          HG23      VAL  16  17.356  -3.651   4.077
  114    H    LEU  17           HN       LEU  17  13.769  -2.405   0.573
  115    HA   LEU  17           HA       LEU  17  16.022  -1.433  -0.929
  116    HB2  LEU  17           HB2      LEU  17  13.059  -1.384  -1.519
  117    HB3  LEU  17           HB1      LEU  17  14.299  -0.871  -2.645
  118    HG   LEU  17           HG       LEU  17  14.082  -3.672  -1.540
  119   HD11  LEU  17          HD11      LEU  17  13.200  -2.577  -4.213
  120   HD12  LEU  17          HD12      LEU  17  12.136  -3.130  -2.919
  121   HD13  LEU  17          HD13      LEU  17  13.199  -4.276  -3.734
  122   HD21  LEU  17          HD21      LEU  17  15.660  -4.226  -3.277
  123   HD22  LEU  17          HD22      LEU  17  16.328  -2.952  -2.261
  124   HD23  LEU  17          HD23      LEU  17  15.667  -2.560  -3.847
  125    H    GLY  18           HN       GLY  18  13.299  -0.037   0.854
  126    HA2  GLY  18           HA2      GLY  18  13.674   2.056   2.016
  127    HA3  GLY  18           HA1      GLY  18  14.749   2.543   0.708
  128    H    ARG  19           HN       ARG  19  12.156   0.918  -0.523
  129    HA   ARG  19           HA       ARG  19  10.764   3.412  -1.179
  130    HB2  ARG  19           HB2      ARG  19   9.754   2.198  -3.037
  131    HB3  ARG  19           HB1      ARG  19  11.499   2.034  -3.102
  132    HG2  ARG  19           HG2      ARG  19  11.321  -0.196  -2.108
  133    HG3  ARG  19           HG1      ARG  19   9.570  -0.007  -2.055
  134    HD2  ARG  19           HD2      ARG  19  10.248  -1.355  -3.952
  135    HD3  ARG  19           HD1      ARG  19   9.489   0.142  -4.472
  136    HE   ARG  19           HE       ARG  19  12.308   0.425  -4.361
  137   HH11  ARG  19          HH11      ARG  19   9.765  -1.046  -6.228
  138   HH12  ARG  19          HH12      ARG  19  10.603  -0.912  -7.741
  139   HH21  ARG  19          HH21      ARG  19  13.466   0.583  -6.347
  140   HH22  ARG  19          HH22      ARG  19  12.720  -0.023  -7.808
  141    H    THR  20           HN       THR  20   8.817   3.806  -0.284
  142    HA   THR  20           HA       THR  20   7.872   1.990   1.701
  143    HB   THR  20           HB       THR  20   6.155   4.222   0.708
  144    HG1  THR  20           HG1      THR  20   8.662   4.565   2.046
  145   HG21  THR  20          HG21      THR  20   5.508   2.935   2.697
  146   HG22  THR  20          HG22      THR  20   5.837   4.616   3.100
  147   HG23  THR  20          HG23      THR  20   7.025   3.374   3.475
  148    H    TYR  21           HN       TYR  21   7.079   0.108   0.932
  149    HA   TYR  21           HA       TYR  21   5.174   0.204  -1.297
  150    HB2  TYR  21           HB2      TYR  21   5.513  -2.129  -1.590
  151    HB3  TYR  21           HB1      TYR  21   7.105  -1.449  -1.277
  152    HD1  TYR  21           HD1      TYR  21   8.194  -1.850   0.939
  153    HD2  TYR  21           HD2      TYR  21   4.525  -3.726  -0.123
  154    HE1  TYR  21           HE1      TYR  21   8.521  -3.499   2.734
  155    HE2  TYR  21           HE2      TYR  21   4.838  -5.370   1.675
  156    HH   TYR  21           HH       TYR  21   7.301  -5.025   4.069
  157    H    TYR  22           HN       TYR  22   3.269  -1.330  -1.098
  158    HA   TYR  22           HA       TYR  22   2.143  -1.170   1.638
  159    HB2  TYR  22           HB2      TYR  22   0.472  -1.233  -0.853
  160    HB3  TYR  22           HB1      TYR  22   0.034  -0.671   0.750
  161    HD1  TYR  22           HD1      TYR  22   0.688   1.567   1.511
  162    HD2  TYR  22           HD2      TYR  22   1.660   0.206  -2.398
  163    HE1  TYR  22           HE1      TYR  22   1.201   3.877   0.843
  164    HE2  TYR  22           HE2      TYR  22   2.185   2.509  -3.082
  165    HH   TYR  22           HH       TYR  22   2.585   5.031  -0.855
  166    H    VAL  23           HN       VAL  23   0.942  -2.926   2.347
  167    HA   VAL  23           HA       VAL  23   0.795  -5.204   0.508
  168    HB   VAL  23           HB       VAL  23   2.638  -5.688   2.017
  169   HG11  VAL  23          HG11      VAL  23   0.662  -5.424   4.265
  170   HG12  VAL  23          HG12      VAL  23   1.962  -4.291   3.900
  171   HG13  VAL  23          HG13      VAL  23   2.342  -5.938   4.401
  172   HG21  VAL  23          HG21      VAL  23   0.192  -7.343   2.654
  173   HG22  VAL  23          HG22      VAL  23   1.868  -7.847   2.881
  174   HG23  VAL  23          HG23      VAL  23   1.252  -7.544   1.257
  175    H    ASN  24           HN       ASN  24  -1.089  -6.131   0.365
  176    HA   ASN  24           HA       ASN  24  -3.280  -5.261   2.064
  177    HB2  ASN  24           HB2      ASN  24  -3.549  -5.490  -0.422
  178    HB3  ASN  24           HB1      ASN  24  -3.277  -7.219  -0.248
  179   HD21  ASN  24          HD21      ASN  24  -5.489  -4.605   0.281
  180   HD22  ASN  24          HD22      ASN  24  -6.868  -5.581   0.653
  181    H    HIS  25           HN       HIS  25  -3.855  -6.408   3.847
  182    HA   HIS  25           HA       HIS  25  -2.397  -8.835   4.398
  183    HB2  HIS  25           HB2      HIS  25  -4.133  -7.013   5.970
  184    HB3  HIS  25           HB1      HIS  25  -3.972  -8.669   6.543
  185    HD1  HIS  25           HD1      HIS  25  -2.403  -8.462   8.476
  186    HD2  HIS  25           HD2      HIS  25  -1.062  -6.406   5.120
  187    HE1  HIS  25           HE1      HIS  25  -0.085  -7.670   9.045
  188    HE2  HIS  25           HE2      HIS  25   0.563  -6.187   7.115
  189    H    GLU  26           HN       GLU  26  -5.332  -8.232   2.876
  190    HA   GLU  26           HA       GLU  26  -6.570 -10.695   3.796
  191    HB2  GLU  26           HB2      GLU  26  -7.746  -8.446   3.157
  192    HB3  GLU  26           HB1      GLU  26  -7.613  -9.064   1.515
  193    HG2  GLU  26           HG2      GLU  26  -9.771  -9.615   2.456
  194    HG3  GLU  26           HG1      GLU  26  -8.823 -11.080   2.178
  195    H    SER  27           HN       SER  27  -5.637  -9.350   0.635
  196    HA   SER  27           HA       SER  27  -5.601 -11.968  -0.575
  197    HB2  SER  27           HB2      SER  27  -6.300  -9.942  -1.833
  198    HB3  SER  27           HB1      SER  27  -4.665  -9.303  -1.681
  199    HG   SER  27           HG       SER  27  -4.075 -10.504  -3.288
  200    H    ARG  28           HN       ARG  28  -3.468 -10.054   1.203
  201    HA   ARG  28           HA       ARG  28  -1.295 -10.223   1.808
  202    HB2  ARG  28           HB2      ARG  28  -1.484 -13.023   0.664
  203    HB3  ARG  28           HB1      ARG  28  -0.288 -12.443   1.821
  204    HG2  ARG  28           HG2      ARG  28  -2.018 -12.058   3.472
  205    HG3  ARG  28           HG1      ARG  28  -3.256 -12.545   2.319
  206    HD2  ARG  28           HD2      ARG  28  -2.191 -14.797   2.236
  207    HD3  ARG  28           HD1      ARG  28  -1.107 -14.273   3.529
  208    HE   ARG  28           HE       ARG  28  -3.795 -13.816   4.273
  209   HH11  ARG  28          HH11      ARG  28  -1.439 -16.377   3.942
  210   HH12  ARG  28          HH12      ARG  28  -2.269 -17.441   5.041
  211   HH21  ARG  28          HH21      ARG  28  -4.858 -15.194   5.745
  212   HH22  ARG  28          HH22      ARG  28  -4.208 -16.774   6.061
  213    H    THR  29           HN       THR  29  -1.946  -9.068  -0.633
  214    HA   THR  29           HA       THR  29   0.264  -9.781  -2.424
  215    HB   THR  29           HB       THR  29  -2.134  -8.040  -3.018
  216    HG1  THR  29           HG1      THR  29  -1.764 -10.815  -3.051
  217   HG21  THR  29          HG21      THR  29  -0.183  -9.422  -4.869
  218   HG22  THR  29          HG22      THR  29  -0.167  -7.702  -4.479
  219   HG23  THR  29          HG23      THR  29  -1.535  -8.393  -5.349
  220    H    THR  30           HN       THR  30   1.840  -8.293  -2.891
  221    HA   THR  30           HA       THR  30   1.718  -5.766  -1.395
  222    HB   THR  30           HB       THR  30   4.234  -5.762  -1.836
  223    HG1  THR  30           HG1      THR  30   4.336  -7.356  -3.439
  224   HG21  THR  30          HG21      THR  30   3.251  -6.299   0.341
  225   HG22  THR  30          HG22      THR  30   4.691  -7.265   0.024
  226   HG23  THR  30          HG23      THR  30   3.093  -7.986  -0.150
  227    H    GLN  31           HN       GLN  31   2.264  -3.803  -2.382
  228    HA   GLN  31           HA       GLN  31   2.856  -3.806  -5.232
  229    HB2  GLN  31           HB2      GLN  31   0.315  -3.749  -4.828
  230    HB3  GLN  31           HB1      GLN  31   0.574  -2.124  -4.216
  231    HG2  GLN  31           HG2      GLN  31   1.389  -1.380  -6.326
  232    HG3  GLN  31           HG1      GLN  31   1.389  -3.024  -6.965
  233   HE21  GLN  31          HE21      GLN  31  -0.549  -0.285  -6.076
  234   HE22  GLN  31          HE22      GLN  31  -2.010  -0.815  -6.844
  235    H    TRP  32           HN       TRP  32   4.093  -2.129  -5.841
  236    HA   TRP  32           HA       TRP  32   4.990  -0.279  -3.772
  237    HB2  TRP  32           HB2      TRP  32   6.808  -1.281  -4.854
  238    HB3  TRP  32           HB1      TRP  32   6.050  -1.189  -6.434
  239    HD1  TRP  32           HD1      TRP  32   7.555   0.216  -7.865
  240    HE1  TRP  32           HE1      TRP  32   8.791   2.464  -7.673
  241    HE3  TRP  32           HE3      TRP  32   6.483   1.297  -2.992
  242    HZ2  TRP  32           HZ2      TRP  32   9.235   4.432  -5.722
  243    HZ3  TRP  32           HZ3      TRP  32   7.373   3.378  -2.040
  244    HH2  TRP  32           HH2      TRP  32   8.712   4.915  -3.375
  245    H    LYS  33           HN       LYS  33   3.253  -0.389  -6.771
  246    HA   LYS  33           HA       LYS  33   2.925   2.438  -7.042
  247    HB2  LYS  33           HB2      LYS  33   2.645   0.865  -8.924
  248    HB3  LYS  33           HB1      LYS  33   1.238   0.167  -8.135
  249    HG2  LYS  33           HG2      LYS  33   0.084   2.307  -8.313
  250    HG3  LYS  33           HG1      LYS  33   1.501   3.008  -9.097
  251    HD2  LYS  33           HD2      LYS  33  -0.253   0.787 -10.140
  252    HD3  LYS  33           HD1      LYS  33  -0.096   2.417 -10.796
  253    HE2  LYS  33           HE2      LYS  33   2.327   1.898 -11.209
  254    HE3  LYS  33           HE1      LYS  33   1.972   0.227 -10.775
  255    HZ1  LYS  33           HZ1      LYS  33   1.782   0.249 -13.072
  256    HZ2  LYS  33           HZ2      LYS  33   1.043   1.770 -13.108
  257    HZ3  LYS  33           HZ3      LYS  33   0.171   0.420 -12.575
  258    H    ARG  34           HN       ARG  34   1.403   3.752  -6.127
  259    HA   ARG  34           HA       ARG  34   0.159   2.820  -3.762
  260    HB2  ARG  34           HB2      ARG  34   1.002   5.130  -4.054
  261    HB3  ARG  34           HB1      ARG  34  -0.307   5.437  -5.190
  262    HG2  ARG  34           HG2      ARG  34  -1.948   5.076  -3.458
  263    HG3  ARG  34           HG1      ARG  34  -0.684   4.641  -2.309
  264    HD2  ARG  34           HD2      ARG  34   0.275   6.915  -2.601
  265    HD3  ARG  34           HD1      ARG  34  -1.117   7.330  -3.601
  266    HE   ARG  34           HE       ARG  34  -2.512   6.953  -1.629
  267   HH11  ARG  34          HH11      ARG  34   0.922   7.415  -1.149
  268   HH12  ARG  34          HH12      ARG  34   0.756   7.880   0.520
  269   HH21  ARG  34          HH21      ARG  34  -2.733   7.558   0.583
  270   HH22  ARG  34          HH22      ARG  34  -1.319   7.976   1.490
  271    HA   PRO  35           HA       PRO  35  -3.733   1.587  -5.571
  272    HB2  PRO  35           HB2      PRO  35  -4.870   0.677  -3.331
  273    HB3  PRO  35           HB1      PRO  35  -3.571  -0.215  -4.139
  274    HG2  PRO  35           HG2      PRO  35  -3.447   1.527  -1.715
  275    HG3  PRO  35           HG1      PRO  35  -2.613  -0.002  -2.041
  276    HD2  PRO  35           HD2      PRO  35  -1.469   2.495  -2.304
  277    HD3  PRO  35           HD1      PRO  35  -0.904   1.036  -3.137
  278    H    SER  36           HN       SER  36  -5.530   2.716  -5.909
  279    HA   SER  36           HA       SER  36  -6.090   5.097  -4.457
  280    HB2  SER  36           HB2      SER  36  -7.947   3.652  -6.358
  281    HB3  SER  36           HB1      SER  36  -7.909   5.381  -5.985
  282    HG   SER  36           HG       SER  36  -6.828   4.414  -8.009
  283    HA   PRO  37           HA       PRO  37  -8.530   3.382  -1.196
  284    HB2  PRO  37           HB2      PRO  37 -10.229   5.772  -1.211
  285    HB3  PRO  37           HB1      PRO  37  -9.079   5.225   0.012
  286    HG2  PRO  37           HG2      PRO  37  -8.607   7.388  -1.522
  287    HG3  PRO  37           HG1      PRO  37  -7.305   6.317  -0.975
  288    HD2  PRO  37           HD2      PRO  37  -8.676   6.418  -3.643
  289    HD3  PRO  37           HD1      PRO  37  -6.943   6.258  -3.270
  290    H    GLU  38           HN       GLU  38  -9.735   3.989  -4.213
  291    HA   GLU  38           HA       GLU  38 -12.487   3.394  -3.832
  292    HB2  GLU  38           HB2      GLU  38 -12.508   3.091  -6.297
  293    HB3  GLU  38           HB1      GLU  38 -11.797   4.613  -5.792
  294    HG2  GLU  38           HG2      GLU  38  -9.526   3.464  -6.045
  295    HG3  GLU  38           HG1      GLU  38 -10.420   2.179  -6.862
  296    H    ASP  39           HN       ASP  39 -12.171   1.596  -2.395
  297    HA   ASP  39           HA       ASP  39 -12.275  -0.917  -3.862
  298    HB2  ASP  39           HB2      ASP  39  -9.938  -0.805  -3.145
  299    HB3  ASP  39           HB1      ASP  39 -10.442  -0.495  -1.488
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1  -1.565  17.682  -0.393
    2    H2   GLY   1           HT2      GLY   1  -0.896  18.534   0.917
    3    H3   GLY   1           HT3      GLY   1  -2.569  18.520   0.678
    4    HA2  GLY   1           HA1      GLY   1  -1.923  17.027   2.480
    5    HA3  GLY   1           HA2      GLY   1  -2.712  16.193   1.149
    6    H    SER   2           HN       SER   2  -0.209  15.997   3.256
    7    HA   SER   2           HA       SER   2   1.569  14.566   1.450
    8    HB2  SER   2           HB2      SER   2   2.511  16.001   3.268
    9    HB3  SER   2           HB1      SER   2   1.813  14.903   4.454
   10    HG   SER   2           HG       SER   2   3.854  14.369   2.561
   11    HA   PRO   3           HA       PRO   3  -0.138  10.896   4.265
   12    HB2  PRO   3           HB2      PRO   3  -2.652  11.471   5.270
   13    HB3  PRO   3           HB1      PRO   3  -1.160  11.512   6.217
   14    HG2  PRO   3           HG2      PRO   3  -2.658  13.753   4.926
   15    HG3  PRO   3           HG1      PRO   3  -1.860  13.705   6.509
   16    HD2  PRO   3           HD2      PRO   3  -0.731  14.933   4.419
   17    HD3  PRO   3           HD1      PRO   3   0.248  14.028   5.592
   18    H    SER   4           HN       SER   4  -1.121   9.383   3.015
   19    HA   SER   4           HA       SER   4  -3.013  10.373   0.990
   20    HB2  SER   4           HB2      SER   4  -1.965   8.505  -0.460
   21    HB3  SER   4           HB1      SER   4  -1.034   9.983  -0.204
   22    HG   SER   4           HG       SER   4   0.225   8.929   1.280
   23    HA   PRO   5           HA       PRO   5  -5.788   7.409   2.887
   24    HB2  PRO   5           HB2      PRO   5  -7.303   8.025   0.406
   25    HB3  PRO   5           HB1      PRO   5  -7.832   8.085   2.091
   26    HG2  PRO   5           HG2      PRO   5  -7.348  10.331   0.758
   27    HG3  PRO   5           HG1      PRO   5  -6.858  10.168   2.456
   28    HD2  PRO   5           HD2      PRO   5  -5.191   9.974  -0.024
   29    HD3  PRO   5           HD1      PRO   5  -4.814  10.749   1.529
   30    H    LEU   6           HN       LEU   6  -6.324   5.292   2.559
   31    HA   LEU   6           HA       LEU   6  -5.869   4.088  -0.048
   32    HB2  LEU   6           HB2      LEU   6  -4.576   2.217   1.145
   33    HB3  LEU   6           HB1      LEU   6  -3.734   3.705   0.769
   34    HG   LEU   6           HG       LEU   6  -4.118   4.407   3.165
   35   HD11  LEU   6          HD11      LEU   6  -4.908   1.516   3.485
   36   HD12  LEU   6          HD12      LEU   6  -5.959   2.916   3.716
   37   HD13  LEU   6          HD13      LEU   6  -4.589   2.654   4.801
   38   HD21  LEU   6          HD21      LEU   6  -2.288   3.008   4.017
   39   HD22  LEU   6          HD22      LEU   6  -1.975   3.587   2.380
   40   HD23  LEU   6          HD23      LEU   6  -2.493   1.921   2.642
   41    HA   PRO   7           HA       PRO   7  -9.342   1.543   0.913
   42    HB2  PRO   7           HB2      PRO   7  -7.914  -0.869   0.009
   43    HB3  PRO   7           HB1      PRO   7  -9.335  -0.086  -0.679
   44    HG2  PRO   7           HG2      PRO   7  -6.971   0.014  -1.911
   45    HG3  PRO   7           HG1      PRO   7  -8.106   1.376  -1.934
   46    HD2  PRO   7           HD2      PRO   7  -5.656   0.983  -0.255
   47    HD3  PRO   7           HD1      PRO   7  -6.213   2.432  -1.107
   48    HA   PRO   8           HA       PRO   8  -8.781  -0.389   4.856
   49    HB2  PRO   8           HB2      PRO   8 -11.046  -2.155   4.115
   50    HB3  PRO   8           HB1      PRO   8 -10.889  -1.030   5.468
   51    HG2  PRO   8           HG2      PRO   8 -12.475  -0.455   3.408
   52    HG3  PRO   8           HG1      PRO   8 -11.497   0.804   4.189
   53    HD2  PRO   8           HD2      PRO   8 -10.970  -0.674   1.630
   54    HD3  PRO   8           HD1      PRO   8 -10.806   1.062   1.977
   55    H    GLY   9           HN       GLY   9  -7.503  -1.986   5.537
   56    HA2  GLY   9           HA2      GLY   9  -6.773  -4.259   5.601
   57    HA3  GLY   9           HA1      GLY   9  -7.363  -4.461   3.958
   58    H    TRP  10           HN       TRP  10  -6.074  -1.741   3.344
   59    HA   TRP  10           HA       TRP  10  -3.442  -2.807   2.716
   60    HB2  TRP  10           HB2      TRP  10  -4.955  -0.346   1.906
   61    HB3  TRP  10           HB1      TRP  10  -3.213  -0.431   1.670
   62    HD1  TRP  10           HD1      TRP  10  -6.475  -1.883   0.338
   63    HE1  TRP  10           HE1      TRP  10  -5.991  -3.109  -1.873
   64    HE3  TRP  10           HE3      TRP  10  -1.386  -1.711   0.462
   65    HZ2  TRP  10           HZ2      TRP  10  -3.697  -3.900  -3.365
   66    HZ3  TRP  10           HZ3      TRP  10  -0.117  -2.712  -1.392
   67    HH2  TRP  10           HH2      TRP  10  -1.254  -3.787  -3.262
   68    H    GLU  11           HN       GLU  11  -1.513  -2.034   3.461
   69    HA   GLU  11           HA       GLU  11  -1.551   0.223   5.330
   70    HB2  GLU  11           HB2      GLU  11  -0.058  -0.955   6.867
   71    HB3  GLU  11           HB1      GLU  11  -1.581  -1.816   6.700
   72    HG2  GLU  11           HG2      GLU  11  -0.642  -3.562   5.607
   73    HG3  GLU  11           HG1      GLU  11   0.658  -2.583   4.916
   74    H    GLU  12           HN       GLU  12   0.525   1.225   5.587
   75    HA   GLU  12           HA       GLU  12   2.129   1.064   3.173
   76    HB2  GLU  12           HB2      GLU  12   1.364   3.258   4.085
   77    HB3  GLU  12           HB1      GLU  12   2.358   2.974   5.506
   78    HG2  GLU  12           HG2      GLU  12   4.354   3.119   4.264
   79    HG3  GLU  12           HG1      GLU  12   3.492   3.029   2.729
   80    H    ARG  13           HN       ARG  13   3.647  -0.368   3.115
   81    HA   ARG  13           HA       ARG  13   5.123  -1.130   5.530
   82    HB2  ARG  13           HB2      ARG  13   3.987  -2.883   4.099
   83    HB3  ARG  13           HB1      ARG  13   5.107  -2.476   2.811
   84    HG2  ARG  13           HG2      ARG  13   6.962  -3.294   4.056
   85    HG3  ARG  13           HG1      ARG  13   5.987  -3.454   5.518
   86    HD2  ARG  13           HD2      ARG  13   4.790  -5.274   4.638
   87    HD3  ARG  13           HD1      ARG  13   5.348  -4.958   2.995
   88    HE   ARG  13           HE       ARG  13   7.501  -5.564   4.796
   89   HH11  ARG  13          HH11      ARG  13   4.913  -7.061   2.973
   90   HH12  ARG  13          HH12      ARG  13   5.797  -8.517   2.637
   91   HH21  ARG  13          HH21      ARG  13   8.686  -7.481   4.345
   92   HH22  ARG  13          HH22      ARG  13   7.957  -8.731   3.381
   93    H    GLN  14           HN       GLN  14   7.558  -1.810   4.648
   94    HA   GLN  14           HA       GLN  14   8.520   0.581   3.229
   95    HB2  GLN  14           HB2      GLN  14   8.860   0.106   5.917
   96    HB3  GLN  14           HB1      GLN  14  10.349  -0.522   5.246
   97    HG2  GLN  14           HG2      GLN  14   9.264   2.250   4.796
   98    HG3  GLN  14           HG1      GLN  14  10.506   1.824   5.971
   99   HE21  GLN  14          HE21      GLN  14  11.836  -0.064   4.302
  100   HE22  GLN  14          HE22      GLN  14  12.614   0.793   3.020
  101    H    ASP  15           HN       ASP  15   9.575   0.028   1.437
  102    HA   ASP  15           HA       ASP  15  10.301  -2.698   0.904
  103    HB2  ASP  15           HB2      ASP  15   9.485  -1.246  -0.893
  104    HB3  ASP  15           HB1      ASP  15  10.854  -0.162  -0.649
  105    H    VAL  16           HN       VAL  16  12.377  -3.512   0.586
  106    HA   VAL  16           HA       VAL  16  14.304  -2.962   2.434
  107    HB   VAL  16           HB       VAL  16  14.804  -3.951  -0.351
  108   HG11  VAL  16          HG11      VAL  16  16.707  -5.128   0.623
  109   HG12  VAL  16          HG12      VAL  16  16.341  -4.412   2.191
  110   HG13  VAL  16          HG13      VAL  16  16.837  -3.382   0.850
  111   HG21  VAL  16          HG21      VAL  16  14.506  -6.218   0.618
  112   HG22  VAL  16          HG22      VAL  16  13.033  -5.248   0.627
  113   HG23  VAL  16          HG23      VAL  16  13.959  -5.462   2.115
  114    H    LEU  17           HN       LEU  17  13.953  -1.506  -0.772
  115    HA   LEU  17           HA       LEU  17  16.502  -0.168  -0.611
  116    HB2  LEU  17           HB2      LEU  17  14.263   0.064  -2.614
  117    HB3  LEU  17           HB1      LEU  17  15.828   0.839  -2.770
  118    HG   LEU  17           HG       LEU  17  15.375  -2.149  -2.688
  119   HD11  LEU  17          HD11      LEU  17  16.076  -0.351  -5.001
  120   HD12  LEU  17          HD12      LEU  17  14.504  -1.101  -4.730
  121   HD13  LEU  17          HD13      LEU  17  15.918  -2.104  -5.050
  122   HD21  LEU  17          HD21      LEU  17  17.547  -1.498  -1.786
  123   HD22  LEU  17          HD22      LEU  17  17.865  -0.531  -3.223
  124   HD23  LEU  17          HD23      LEU  17  17.728  -2.282  -3.353
  125    H    GLY  18           HN       GLY  18  13.462   0.489   0.706
  126    HA2  GLY  18           HA2      GLY  18  13.204   2.317   2.194
  127    HA3  GLY  18           HA1      GLY  18  14.389   3.228   1.255
  128    H    ARG  19           HN       ARG  19  12.174   1.547  -0.612
  129    HA   ARG  19           HA       ARG  19  10.711   3.933  -1.335
  130    HB2  ARG  19           HB2      ARG  19  10.631   1.062  -2.238
  131    HB3  ARG  19           HB1      ARG  19   9.418   2.221  -2.749
  132    HG2  ARG  19           HG2      ARG  19  11.022   2.058  -4.471
  133    HG3  ARG  19           HG1      ARG  19  11.254   3.619  -3.685
  134    HD2  ARG  19           HD2      ARG  19  13.194   2.912  -2.600
  135    HD3  ARG  19           HD1      ARG  19  12.841   1.210  -2.897
  136    HE   ARG  19           HE       ARG  19  13.155   1.920  -5.362
  137   HH11  ARG  19          HH11      ARG  19  14.935   3.196  -2.636
  138   HH12  ARG  19          HH12      ARG  19  16.394   3.474  -3.539
  139   HH21  ARG  19          HH21      ARG  19  15.065   2.285  -6.569
  140   HH22  ARG  19          HH22      ARG  19  16.450   2.992  -5.792
  141    H    THR  20           HN       THR  20   8.435   4.204  -0.918
  142    HA   THR  20           HA       THR  20   7.528   2.811   1.413
  143    HB   THR  20           HB       THR  20   5.299   4.054   0.436
  144    HG1  THR  20           HG1      THR  20   5.871   5.574  -0.919
  145   HG21  THR  20          HG21      THR  20   6.133   4.216   2.685
  146   HG22  THR  20          HG22      THR  20   5.907   5.845   2.042
  147   HG23  THR  20          HG23      THR  20   7.531   5.147   2.141
  148    H    TYR  21           HN       TYR  21   7.184   0.813   1.181
  149    HA   TYR  21           HA       TYR  21   5.876  -0.355  -1.127
  150    HB2  TYR  21           HB2      TYR  21   7.838  -1.249   0.323
  151    HB3  TYR  21           HB1      TYR  21   6.587  -1.719   1.458
  152    HD1  TYR  21           HD1      TYR  21   7.289  -2.040  -2.197
  153    HD2  TYR  21           HD2      TYR  21   5.907  -3.866   1.379
  154    HE1  TYR  21           HE1      TYR  21   7.052  -4.176  -3.391
  155    HE2  TYR  21           HE2      TYR  21   5.659  -5.990   0.220
  156    HH   TYR  21           HH       TYR  21   5.440  -6.896  -2.025
  157    H    TYR  22           HN       TYR  22   3.943  -1.851  -0.719
  158    HA   TYR  22           HA       TYR  22   2.459  -1.190   1.709
  159    HB2  TYR  22           HB2      TYR  22   1.180  -1.056  -1.031
  160    HB3  TYR  22           HB1      TYR  22   0.351  -0.880   0.501
  161    HD1  TYR  22           HD2      TYR  22   2.666   0.757  -1.843
  162    HD2  TYR  22           HD1      TYR  22   0.455   1.160   1.766
  163    HE1  TYR  22           HE2      TYR  22   3.096   3.175  -1.862
  164    HE2  TYR  22           HE1      TYR  22   0.879   3.579   1.766
  165    HH   TYR  22           HH       TYR  22   2.544   5.140   0.867
  166    H    VAL  23           HN       VAL  23   0.768  -2.707   2.196
  167    HA   VAL  23           HA       VAL  23   0.711  -5.161   0.633
  168    HB   VAL  23           HB       VAL  23   2.429  -5.832   2.074
  169   HG11  VAL  23          HG11      VAL  23   2.396  -3.945   3.594
  170   HG12  VAL  23          HG12      VAL  23   2.456  -5.468   4.490
  171   HG13  VAL  23          HG13      VAL  23   0.937  -4.575   4.363
  172   HG21  VAL  23          HG21      VAL  23   0.642  -7.475   2.017
  173   HG22  VAL  23          HG22      VAL  23  -0.129  -6.704   3.407
  174   HG23  VAL  23          HG23      VAL  23   1.445  -7.486   3.590
  175    H    ASN  24           HN       ASN  24  -1.273  -5.918   0.469
  176    HA   ASN  24           HA       ASN  24  -3.396  -4.948   2.215
  177    HB2  ASN  24           HB2      ASN  24  -3.699  -5.124  -0.281
  178    HB3  ASN  24           HB1      ASN  24  -3.563  -6.871  -0.128
  179   HD21  ASN  24          HD21      ASN  24  -5.783  -5.238  -1.104
  180   HD22  ASN  24          HD22      ASN  24  -7.152  -5.666  -0.135
  181    H    HIS  25           HN       HIS  25  -4.185  -6.091   3.879
  182    HA   HIS  25           HA       HIS  25  -2.806  -8.524   4.581
  183    HB2  HIS  25           HB2      HIS  25  -4.745  -6.723   5.981
  184    HB3  HIS  25           HB1      HIS  25  -4.402  -8.321   6.633
  185    HD1  HIS  25           HD1      HIS  25  -2.839  -8.053   8.495
  186    HD2  HIS  25           HD2      HIS  25  -1.917  -5.504   5.346
  187    HE1  HIS  25           HE1      HIS  25  -0.712  -6.892   9.165
  188    HE2  HIS  25           HE2      HIS  25  -0.310  -5.191   7.357
  189    H    GLU  26           HN       GLU  26  -5.720  -7.819   2.960
  190    HA   GLU  26           HA       GLU  26  -7.118 -10.196   3.797
  191    HB2  GLU  26           HB2      GLU  26  -8.330  -8.176   3.040
  192    HB3  GLU  26           HB1      GLU  26  -7.617  -8.365   1.440
  193    HG2  GLU  26           HG2      GLU  26  -8.787 -10.414   1.090
  194    HG3  GLU  26           HG1      GLU  26  -9.383 -10.413   2.749
  195    H    SER  27           HN       SER  27  -5.726  -9.129   0.714
  196    HA   SER  27           HA       SER  27  -5.812 -11.849  -0.286
  197    HB2  SER  27           HB2      SER  27  -5.092 -10.752  -2.415
  198    HB3  SER  27           HB1      SER  27  -6.576 -10.088  -1.751
  199    HG   SER  27           HG       SER  27  -4.281  -8.836  -2.306
  200    H    ARG  28           HN       ARG  28  -3.724 -10.082   1.526
  201    HA   ARG  28           HA       ARG  28  -1.563 -10.316   2.173
  202    HB2  ARG  28           HB2      ARG  28  -1.632 -12.907   0.606
  203    HB3  ARG  28           HB1      ARG  28  -0.487 -12.478   1.870
  204    HG2  ARG  28           HG2      ARG  28  -3.456 -12.785   2.291
  205    HG3  ARG  28           HG1      ARG  28  -2.265 -14.046   2.610
  206    HD2  ARG  28           HD2      ARG  28  -1.372 -12.930   4.421
  207    HD3  ARG  28           HD1      ARG  28  -1.923 -11.355   3.849
  208    HE   ARG  28           HE       ARG  28  -4.111 -11.873   4.614
  209   HH11  ARG  28          HH11      ARG  28  -1.680 -14.198   5.599
  210   HH12  ARG  28          HH12      ARG  28  -2.659 -14.861   6.872
  211   HH21  ARG  28          HH21      ARG  28  -5.384 -12.739   6.290
  212   HH22  ARG  28          HH22      ARG  28  -4.768 -14.039   7.265
  213    H    THR  29           HN       THR  29  -2.320  -9.036  -0.353
  214    HA   THR  29           HA       THR  29  -0.199  -9.642  -2.223
  215    HB   THR  29           HB       THR  29  -2.354  -7.531  -2.378
  216    HG1  THR  29           HG1      THR  29  -2.228 -10.242  -3.225
  217   HG21  THR  29          HG21      THR  29  -0.563  -8.712  -4.506
  218   HG22  THR  29          HG22      THR  29  -0.480  -7.067  -3.868
  219   HG23  THR  29          HG23      THR  29  -1.893  -7.587  -4.789
  220    H    THR  30           HN       THR  30   1.748  -8.785  -1.913
  221    HA   THR  30           HA       THR  30   2.022  -6.125  -0.765
  222    HB   THR  30           HB       THR  30   4.524  -6.725  -1.272
  223    HG1  THR  30           HG1      THR  30   4.798  -9.048  -1.181
  224   HG21  THR  30          HG21      THR  30   2.834  -7.955   0.895
  225   HG22  THR  30          HG22      THR  30   3.796  -6.473   0.959
  226   HG23  THR  30          HG23      THR  30   4.596  -8.040   0.877
  227    H    GLN  31           HN       GLN  31   2.370  -4.344  -1.968
  228    HA   GLN  31           HA       GLN  31   2.855  -4.722  -4.846
  229    HB2  GLN  31           HB2      GLN  31   0.456  -4.424  -4.455
  230    HB3  GLN  31           HB1      GLN  31   0.772  -2.930  -3.584
  231    HG2  GLN  31           HG2      GLN  31   1.673  -1.940  -5.641
  232    HG3  GLN  31           HG1      GLN  31   1.296  -3.433  -6.502
  233   HE21  GLN  31          HE21      GLN  31  -0.022  -0.628  -4.909
  234   HE22  GLN  31          HE22      GLN  31  -1.616  -0.759  -5.569
  235    H    TRP  32           HN       TRP  32   4.069  -3.175  -5.849
  236    HA   TRP  32           HA       TRP  32   5.230  -1.117  -4.141
  237    HB2  TRP  32           HB2      TRP  32   6.945  -2.292  -5.146
  238    HB3  TRP  32           HB1      TRP  32   6.149  -2.386  -6.707
  239    HD1  TRP  32           HD1      TRP  32   7.612  -1.057  -8.349
  240    HE1  TRP  32           HE1      TRP  32   8.714   1.268  -8.371
  241    HE3  TRP  32           HE3      TRP  32   6.575   0.366  -3.555
  242    HZ2  TRP  32           HZ2      TRP  32   9.092   3.422  -6.582
  243    HZ3  TRP  32           HZ3      TRP  32   7.353   2.558  -2.784
  244    HH2  TRP  32           HH2      TRP  32   8.580   4.059  -4.270
  245    H    LYS  33           HN       LYS  33   3.216  -0.159  -4.199
  246    HA   LYS  33           HA       LYS  33   3.170   2.237  -5.575
  247    HB2  LYS  33           HB2      LYS  33   2.591   1.038  -7.599
  248    HB3  LYS  33           HB1      LYS  33   1.301   0.178  -6.769
  249    HG2  LYS  33           HG2      LYS  33   0.169   2.360  -6.406
  250    HG3  LYS  33           HG1      LYS  33   1.409   3.112  -7.415
  251    HD2  LYS  33           HD2      LYS  33   0.743   1.761  -9.310
  252    HD3  LYS  33           HD1      LYS  33  -0.435   0.898  -8.313
  253    HE2  LYS  33           HE2      LYS  33  -1.636   3.001  -7.930
  254    HE3  LYS  33           HE1      LYS  33  -0.463   3.847  -8.938
  255    HZ1  LYS  33           HZ1      LYS  33  -2.494   3.332 -10.141
  256    HZ2  LYS  33           HZ2      LYS  33  -2.270   1.674  -9.857
  257    HZ3  LYS  33           HZ3      LYS  33  -1.164   2.530 -10.821
  258    H    ARG  34           HN       ARG  34   1.668   3.615  -4.666
  259    HA   ARG  34           HA       ARG  34   0.217   2.847  -2.385
  260    HB2  ARG  34           HB2      ARG  34   0.763   5.169  -2.663
  261    HB3  ARG  34           HB1      ARG  34  -0.076   5.244  -4.212
  262    HG2  ARG  34           HG2      ARG  34  -2.198   4.746  -3.003
  263    HG3  ARG  34           HG1      ARG  34  -1.308   4.893  -1.489
  264    HD2  ARG  34           HD2      ARG  34  -0.831   7.185  -1.901
  265    HD3  ARG  34           HD1      ARG  34  -1.432   7.081  -3.557
  266    HE   ARG  34           HE       ARG  34  -3.312   6.529  -1.385
  267   HH11  ARG  34          HH11      ARG  34  -2.152   8.759  -3.827
  268   HH12  ARG  34          HH12      ARG  34  -3.627   9.671  -3.867
  269   HH21  ARG  34          HH21      ARG  34  -5.249   7.723  -1.451
  270   HH22  ARG  34          HH22      ARG  34  -5.384   9.090  -2.520
  271    HA   PRO  35           HA       PRO  35  -3.374   1.110  -4.389
  272    HB2  PRO  35           HB2      PRO  35  -4.887   0.805  -2.155
  273    HB3  PRO  35           HB1      PRO  35  -3.588  -0.309  -2.592
  274    HG2  PRO  35           HG2      PRO  35  -3.612   1.866  -0.565
  275    HG3  PRO  35           HG1      PRO  35  -2.787   0.300  -0.524
  276    HD2  PRO  35           HD2      PRO  35  -1.569   2.712  -1.104
  277    HD3  PRO  35           HD1      PRO  35  -0.942   1.126  -1.578
  278    H    SER  36           HN       SER  36  -4.333   2.696  -5.562
  279    HA   SER  36           HA       SER  36  -5.416   5.086  -4.643
  280    HB2  SER  36           HB2      SER  36  -6.451   3.346  -6.906
  281    HB3  SER  36           HB1      SER  36  -6.707   5.081  -6.722
  282    HG   SER  36           HG       SER  36  -4.980   4.525  -8.180
  283    HA   PRO  37           HA       PRO  37  -8.874   3.719  -2.251
  284    HB2  PRO  37           HB2      PRO  37 -10.336   6.168  -2.858
  285    HB3  PRO  37           HB1      PRO  37  -9.543   5.692  -1.355
  286    HG2  PRO  37           HG2      PRO  37  -8.612   7.701  -2.900
  287    HG3  PRO  37           HG1      PRO  37  -7.542   6.658  -1.946
  288    HD2  PRO  37           HD2      PRO  37  -8.222   6.494  -4.864
  289    HD3  PRO  37           HD1      PRO  37  -6.628   6.401  -4.075
  290    H    GLU  38           HN       GLU  38  -8.891   3.119  -5.176
  291    HA   GLU  38           HA       GLU  38 -11.732   3.177  -5.786
  292    HB2  GLU  38           HB2      GLU  38 -11.025   2.020  -7.899
  293    HB3  GLU  38           HB1      GLU  38 -10.300   3.604  -7.669
  294    HG2  GLU  38           HG2      GLU  38  -8.229   2.503  -6.873
  295    HG3  GLU  38           HG1      GLU  38  -8.973   0.939  -7.195
  296    H    ASP  39           HN       ASP  39 -12.184   1.963  -3.849
  297    HA   ASP  39           HA       ASP  39 -12.153  -0.902  -4.319
  298    HB2  ASP  39           HB2      ASP  39 -10.052  -0.512  -3.091
  299    HB3  ASP  39           HB1      ASP  39 -10.939   0.304  -1.815