*HEADER    LIGASE                                  06-APR-00   1EQX              
*TITLE     SOLUTION STRUCTURE DETERMINATION AND MUTATIONAL ANALYSIS OF           
*TITLE    2 THE PAPILLOMAVIRUS E6-INTERACTING PEPTIDE OF E6AP                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PAPILLOMAVIRUS E6-ASSOCIATED PROTEIN;                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: E6-INTERACTING PEPTIDE;                                    
*COMPND   5 EC: 6.3.2.-                                                          
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN                                               
*KEYWDS    PEPTIDE, ALPHA HELIX                                                  
*EXPDTA    NMR, 24 STRUCTURES                                                    
*AUTHOR    X.BE, Y.HONG, E.J.ANDROPHY, J.J.CHEN, J.D.BALEJA                      
*REVDAT   1   28-FEB-01 1EQX    0                                                


set message=on   echo=on   end
! intra noes   syntax  assign d, d-, d+
assign (resid  1 and  name HA )(resid 1 and  name HT#  ) 3.8 2.0 0.8
assign (resid  1 and  name HA )(resid 2 and  name HD1 ) 3.0 1.2 0.6
assign (resid  1 and  name HA )(resid 2 and  name HD2 ) 3.0 1.2 0.6
assign (resid  1 and  name HA )(resid 2 and  name HG1 ) 4.0 2.2 0.8
assign (resid  1 and  name HB )(resid 2 and  name HD1 ) 4.0 2.2 0.8
assign (resid  1 and  name HG2# or resid  1 and  name HD1#)(resid 2 and  name HD1 ) 3.5 1.7 1.8
assign (resid  1 and  name HG2# or resid  1 and  name HD1#)(resid 2 and  name HD2 ) 4.0 2.2 1.9
assign (resid  1 and  name HT# )(resid 2 and  name HD1 ) 5.0 3.2 1.0
assign (resid  1 and  name HT# )(resid 2 and  name HD2 ) 5.5 3.7 1.1
assign (resid  1 and  name HG2# or resid  1 and  name HD1#)(resid 3 and  name HN  ) 4.0 2.2 1.9
assign (resid  1 and  name HG2# or resid  1 and  name HD1#)(resid 4 and  name HN  ) 4.5 2.7 2.0

assign (resid 2 and  name HD1 )(resid 3 and  name HN  ) 4.8 3.0 1.0
assign (resid 2 and  name HD2 )(resid 3 and  name HN  ) 4.5 2.7 1.0 
assign (resid 2 and  name HA )(resid 3 and  name HN  ) 2.5 0.7 0.5
assign (resid 2 and  name HB1 )(resid 3 and  name HN  ) 4.0 2.2 0.8
assign (resid 2 and  name HB1 )(resid 4 and  name HN  ) 5.0 3.2 1.0
assign (resid 2 and  name HB2 )(resid 4 and  name HN  ) 4.5 2.7 0.9

assign (resid 3 and  name HA )(resid 3 and  name HN  ) 3.3 1.5 0.7
assign (resid 3 and  name HB1 )(resid 4 and  name HN  ) 4.0 2.2 0.8
assign (resid 3 and  name HB2 )(resid 4 and  name HN  ) 4.0 2.2 0.8
assign (resid 3 and  name HG# )(resid 4 and  name HN  ) 4.0 2.2 1.9
assign (resid 3 and  name HN )(resid 4 and  name HN  ) 3.5 1.7 0.7
assign (resid 3 and  name HA )(resid 4 and  name HN  ) 2.8 1.0 0.6
assign (resid 3 and  name HA )(resid 5 and  name HN  ) 4.0 2.2 0.8
assign (resid 3 and  name HA )(resid 6 and  name HN  ) 4.5 2.7 0.9

assign (resid 4 and  name HA )(resid 4 and  name HN  ) 3.3 1.5 0.7
assign (resid 4 and  name HN )(resid 4 and  name HB1  ) 3.5 1.7 0.7
assign (resid 4 and  name HN )(resid 4 and  name HB2  ) 3.5 1.7 0.7
assign (resid 4 and  name HA )(resid 5 and  name HN  ) 3.5 1.7 0.7
assign (resid 4 and  name HN )(resid 5 and  name HN  ) 3.8 2.0 0.7
assign (resid 4 and  name HA )(resid 7 and  name HN  ) 4.0 2.2 0.8
assign (resid 4 and  name HA )(resid 7 and  name HB1  ) 4.0 2.2 0.8
assign (resid 4 and  name HA )(resid 7 and  name HB2  ) 4.0 2.2 0.8
assign (resid 4 and  name HA )(resid 7 and  name HD##  ) 4.0 2.2 1.9

assign (resid 5 and  name HA )(resid 5 and  name HN  ) 3.0 1.2 0.6
assign (resid 5 and  name HA )(resid 6 and  name HN  ) 3.0 1.2 0.6
assign (resid 5 and  name HB1 )(resid 5 and  name HN  ) 3.8 2.0 0.7
assign (resid 5 and  name HB2 )(resid 6 and  name HN  ) 3.8 2.0 0.7
assign (resid 5 and  name HB2 )(resid 5 and  name HN  ) 3.5 1.7 0.7
assign (resid 5 and  name HB1 )(resid 6 and  name HN  ) 4.0 2.2 0.8
assign (resid 5 and  name HA )(resid 7 and  name HN  ) 4.0 2.2 0.8
assign (resid 5 and  name HN )(resid 6 and  name HN  ) 3.5 1.7 0.7
assign (resid 5 and  name HN )(resid 7 and  name HN  ) 4.0 2.2 0.8
assign (resid 5 and  name HA )(resid 8 and  name HN  ) 4.0 2.2 0.8
assign (resid 5 and  name HB1 )(resid 8 and  name HN  )4.5 2.7 0.9
assign (resid 5 and  name HB2 )(resid 8 and  name HN  ) 4.5 2.7 1.0 

assign (resid 6 and  name HA )(resid 6 and  name HN  ) 3.0 1.2 0.6
assign (resid 6 and  name HA )(resid 7 and  name HN  ) 3.0 1.2 0.6
assign (resid 6 and  name HB1 )(resid 7 and  name HN  ) 3.0 1.2 0.6
assign (resid 6 and  name HB2 )(resid 7 and  name HN  ) 3.0 1.2 0.6
assign (resid 6 and  name HB1 )(resid 7 and  name HD##  ) 4.5 2.7 2.0
assign (resid 6 and  name HB2 )(resid 7 and  name HD##  ) 4.5 2.7 2.0
assign (resid 6 and  name HG# )(resid 7 and  name HN  ) 4.0 2.2 1.9
assign (resid 6 and  name HN )(resid 7 and  name HN  ) 3.0 1.2 0.6
assign (resid 6 and  name HB1 )(resid 8 and  name HN  ) 4.5 2.7 2.0
assign (resid 6 and  name HB2 )(resid 8 and  name HN  ) 4.5 2.7 2.0
assign (resid 6 and  name HN )(resid 8 and  name HN  ) 5.0 3.2 1.0
assign (resid 6 and  name HN )(resid 9 and  name HB#  ) 4.0 2.2 1.9

assign (resid 7 and  name HA )(resid 7 and  name HN  ) 3.0 1.2 0.6
assign (resid 7 and  name HA )(resid 8 and  name HN  ) 3.0 1.2 0.6
assign (resid 7 and  name HB1 )(resid 8 and  name HN  ) 3.5 1.7 0.7
assign (resid 7 and  name HB2 )(resid 8 and  name HN  ) 3.0 1.2 0.6
assign (resid 7 and  name HD## )(resid 8 and  name HN  ) 4.0 2.2 1.9
assign (resid 7 and  name HA )(resid 9 and  name HN  ) 4.0 2.2 0.8
assign (resid 7 and  name HA )(resid 10 and  name HN  ) 3.5 1.7 0.7
assign (resid 7 and  name HA )(resid 10 and  name HG#  ) 4.0 2.2 1.9
assign (resid 7 and  name HA )(resid 10 and  name HB1  ) 3.5 1.7 0.7
assign (resid 7 and  name HA )(resid 10 and  name HB2  ) 3.5 1.7 0.7
assign (resid 7 and  name HA )(resid 11 and  name HN  ) 4.0 2.2 0.8
assign (resid 7 and  name HN )(resid 10 and  name HB1  ) 5.0 3.2 1.0
assign (resid 7 and  name HD## )(resid 11 and  name HN  ) 4.0 2.2 1.9

assign (resid 8 and  name HA )(resid 8 and  name HN  ) 3.0 1.2 0.6
assign (resid 8 and  name HB )(resid 8 and  name HN  ) 3.0 1.2 0.6
assign (resid 8 and  name HA )(resid 9 and  name HN  ) 3.5 1.7 0.7
assign (resid 8 and  name HG2# )(resid 9 and  name HN  ) 3.5 1.7 1.8
assign (resid 8 and  name HN )(resid 9 and  name HN  ) 3.0 1.2 0.6
assign (resid 8 and  name HB )(resid 9 and  name HB#  ) 4.0 2.2 1.9
assign (resid 8 and  name HB )(resid 9 and  name HN  ) 3.0 1.2 0.6
assign (resid 8 and  name HB )(resid 11 and  name HN  ) 4.8 3.0 1.0
assign (resid 8 and  name HN )(resid 11 and  name HB1  ) 5.5 3.7 1.1
assign (resid 8 and  name HN )(resid 11 and  name HB2  ) 5.5 3.7 1.1
assign (resid 8 and  name HG2# )(resid 11 and  name HN  ) 4.0 2.2 1.9
assign (resid 8 and  name HB )(resid 12 and  name HN  ) 4.0 2.2 1.0
assign (resid 8 and  name HG2# )(resid 12 and  name HN  ) 4.5 2.7 2.0
assign (resid 8 and  name HB )(resid 12 and  name HD##  ) 4.5 2.7 2.0

assign (resid 9 and  name HA )(resid 9 and  name HN  ) 3.0 1.2 0.6
assign (resid 9 and  name HA )(resid 10 and  name HN  ) 3.5 1.7 0.7
assign (resid 9 and  name HD## )(resid 10 and  name HA  ) 4.0 2.2 1.9
assign (resid 9 and  name HD## )(resid 10 and  name HB1  ) 3.5 1.7 1.8
assign (resid 9 and  name HD## )(resid 10 and  name HB2  ) 3.5 1.7 1.8
assign (resid 9 and  name HB# )(resid 10 and  name HN  ) 3.0 1.2 1.7
assign (resid 9 and  name HB# )(resid 11 and  name HN  ) 4.5 2.7 2.0
assign (resid 9 and  name HG )(resid 11 and  name HN  ) 4.5 2.7 0.9
assign (resid 9 and  name HB# )(resid 12 and  name HD##  ) 2.5 0.7 1.7
assign (resid 9 and  name HB# )(resid 13 and  name HD##  ) 4.0 2.2 1.9

assign (resid 10 and  name HA )(resid 10 and  name HN  ) 3.0 1.2 0.6
assign (resid 10 and  name HB2 )(resid 11 and  name HN  ) 3.5 1.7 0.7
assign (resid 10 and  name HA )(resid 11 and  name HN  ) 3.5 1.7 0.7
assign (resid 10 and  name HN )(resid 11 and  name HN  ) 3.3 1.5 0.7
assign (resid 10 and  name HG# )(resid 11 and  name HN  ) 4.5 2.7 2.0
assign (resid 10 and  name HN )(resid 12 and  name HN  ) 4.5 2.7 0.9
assign (resid 10 and  name HA )(resid 13 and  name HN  ) 3.8 2.0 0.7

assign (resid 11 and  name HA )(resid 11 and  name HN  ) 2.5 0.7 0.5
assign (resid 11 and  name HA )(resid 12 and  name HN  ) 3.5 1.7 0.7
assign (resid 11 and  name HB1 )(resid 12 and  name HN  ) 3.5 1.7 0.7
assign (resid 11 and  name HB2 )(resid 12 and  name HN  ) 3.5 1.7 0.7
assign (resid 11 and  name HG1 )(resid 12 and  name HN  ) 4.3 2.5 0.9
assign (resid 11 and  name HG2 )(resid 12 and  name HN  ) 4.5 2.7 0.9
assign (resid 11 and  name HN )(resid 12 and  name HN  ) 3.0 1.2 0.6
assign (resid 11 and  name HN )(resid 13 and  name HN  ) 4.3 2.5 0.9
assign (resid 11 and  name HA )(resid 14 and  name HN  )  3.5 1.7 0.7
assign (resid 11 and  name HB2 )(resid 15 and  name HN  )  5.0 3.2 1.0

assign (resid 12 and  name HA )(resid 12 and  name HN  ) 3.0 1.2 0.6
assign (resid 12 and  name HA )(resid 13 and  name HN  ) 3.5 1.7 0.7
assign (resid 12 and  name HB# )(resid 13 and  name HN  ) 3.5 1.7 1.8
assign (resid 12 and  name HG )(resid 13 and  name HN  ) 3.5 1.7 0.7 
assign (resid 12 and  name HN )(resid 13 and  name HN  ) 3.0 1.2 0.6
assign (resid 12 and  name HD## )(resid 16 and  name HB# )  3.5 1.7 1.8

assign (resid 13 and  name HA )(resid 13 and  name HN  ) 3.0 1.2 0.6
assign (resid 13 and  name HN )(resid 14 and  name HA#  ) 4.0 2.2 1.9
assign (resid 13 and  name HB# )(resid 14 and  name HN  ) 3.5 1.7 1.8
assign (resid 13 and  name HG )(resid 14 and  name HN  ) 4.0 2.2 0.9
assign (resid 13 and  name HD## )(resid 14 and  name HN  ) 4.0 2.2 1.9
assign (resid 13 and  name HN )(resid 14 and  name HN  ) 2.8 1.0 0.6
assign (resid 13 and  name HN )(resid 15 and  name HN  ) 4.5 2.7 0.9
assign (resid 13 and  name HN )(resid 16 and  name HB#  ) 4.5 2.7 2.0

assign (resid 14 and  name HA# )(resid 14 and  name HN  ) 2.5 0.7 1.6
assign (resid 14 and  name HA# )(resid 15 and  name HN  ) 3.0 1.2 1.7
assign (resid 14 and  name HN )(resid 15 and  name HN  ) 3.3 1.5 0.7
assign (resid 14 and  name HN )(resid 16 and  name HN  ) 4.0 2.2 0.8
assign (resid 14 and  name HA# )(resid 17 and  name HN  ) 4.0 2.2 1.9
assign (resid 14 and  name HN )(resid 17 and  name HN  ) 3.5 1.7 1.0 

assign (resid 15 and  name HA )(resid 15 and  name HN  )  2.8 1.0 0.6
assign (resid 15 and  name HN )(resid 16 and  name HN  )  2.8 1.0 0.6
assign (resid 15 and  name HB# )(resid 17 and  name HN  ) 4.0 2.2 1.9
assign (resid 15 and  name HA )(resid 18 and  name HD#  ) 4.0 2.2 1.9
assign (resid 15 and  name HA )(resid 18 and  name HG1  ) 4.0 2.2 0.8
assign (resid 15 and  name HA )(resid 18 and  name HG2  ) 3.0 1.2 0.6
assign (resid 15 and  name HA )(resid 18 and  name HN  ) 4.0 2.2 0.8

assign (resid 16 and  name HA )(resid 16 and  name HN  ) 2.8 1.0 0.6
assign (resid 16 and  name HA )(resid 17 and  name HN  ) 3.0 1.2 0.6
assign (resid 16 and  name HB# )(resid 17 and  name HN  ) 4.0 2.2 1.9
assign (resid 16 and  name HN )(resid 17 and  name HN  ) 3.5 1.7 0.7
assign (resid 16 and  name HN )(resid 18 and  name HN  ) 4.0 2.2 0.8

assign (resid 17 and  name HA )(resid 17 and  name HN  ) 3.0 1.2 0.6
assign (resid 17 and  name HN )(resid 18 and  name HN  ) 3.0 1.2 0.6
assign (resid 18 and  name HA )(resid 18 and  name HN  ) 2.8 1.0 0.6


!
set message=on echo=on end


restraints dihedral
  nassign=400
    assign ( resid 2 and name c )
           ( resid 3 and name n )
           ( resid 3 and name ca)
           ( resid 3 and name c)  1 -62 23 2
    assign ( resid 4 and name c )
           ( resid 5 and name n )
           ( resid 5 and name ca)
           ( resid 5 and name c)  1 -62 23 2
    assign ( resid 5 and name c )
           ( resid 6 and name n )
           ( resid 6 and name ca)
           ( resid 6 and name c)  1 -62 23 2
    assign ( resid 6 and name c )
           ( resid 7 and name n )
           ( resid 7 and name ca)
           ( resid 7 and name c)  1 -62 23 2
    assign ( resid 7 and name c )
           ( resid 8 and name n )
           ( resid 8 and name ca)
           ( resid 8 and name c)  1 -62 23 2
    assign ( resid 8 and name c )
           ( resid 9 and name n )
           ( resid 9 and name ca)
           ( resid 9 and name c)  1 -62 23 2
    assign ( resid 9 and name c )
           ( resid 10 and name n )
           ( resid 10 and name ca)
           ( resid 10 and name c)  1 -62 23 2
    assign ( resid 10 and name c )
           ( resid 11 and name n )
           ( resid 11 and name ca)
           ( resid 11 and name c)  1 -62 23 2
    assign ( resid 11 and name c )
           ( resid 12 and name n )
           ( resid 12 and name ca)
           ( resid 12 and name c)  1 -62 23 2
    assign ( resid 15 and name c )
           ( resid 16 and name n )
           ( resid 16 and name ca)
           ( resid 16 and name c)  1 -62 23 2
    assign ( resid 3 and name n )
           ( resid 3 and name ca )
           ( resid 3 and name cb )
           ( resid 3 and name cg ) 1 -60 30 2
    assign ( resid 4 and name n )
           ( resid 4 and name ca )
           ( resid 4 and name cb )
           ( resid 4 and name og ) 1 60 30 2
    assign ( resid 6 and name n )
           ( resid 6 and name ca )
           ( resid 6 and name cb )
           ( resid 6 and name cg ) 1 240 150 2
    assign ( resid 10 and name n )
           ( resid 10 and name ca )
           ( resid 10 and name cb )
           ( resid 10 and name cg ) 1 180 30 2
    assign ( resid 12 and name n )
           ( resid 12 and name ca )
           ( resid 12 and name cb )
           ( resid 12 and name cg ) 1 240 150 2
    assign ( resid 13 and name n )
           ( resid 13 and name ca )
           ( resid 13 and name cb )
           ( resid 13 and name cg ) 1 240 150 2
    assign ( resid 17 and name n )
           ( resid 17 and name ca )
           ( resid 17 and name cb )
           ( resid 17 and name cg ) 1 240 150 2
   scale=1.0
end
flags include cdih





  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ILE   1          HT1       ILE   1   7.494   8.238  -3.304
    2   2H    ILE   1          HT2       ILE   1   5.984   8.748  -3.870
    3   3H    ILE   1          HT3       ILE   1   6.512   7.167  -4.172
    4    HA   ILE   1           HA       ILE   1   6.437   7.928  -1.390
    5    HB   ILE   1           HB       ILE   1   3.850   7.186  -1.591
    6   1HG1  ILE   1          HG12      ILE   1   2.839   8.718  -3.347
    7   2HG1  ILE   1          HG11      ILE   1   4.445   8.842  -4.052
    8   1HG2  ILE   1          HG21      ILE   1   5.094   9.188  -0.484
    9   2HG2  ILE   1          HG22      ILE   1   3.358   9.277  -0.778
   10   3HG2  ILE   1          HG23      ILE   1   4.480  10.085  -1.872
   11   1HD1  ILE   1          HD11      ILE   1   2.466   6.719  -4.250
   12   2HD1  ILE   1          HD12      ILE   1   4.089   6.137  -3.880
   13   3HD1  ILE   1          HD13      ILE   1   3.812   7.124  -5.315
   14    HA   PRO   2           HA       PRO   2   6.923   3.514  -1.362
   15   1HB   PRO   2          HB2       PRO   2   6.867   3.099   1.290
   16   2HB   PRO   2          HB1       PRO   2   8.213   3.937   0.508
   17   1HG   PRO   2          HG2       PRO   2   5.885   5.074   2.006
   18   2HG   PRO   2          HG1       PRO   2   7.594   5.542   2.073
   19   1HD   PRO   2          HD2       PRO   2   5.695   6.881   0.615
   20   2HD   PRO   2          HD1       PRO   2   7.424   6.874   0.219
   21    H    GLU   3           HN       GLU   3   4.276   4.312  -2.001
   22    HA   GLU   3           HA       GLU   3   2.420   3.066  -0.197
   23   1HB   GLU   3          HB2       GLU   3   1.930   3.884  -3.060
   24   2HB   GLU   3          HB1       GLU   3   0.725   3.630  -1.806
   25   1HG   GLU   3          HG2       GLU   3   2.728   5.856  -2.017
   26   2HG   GLU   3          HG1       GLU   3   0.972   5.965  -2.092
   27    H    SER   4           HN       SER   4   4.310   2.028  -2.863
   28    HA   SER   4           HA       SER   4   4.694   0.041  -3.859
   29   1HB   SER   4          HB2       SER   4   4.222  -2.010  -2.807
   30   2HB   SER   4          HB1       SER   4   4.434  -0.868  -1.484
   31    HG   SER   4           HG       SER   4   2.083  -0.682  -1.494
   32    H    SER   5           HN       SER   5   1.281   0.675  -3.165
   33    HA   SER   5           HA       SER   5   0.206  -0.942  -5.224
   34   1HB   SER   5          HB2       SER   5  -1.182  -0.094  -3.425
   35   2HB   SER   5          HB1       SER   5  -0.900   1.563  -3.953
   36    HG   SER   5           HG       SER   5  -1.813   0.534  -6.068
   37    H    GLU   6           HN       GLU   6   1.043   2.522  -5.154
   38    HA   GLU   6           HA       GLU   6   0.291   3.099  -7.812
   39   1HB   GLU   6          HB2       GLU   6   2.341   4.382  -5.994
   40   2HB   GLU   6          HB1       GLU   6   1.914   5.028  -7.572
   41   1HG   GLU   6          HG2       GLU   6  -0.087   4.584  -5.374
   42   2HG   GLU   6          HG1       GLU   6   0.784   6.099  -5.606
   43    H    LEU   7           HN       LEU   7   3.276   1.968  -6.351
   44    HA   LEU   7           HA       LEU   7   4.897   2.027  -8.655
   45   1HB   LEU   7          HB2       LEU   7   5.059   0.421  -6.112
   46   2HB   LEU   7          HB1       LEU   7   6.255   0.287  -7.384
   47    HG   LEU   7           HG       LEU   7   6.636   2.790  -7.104
   48   1HD1  LEU   7          HD11      LEU   7   5.506   3.978  -5.605
   49   2HD1  LEU   7          HD12      LEU   7   5.795   2.782  -4.341
   50   3HD1  LEU   7          HD13      LEU   7   4.425   2.595  -5.436
   51   1HD2  LEU   7          HD21      LEU   7   8.444   2.054  -6.060
   52   2HD2  LEU   7          HD22      LEU   7   7.611   0.551  -5.663
   53   3HD2  LEU   7          HD23      LEU   7   7.530   1.923  -4.558
   54    H    THR   8           HN       THR   8   2.968  -0.603  -7.161
   55    HA   THR   8           HA       THR   8   3.662  -2.529  -9.141
   56    HB   THR   8           HB       THR   8   1.548  -3.722  -8.336
   57    HG1  THR   8           HG1      THR   8   1.632  -1.878  -6.190
   58   1HG2  THR   8          HG21      THR   8   3.080  -3.288  -5.891
   59   2HG2  THR   8          HG22      THR   8   4.094  -3.576  -7.305
   60   3HG2  THR   8          HG23      THR   8   2.865  -4.754  -6.847
   61    H    LEU   9           HN       LEU   9   0.922  -0.292  -8.832
   62    HA   LEU   9           HA       LEU   9  -0.558  -1.187 -11.050
   63   1HB   LEU   9          HB2       LEU   9  -1.471   0.350  -9.394
   64   2HB   LEU   9          HB1       LEU   9  -0.318   1.582  -9.868
   65    HG   LEU   9           HG       LEU   9  -1.385   1.606 -12.136
   66   1HD1  LEU   9          HD11      LEU   9  -3.682   0.155 -10.871
   67   2HD1  LEU   9          HD12      LEU   9  -2.418  -0.710 -11.746
   68   3HD1  LEU   9          HD13      LEU   9  -3.389   0.506 -12.575
   69   1HD2  LEU   9          HD21      LEU   9  -1.960   3.059 -10.016
   70   2HD2  LEU   9          HD22      LEU   9  -3.510   2.227 -10.148
   71   3HD2  LEU   9          HD23      LEU   9  -2.906   3.188 -11.498
   72    H    GLN  10           HN       GLN  10   1.890   1.404 -10.804
   73    HA   GLN  10           HA       GLN  10   1.888   2.081 -13.551
   74   1HB   GLN  10          HB2       GLN  10   2.797   3.534 -11.774
   75   2HB   GLN  10          HB1       GLN  10   4.101   2.388 -11.510
   76   1HG   GLN  10          HG2       GLN  10   5.043   2.846 -13.644
   77   2HG   GLN  10          HG1       GLN  10   3.633   3.785 -14.130
   78   1HE2  GLN  10          HE21      GLN  10   4.040   5.868 -14.164
   79   2HE2  GLN  10          HE22      GLN  10   5.054   6.728 -13.063
   80    H    GLU  11           HN       GLU  11   3.672  -0.288 -11.668
   81    HA   GLU  11           HA       GLU  11   5.558  -1.088 -13.615
   82   1HB   GLU  11          HB2       GLU  11   5.887  -1.653 -11.327
   83   2HB   GLU  11          HB1       GLU  11   4.338  -2.465 -11.224
   84   1HG   GLU  11          HG2       GLU  11   5.200  -4.214 -12.731
   85   2HG   GLU  11          HG1       GLU  11   6.768  -3.403 -12.732
   86    H    LEU  12           HN       LEU  12   2.393  -2.481 -12.717
   87    HA   LEU  12           HA       LEU  12   2.367  -4.527 -14.656
   88   1HB   LEU  12          HB2       LEU  12   0.039  -3.042 -13.425
   89   2HB   LEU  12          HB1       LEU  12  -0.083  -4.545 -14.318
   90    HG   LEU  12           HG       LEU  12   1.423  -4.206 -11.723
   91   1HD1  LEU  12          HD11      LEU  12  -1.297  -5.367 -12.299
   92   2HD1  LEU  12          HD12      LEU  12  -0.930  -3.947 -11.320
   93   3HD1  LEU  12          HD13      LEU  12  -0.432  -5.548 -10.773
   94   1HD2  LEU  12          HD21      LEU  12   0.588  -6.847 -12.778
   95   2HD2  LEU  12          HD22      LEU  12   2.010  -6.398 -11.837
   96   3HD2  LEU  12          HD23      LEU  12   1.953  -6.055 -13.566
   97    H    LEU  13           HN       LEU  13   0.923  -1.263 -14.703
   98    HA   LEU  13           HA       LEU  13   0.217  -1.499 -17.494
   99   1HB   LEU  13          HB2       LEU  13  -0.004   0.676 -15.453
  100   2HB   LEU  13          HB1       LEU  13  -0.222   1.045 -17.155
  101    HG   LEU  13           HG       LEU  13  -1.963  -0.816 -17.170
  102   1HD1  LEU  13          HD11      LEU  13  -1.111  -1.020 -14.464
  103   2HD1  LEU  13          HD12      LEU  13  -2.297  -1.995 -15.332
  104   3HD1  LEU  13          HD13      LEU  13  -2.804  -0.529 -14.493
  105   1HD2  LEU  13          HD21      LEU  13  -2.145   1.872 -16.782
  106   2HD2  LEU  13          HD22      LEU  13  -3.051   1.250 -15.403
  107   3HD2  LEU  13          HD23      LEU  13  -3.517   0.795 -17.042
  108    H    GLY  14           HN       GLY  14   2.955  -1.866 -16.849
  109   1HA   GLY  14          HA2       GLY  14   4.154   0.274 -18.495
  110   2HA   GLY  14          HA1       GLY  14   4.993  -0.389 -17.096
  111    H    GLU  15           HN       GLU  15   4.914  -2.990 -17.201
  112    HA   GLU  15           HA       GLU  15   6.360  -3.622 -19.631
  113   1HB   GLU  15          HB2       GLU  15   5.740  -5.237 -17.161
  114   2HB   GLU  15          HB1       GLU  15   6.558  -5.923 -18.559
  115   1HG   GLU  15          HG2       GLU  15   8.224  -4.003 -18.296
  116   2HG   GLU  15          HG1       GLU  15   7.509  -3.774 -16.702
  117    H    GLU  16           HN       GLU  16   3.204  -4.486 -18.230
  118    HA   GLU  16           HA       GLU  16   2.529  -6.505 -20.089
  119   1HB   GLU  16          HB2       GLU  16   0.779  -4.609 -18.518
  120   2HB   GLU  16          HB1       GLU  16   0.147  -5.925 -19.494
  121   1HG   GLU  16          HG2       GLU  16   1.302  -7.543 -18.107
  122   2HG   GLU  16          HG1       GLU  16   2.015  -6.241 -17.155
  123    H    ARG  17           HN       ARG  17   2.051  -3.011 -20.120
  124    HA   ARG  17           HA       ARG  17   1.121  -3.164 -22.907
  125   1HB   ARG  17          HB2       ARG  17   0.876  -0.898 -20.911
  126   2HB   ARG  17          HB1       ARG  17   0.244  -0.885 -22.552
  127   1HG   ARG  17          HG2       ARG  17  -1.303  -2.653 -22.023
  128   2HG   ARG  17          HG1       ARG  17  -0.606  -2.826 -20.411
  129   1HD   ARG  17          HD2       ARG  17  -1.307  -0.526 -19.883
  130   2HD   ARG  17          HD1       ARG  17  -2.037  -0.393 -21.482
  131    HE   ARG  17           HE       ARG  17  -3.147  -1.679 -19.189
  132   1HH1  ARG  17          HH11      ARG  17  -3.113  -1.702 -22.650
  133   2HH1  ARG  17          HH12      ARG  17  -4.625  -2.526 -22.777
  134   1HH2  ARG  17          HH21      ARG  17  -5.116  -2.746 -19.364
  135   2HH2  ARG  17          HH22      ARG  17  -5.752  -3.111 -20.927
  136    H    ARG  18           HN       ARG  18   3.814  -3.557 -22.359
  137    HA   ARG  18           HA       ARG  18   5.356  -1.169 -22.583
  138   1HB   ARG  18          HB2       ARG  18   6.068  -3.425 -21.626
  139   2HB   ARG  18          HB1       ARG  18   6.262  -3.959 -23.288
  140   1HG   ARG  18          HG2       ARG  18   7.654  -1.494 -22.352
  141   2HG   ARG  18          HG1       ARG  18   8.300  -3.081 -21.943
  142   1HD   ARG  18          HD2       ARG  18   8.633  -3.653 -24.197
  143   2HD   ARG  18          HD1       ARG  18   7.600  -2.345 -24.769
  144    HE   ARG  18           HE       ARG  18  10.379  -2.168 -24.004
  145   1HH1  ARG  18          HH11      ARG  18   7.438  -0.464 -24.745
  146   2HH1  ARG  18          HH12      ARG  18   8.267   1.054 -24.968
  147   1HH2  ARG  18          HH21      ARG  18  11.421  -0.202 -24.308
  148   2HH2  ARG  18          HH22      ARG  18  10.499   1.198 -24.724
  Start of MODEL    2
    1   1H    ILE   1          HT1       ILE   1   0.867   1.306   3.448
    2   2H    ILE   1          HT2       ILE   1  -0.424   2.389   3.312
    3   3H    ILE   1          HT3       ILE   1   1.167   2.962   3.258
    4    HA   ILE   1           HA       ILE   1   0.169   1.021   1.280
    5    HB   ILE   1           HB       ILE   1  -1.400   2.805   1.092
    6   1HG1  ILE   1          HG12      ILE   1   0.767   3.276  -0.967
    7   2HG1  ILE   1          HG11      ILE   1  -0.435   1.992  -1.035
    8   1HG2  ILE   1          HG21      ILE   1  -0.797   5.151   0.916
    9   2HG2  ILE   1          HG22      ILE   1   0.910   4.741   1.082
   10   3HG2  ILE   1          HG23      ILE   1  -0.197   4.466   2.427
   11   1HD1  ILE   1          HD11      ILE   1  -1.668   4.585  -0.721
   12   2HD1  ILE   1          HD12      ILE   1  -1.934   3.345  -1.946
   13   3HD1  ILE   1          HD13      ILE   1  -0.631   4.516  -2.145
   14    HA   PRO   2           HA       PRO   2   4.518   1.495   0.331
   15   1HB   PRO   2          HB2       PRO   2   4.257  -0.515  -1.698
   16   2HB   PRO   2          HB1       PRO   2   4.945  -0.683  -0.083
   17   1HG   PRO   2          HG2       PRO   2   2.612  -1.889  -0.932
   18   2HG   PRO   2          HG1       PRO   2   3.033  -1.583   0.761
   19   1HD   PRO   2          HD2       PRO   2   1.216  -0.050  -1.052
   20   2HD   PRO   2          HD1       PRO   2   1.051  -0.403   0.682
   21    H    GLU   3           HN       GLU   3   4.861   3.392  -0.727
   22    HA   GLU   3           HA       GLU   3   3.632   4.234  -3.087
   23   1HB   GLU   3          HB2       GLU   3   6.331   4.991  -1.969
   24   2HB   GLU   3          HB1       GLU   3   5.516   5.852  -3.265
   25   1HG   GLU   3          HG2       GLU   3   5.067   7.116  -1.371
   26   2HG   GLU   3          HG1       GLU   3   3.599   6.175  -1.612
   27    H    SER   4           HN       SER   4   6.724   2.594  -2.652
   28    HA   SER   4           HA       SER   4   7.566   2.610  -5.328
   29   1HB   SER   4          HB2       SER   4   9.037   0.724  -4.691
   30   2HB   SER   4          HB1       SER   4   9.087   2.030  -3.507
   31    HG   SER   4           HG       SER   4   8.740  -0.372  -2.879
   32    H    SER   5           HN       SER   5   5.499   0.359  -3.576
   33    HA   SER   5           HA       SER   5   5.322  -1.624  -5.587
   34   1HB   SER   5          HB2       SER   5   4.616  -2.325  -3.495
   35   2HB   SER   5          HB1       SER   5   3.649  -0.880  -3.223
   36    HG   SER   5           HG       SER   5   2.024  -1.695  -4.378
   37    H    GLU   6           HN       GLU   6   2.988   0.924  -4.681
   38    HA   GLU   6           HA       GLU   6   1.262   0.429  -6.841
   39   1HB   GLU   6          HB2       GLU   6   1.633   2.688  -4.925
   40   2HB   GLU   6          HB1       GLU   6   0.595   2.926  -6.323
   41   1HG   GLU   6          HG2       GLU   6  -0.695   2.256  -4.375
   42   2HG   GLU   6          HG1       GLU   6  -0.788   1.043  -5.645
   43    H    LEU   7           HN       LEU   7   4.116   2.437  -6.530
   44    HA   LEU   7           HA       LEU   7   3.838   3.867  -8.967
   45   1HB   LEU   7          HB2       LEU   7   5.408   4.406  -7.061
   46   2HB   LEU   7          HB1       LEU   7   6.416   3.087  -7.611
   47    HG   LEU   7           HG       LEU   7   6.705   4.239  -9.784
   48   1HD1  LEU   7          HD11      LEU   7   4.986   6.298  -8.442
   49   2HD1  LEU   7          HD12      LEU   7   4.806   5.574 -10.040
   50   3HD1  LEU   7          HD13      LEU   7   6.106   6.726  -9.736
   51   1HD2  LEU   7          HD21      LEU   7   8.417   5.571  -9.035
   52   2HD2  LEU   7          HD22      LEU   7   8.128   4.576  -7.608
   53   3HD2  LEU   7          HD23      LEU   7   7.476   6.212  -7.688
   54    H    THR   8           HN       THR   8   5.568   0.860  -8.082
   55    HA   THR   8           HA       THR   8   6.487   0.390 -10.760
   56    HB   THR   8           HB       THR   8   6.892  -1.979  -9.939
   57    HG1  THR   8           HG1      THR   8   6.361  -0.879  -7.374
   58   1HG2  THR   8          HG21      THR   8   8.297  -0.326  -7.980
   59   2HG2  THR   8          HG22      THR   8   8.339   0.323  -9.620
   60   3HG2  THR   8          HG23      THR   8   8.934  -1.307  -9.301
   61    H    LEU   9           HN       LEU   9   3.689  -0.662  -8.895
   62    HA   LEU   9           HA       LEU   9   2.668  -2.591 -10.656
   63   1HB   LEU   9          HB2       LEU   9   1.818  -2.257  -8.393
   64   2HB   LEU   9          HB1       LEU   9   1.199  -0.678  -8.839
   65    HG   LEU   9           HG       LEU   9  -0.295  -1.850 -10.501
   66   1HD1  LEU   9          HD11      LEU   9   0.971  -3.947 -10.614
   67   2HD1  LEU   9          HD12      LEU   9  -0.715  -4.218 -10.170
   68   3HD1  LEU   9          HD13      LEU   9   0.545  -4.287  -8.937
   69   1HD2  LEU   9          HD21      LEU   9  -0.672  -2.548  -7.591
   70   2HD2  LEU   9          HD22      LEU   9  -1.934  -2.464  -8.820
   71   3HD2  LEU   9          HD23      LEU   9  -1.078  -1.001  -8.333
   72    H    GLN  10           HN       GLN  10   2.048   0.919 -10.484
   73    HA   GLN  10           HA       GLN  10   0.258   1.057 -12.668
   74   1HB   GLN  10          HB2       GLN  10   0.482   2.895 -11.076
   75   2HB   GLN  10          HB1       GLN  10   2.151   3.147 -11.567
   76   1HG   GLN  10          HG2       GLN  10   1.189   3.567 -13.908
   77   2HG   GLN  10          HG1       GLN  10  -0.362   3.730 -13.086
   78   1HE2  GLN  10          HE21      GLN  10   2.203   5.390 -14.238
   79   2HE2  GLN  10          HE22      GLN  10   2.093   6.812 -13.264
   80    H    GLU  11           HN       GLU  11   3.756   1.236 -12.425
   81    HA   GLU  11           HA       GLU  11   4.326   1.994 -15.082
   82   1HB   GLU  11          HB2       GLU  11   5.996   2.207 -13.369
   83   2HB   GLU  11          HB1       GLU  11   5.925   0.491 -13.009
   84   1HG   GLU  11          HG2       GLU  11   6.875   0.000 -15.212
   85   2HG   GLU  11          HG1       GLU  11   6.972   1.730 -15.543
   86    H    LEU  12           HN       LEU  12   4.243  -1.220 -13.541
   87    HA   LEU  12           HA       LEU  12   4.834  -2.697 -15.881
   88   1HB   LEU  12          HB2       LEU  12   3.281  -3.543 -13.432
   89   2HB   LEU  12          HB1       LEU  12   3.941  -4.629 -14.640
   90    HG   LEU  12           HG       LEU  12   5.593  -2.820 -12.874
   91   1HD1  LEU  12          HD11      LEU  12   6.157  -4.769 -11.606
   92   2HD1  LEU  12          HD12      LEU  12   5.224  -5.804 -12.688
   93   3HD1  LEU  12          HD13      LEU  12   4.399  -4.634 -11.657
   94   1HD2  LEU  12          HD21      LEU  12   6.648  -5.165 -14.381
   95   2HD2  LEU  12          HD22      LEU  12   7.477  -3.704 -13.844
   96   3HD2  LEU  12          HD23      LEU  12   6.391  -3.642 -15.232
   97    H    LEU  13           HN       LEU  13   1.711  -2.038 -14.271
   98    HA   LEU  13           HA       LEU  13   0.259  -3.085 -16.567
   99   1HB   LEU  13          HB2       LEU  13  -0.742  -1.835 -14.010
  100   2HB   LEU  13          HB1       LEU  13  -1.748  -2.593 -15.231
  101    HG   LEU  13           HG       LEU  13   0.370  -4.008 -13.617
  102   1HD1  LEU  13          HD11      LEU  13  -1.863  -3.144 -12.530
  103   2HD1  LEU  13          HD12      LEU  13  -1.252  -4.761 -12.183
  104   3HD1  LEU  13          HD13      LEU  13  -2.549  -4.541 -13.358
  105   1HD2  LEU  13          HD21      LEU  13  -1.281  -4.759 -15.929
  106   2HD2  LEU  13          HD22      LEU  13  -1.267  -5.924 -14.605
  107   3HD2  LEU  13          HD23      LEU  13   0.248  -5.426 -15.359
  108    H    GLY  14           HN       GLY  14   1.855  -0.798 -17.116
  109   1HA   GLY  14          HA2       GLY  14  -0.286   1.020 -17.989
  110   2HA   GLY  14          HA1       GLY  14   1.081   1.692 -17.117
  111    H    GLU  15           HN       GLU  15   3.279   0.644 -18.179
  112    HA   GLU  15           HA       GLU  15   3.197   1.672 -20.909
  113   1HB   GLU  15          HB2       GLU  15   4.958   2.377 -19.273
  114   2HB   GLU  15          HB1       GLU  15   5.596   0.739 -19.321
  115   1HG   GLU  15          HG2       GLU  15   6.887   2.185 -20.759
  116   2HG   GLU  15          HG1       GLU  15   6.023   0.985 -21.721
  117    H    GLU  16           HN       GLU  16   4.332  -1.321 -19.287
  118    HA   GLU  16           HA       GLU  16   5.006  -2.670 -21.670
  119   1HB   GLU  16          HB2       GLU  16   5.724  -3.333 -19.355
  120   2HB   GLU  16          HB1       GLU  16   4.098  -3.946 -19.083
  121   1HG   GLU  16          HG2       GLU  16   4.377  -5.559 -20.871
  122   2HG   GLU  16          HG1       GLU  16   5.979  -4.915 -21.225
  123    H    ARG  17           HN       ARG  17   2.008  -2.455 -19.836
  124    HA   ARG  17           HA       ARG  17   0.620  -4.079 -21.863
  125   1HB   ARG  17          HB2       ARG  17  -0.718  -3.055 -19.384
  126   2HB   ARG  17          HB1       ARG  17  -1.035  -4.528 -20.288
  127   1HG   ARG  17          HG2       ARG  17   1.343  -4.018 -18.514
  128   2HG   ARG  17          HG1       ARG  17  -0.058  -5.014 -18.120
  129   1HD   ARG  17          HD2       ARG  17   0.527  -6.655 -19.682
  130   2HD   ARG  17          HD1       ARG  17   1.626  -5.574 -20.540
  131    HE   ARG  17           HE       ARG  17   3.281  -6.218 -19.112
  132   1HH1  ARG  17          HH11      ARG  17   0.251  -6.956 -17.598
  133   2HH1  ARG  17          HH12      ARG  17   0.996  -7.670 -16.215
  134   1HH2  ARG  17          HH21      ARG  17   4.235  -7.099 -17.364
  135   2HH2  ARG  17          HH22      ARG  17   3.260  -7.763 -16.077
  136    H    ARG  18           HN       ARG  18   1.515  -1.469 -22.521
  137    HA   ARG  18           HA       ARG  18  -0.585   0.435 -22.223
  138   1HB   ARG  18          HB2       ARG  18   1.819   1.008 -22.507
  139   2HB   ARG  18          HB1       ARG  18   1.715   0.474 -24.176
  140   1HG   ARG  18          HG2       ARG  18   1.598   2.920 -23.912
  141   2HG   ARG  18          HG1       ARG  18   0.184   2.238 -24.705
  142   1HD   ARG  18          HD2       ARG  18   0.278   2.859 -21.761
  143   2HD   ARG  18          HD1       ARG  18  -0.264   4.022 -22.969
  144    HE   ARG  18           HE       ARG  18  -1.702   1.638 -23.340
  145   1HH1  ARG  18          HH11      ARG  18  -1.390   4.184 -21.004
  146   2HH1  ARG  18          HH12      ARG  18  -3.000   3.993 -20.411
  147   1HH2  ARG  18          HH21      ARG  18  -3.755   1.380 -22.558
  148   2HH2  ARG  18          HH22      ARG  18  -4.345   2.400 -21.294
  Start of MODEL    3
    1   1H    ILE   1          HT1       ILE   1   6.691   3.863   2.663
    2   2H    ILE   1          HT2       ILE   1   5.313   4.793   2.981
    3   3H    ILE   1          HT3       ILE   1   6.780   5.553   2.618
    4    HA   ILE   1           HA       ILE   1   4.926   5.288   0.825
    5    HB   ILE   1           HB       ILE   1   6.971   6.418   0.344
    6   1HG1  ILE   1          HG12      ILE   1   6.686   4.147  -1.636
    7   2HG1  ILE   1          HG11      ILE   1   5.691   5.598  -1.610
    8   1HG2  ILE   1          HG21      ILE   1   8.247   3.708   0.503
    9   2HG2  ILE   1          HG22      ILE   1   8.612   5.154   1.444
   10   3HG2  ILE   1          HG23      ILE   1   9.040   5.083  -0.265
   11   1HD1  ILE   1          HD11      ILE   1   7.991   6.817  -1.817
   12   2HD1  ILE   1          HD12      ILE   1   7.210   6.119  -3.236
   13   3HD1  ILE   1          HD13      ILE   1   8.526   5.255  -2.440
   14    HA   PRO   2           HA       PRO   2   4.079   0.993   0.017
   15   1HB   PRO   2          HB2       PRO   2   2.653   1.885  -2.376
   16   2HB   PRO   2          HB1       PRO   2   2.015   1.146  -0.906
   17   1HG   PRO   2          HG2       PRO   2   1.567   3.733  -1.528
   18   2HG   PRO   2          HG1       PRO   2   1.726   3.171   0.147
   19   1HD   PRO   2          HD2       PRO   2   3.750   4.538  -1.593
   20   2HD   PRO   2          HD1       PRO   2   3.363   4.818   0.119
   21    H    GLU   3           HN       GLU   3   6.551   1.098  -0.648
   22    HA   GLU   3           HA       GLU   3   7.193   1.141  -3.418
   23   1HB   GLU   3          HB2       GLU   3   8.724  -0.063  -1.107
   24   2HB   GLU   3          HB1       GLU   3   9.371   0.217  -2.717
   25   1HG   GLU   3          HG2       GLU   3   8.968   2.636  -2.417
   26   2HG   GLU   3          HG1       GLU   3   8.434   2.311  -0.769
   27    H    SER   4           HN       SER   4   5.127  -0.433  -3.585
   28    HA   SER   4           HA       SER   4   6.132  -2.846  -4.711
   29   1HB   SER   4          HB2       SER   4   4.903  -4.453  -3.276
   30   2HB   SER   4          HB1       SER   4   6.171  -3.609  -2.388
   31    HG   SER   4           HG       SER   4   4.398  -3.523  -1.101
   32    H    SER   5           HN       SER   5   3.151  -1.539  -3.249
   33    HA   SER   5           HA       SER   5   1.468  -2.629  -5.300
   34   1HB   SER   5          HB2       SER   5   0.837  -0.439  -3.317
   35   2HB   SER   5          HB1       SER   5  -0.325  -1.387  -4.242
   36    HG   SER   5           HG       SER   5   1.267  -3.072  -2.946
   37    H    GLU   6           HN       GLU   6   2.610   0.640  -4.524
   38    HA   GLU   6           HA       GLU   6   1.383   1.990  -6.665
   39   1HB   GLU   6          HB2       GLU   6   2.413   3.040  -4.647
   40   2HB   GLU   6          HB1       GLU   6   3.995   2.646  -5.288
   41   1HG   GLU   6          HG2       GLU   6   3.654   4.106  -7.168
   42   2HG   GLU   6          HG1       GLU   6   1.999   4.433  -6.656
   43    H    LEU   7           HN       LEU   7   4.547   0.510  -6.296
   44    HA   LEU   7           HA       LEU   7   5.614   1.175  -8.805
   45   1HB   LEU   7          HB2       LEU   7   6.231  -0.945  -6.785
   46   2HB   LEU   7          HB1       LEU   7   7.024  -0.973  -8.348
   47    HG   LEU   7           HG       LEU   7   7.898   1.314  -7.906
   48   1HD1  LEU   7          HD11      LEU   7   7.782   2.271  -5.706
   49   2HD1  LEU   7          HD12      LEU   7   6.854   0.895  -5.111
   50   3HD1  LEU   7          HD13      LEU   7   6.143   1.993  -6.295
   51   1HD2  LEU   7          HD21      LEU   7   9.009   0.096  -5.583
   52   2HD2  LEU   7          HD22      LEU   7   9.708   0.257  -7.195
   53   3HD2  LEU   7          HD23      LEU   7   8.718  -1.148  -6.799
   54    H    THR   8           HN       THR   8   3.885  -1.802  -7.752
   55    HA   THR   8           HA       THR   8   4.070  -3.032 -10.309
   56    HB   THR   8           HB       THR   8   2.114  -4.449  -9.497
   57    HG1  THR   8           HG1      THR   8   2.676  -3.364  -6.948
   58   1HG2  THR   8          HG21      THR   8   4.285  -5.359  -9.312
   59   2HG2  THR   8          HG22      THR   8   3.549  -5.563  -7.722
   60   3HG2  THR   8          HG23      THR   8   4.714  -4.267  -7.995
   61    H    LEU   9           HN       LEU   9   1.543  -1.068  -8.761
   62    HA   LEU   9           HA       LEU   9  -0.401  -1.253 -10.773
   63   1HB   LEU   9          HB2       LEU   9  -0.863  -0.267  -8.597
   64   2HB   LEU   9          HB1       LEU   9   0.252   1.046  -8.926
   65    HG   LEU   9           HG       LEU   9  -1.237   1.735 -10.821
   66   1HD1  LEU   9          HD11      LEU   9  -3.305   0.792 -11.189
   67   2HD1  LEU   9          HD12      LEU   9  -3.386   0.076  -9.579
   68   3HD1  LEU   9          HD13      LEU   9  -2.331  -0.628 -10.805
   69   1HD2  LEU   9          HD21      LEU   9  -1.403   3.037  -8.888
   70   2HD2  LEU   9          HD22      LEU   9  -2.176   1.744  -7.971
   71   3HD2  LEU   9          HD23      LEU   9  -3.069   2.579  -9.242
   72    H    GLN  10           HN       GLN  10   2.270   1.054 -10.355
   73    HA   GLN  10           HA       GLN  10   1.749   2.622 -12.638
   74   1HB   GLN  10          HB2       GLN  10   3.213   3.402 -10.870
   75   2HB   GLN  10          HB1       GLN  10   4.333   2.081 -11.168
   76   1HG   GLN  10          HG2       GLN  10   4.943   2.994 -13.294
   77   2HG   GLN  10          HG1       GLN  10   3.688   4.227 -13.174
   78   1HE2  GLN  10          HE21      GLN  10   4.525   6.132 -12.785
   79   2HE2  GLN  10          HE22      GLN  10   5.858   6.469 -11.743
   80    H    GLU  11           HN       GLU  11   3.624  -0.329 -12.171
   81    HA   GLU  11           HA       GLU  11   4.779  -0.421 -14.763
   82   1HB   GLU  11          HB2       GLU  11   4.242  -2.528 -12.672
   83   2HB   GLU  11          HB1       GLU  11   4.978  -2.924 -14.216
   84   1HG   GLU  11          HG2       GLU  11   6.090  -0.939 -12.248
   85   2HG   GLU  11          HG1       GLU  11   6.605  -2.619 -12.387
   86    H    LEU  12           HN       LEU  12   1.858  -1.881 -13.369
   87    HA   LEU  12           HA       LEU  12   1.012  -3.290 -15.653
   88   1HB   LEU  12          HB2       LEU  12  -0.703  -2.036 -13.504
   89   2HB   LEU  12          HB1       LEU  12  -1.209  -3.290 -14.618
   90    HG   LEU  12           HG       LEU  12   0.942  -3.620 -12.524
   91   1HD1  LEU  12          HD11      LEU  12  -1.024  -3.438 -11.297
   92   2HD1  LEU  12          HD12      LEU  12  -0.860  -5.175 -11.554
   93   3HD1  LEU  12          HD13      LEU  12  -1.988  -4.242 -12.537
   94   1HD2  LEU  12          HD21      LEU  12   0.079  -6.104 -13.197
   95   2HD2  LEU  12          HD22      LEU  12   1.510  -5.322 -13.871
   96   3HD2  LEU  12          HD23      LEU  12  -0.019  -5.272 -14.749
   97    H    LEU  13           HN       LEU  13  -0.210  -0.161 -14.421
   98    HA   LEU  13           HA       LEU  13  -1.415   0.409 -17.010
   99   1HB   LEU  13          HB2       LEU  13  -1.383   2.037 -14.470
  100   2HB   LEU  13          HB1       LEU  13  -2.341   2.386 -15.898
  101    HG   LEU  13           HG       LEU  13  -2.624  -0.098 -14.211
  102   1HD1  LEU  13          HD11      LEU  13  -4.942   1.230 -13.894
  103   2HD1  LEU  13          HD12      LEU  13  -3.827   2.590 -14.030
  104   3HD1  LEU  13          HD13      LEU  13  -3.580   1.369 -12.782
  105   1HD2  LEU  13          HD21      LEU  13  -3.733  -0.888 -15.969
  106   2HD2  LEU  13          HD22      LEU  13  -3.604   0.652 -16.819
  107   3HD2  LEU  13          HD23      LEU  13  -4.935   0.373 -15.695
  108    H    GLY  14           HN       GLY  14   1.350   0.268 -17.186
  109   1HA   GLY  14          HA2       GLY  14   1.917   2.923 -18.207
  110   2HA   GLY  14          HA1       GLY  14   2.943   2.428 -16.872
  111    H    GLU  15           HN       GLU  15   3.587  -0.131 -17.349
  112    HA   GLU  15           HA       GLU  15   4.925   0.022 -19.966
  113   1HB   GLU  15          HB2       GLU  15   5.776  -1.082 -17.334
  114   2HB   GLU  15          HB1       GLU  15   6.406  -1.827 -18.797
  115   1HG   GLU  15          HG2       GLU  15   6.653   1.078 -18.039
  116   2HG   GLU  15          HG1       GLU  15   7.928  -0.137 -17.947
  117    H    GLU  16           HN       GLU  16   3.229  -2.248 -17.815
  118    HA   GLU  16           HA       GLU  16   3.374  -4.441 -19.624
  119   1HB   GLU  16          HB2       GLU  16   2.877  -4.608 -17.157
  120   2HB   GLU  16          HB1       GLU  16   1.268  -3.988 -17.502
  121   1HG   GLU  16          HG2       GLU  16   0.762  -5.905 -18.857
  122   2HG   GLU  16          HG1       GLU  16   2.414  -6.499 -18.700
  123    H    ARG  17           HN       ARG  17   0.754  -2.156 -18.844
  124    HA   ARG  17           HA       ARG  17  -0.472  -2.841 -21.428
  125   1HB   ARG  17          HB2       ARG  17  -1.778  -3.004 -19.150
  126   2HB   ARG  17          HB1       ARG  17  -1.917  -1.261 -19.326
  127   1HG   ARG  17          HG2       ARG  17  -2.953  -3.372 -21.210
  128   2HG   ARG  17          HG1       ARG  17  -3.898  -2.274 -20.205
  129   1HD   ARG  17          HD2       ARG  17  -3.044  -0.372 -21.495
  130   2HD   ARG  17          HD1       ARG  17  -2.103  -1.472 -22.496
  131    HE   ARG  17           HE       ARG  17  -4.867  -2.125 -22.532
  132   1HH1  ARG  17          HH11      ARG  17  -2.456   0.007 -23.880
  133   2HH1  ARG  17          HH12      ARG  17  -3.444   0.389 -25.257
  134   1HH2  ARG  17          HH21      ARG  17  -6.099  -1.622 -24.337
  135   2HH2  ARG  17          HH22      ARG  17  -5.475  -0.528 -25.517
  136    H    ARG  18           HN       ARG  18   1.324  -1.459 -22.272
  137    HA   ARG  18           HA       ARG  18   1.439   1.319 -21.818
  138   1HB   ARG  18          HB2       ARG  18   2.287  -0.406 -24.133
  139   2HB   ARG  18          HB1       ARG  18   2.483   1.340 -24.174
  140   1HG   ARG  18          HG2       ARG  18   3.899   1.237 -22.193
  141   2HG   ARG  18          HG1       ARG  18   3.684  -0.514 -22.127
  142   1HD   ARG  18          HD2       ARG  18   4.786  -0.781 -24.251
  143   2HD   ARG  18          HD1       ARG  18   4.875   0.966 -24.469
  144    HE   ARG  18           HE       ARG  18   6.198   0.406 -22.088
  145   1HH1  ARG  18          HH11      ARG  18   6.543  -0.352 -25.458
  146   2HH1  ARG  18          HH12      ARG  18   8.257  -0.531 -25.363
  147   1HH2  ARG  18          HH21      ARG  18   8.404   0.153 -21.944
  148   2HH2  ARG  18          HH22      ARG  18   9.313  -0.238 -23.379
  Start of MODEL    4
    1   1H    ILE   1          HT1       ILE   1   9.703   2.771   2.837
    2   2H    ILE   1          HT2       ILE   1   9.812   4.458   2.764
    3   3H    ILE   1          HT3       ILE   1   9.941   3.541   1.347
    4    HA   ILE   1           HA       ILE   1   7.508   3.189   2.899
    5    HB   ILE   1           HB       ILE   1   7.962   5.653   1.208
    6   1HG1  ILE   1          HG12      ILE   1   7.527   5.427   4.195
    7   2HG1  ILE   1          HG11      ILE   1   9.065   5.794   3.420
    8   1HG2  ILE   1          HG21      ILE   1   5.626   4.320   1.559
    9   2HG2  ILE   1          HG22      ILE   1   5.752   6.051   1.245
   10   3HG2  ILE   1          HG23      ILE   1   5.573   5.465   2.899
   11   1HD1  ILE   1          HD11      ILE   1   6.763   7.518   3.957
   12   2HD1  ILE   1          HD12      ILE   1   7.479   7.713   2.358
   13   3HD1  ILE   1          HD13      ILE   1   8.474   7.915   3.800
   14    HA   PRO   2           HA       PRO   2   6.921   1.022  -0.948
   15   1HB   PRO   2          HB2       PRO   2   4.377   0.180  -0.522
   16   2HB   PRO   2          HB1       PRO   2   5.780  -0.557   0.258
   17   1HG   PRO   2          HG2       PRO   2   3.798   1.379   1.355
   18   2HG   PRO   2          HG1       PRO   2   4.604   0.020   2.155
   19   1HD   PRO   2          HD2       PRO   2   5.340   2.657   2.440
   20   2HD   PRO   2          HD1       PRO   2   6.425   1.283   2.711
   21    H    GLU   3           HN       GLU   3   6.428   1.790  -2.890
   22    HA   GLU   3           HA       GLU   3   5.122   4.220  -3.319
   23   1HB   GLU   3          HB2       GLU   3   5.567   1.990  -5.303
   24   2HB   GLU   3          HB1       GLU   3   5.224   3.668  -5.698
   25   1HG   GLU   3          HG2       GLU   3   7.664   2.705  -4.225
   26   2HG   GLU   3          HG1       GLU   3   7.596   3.082  -5.946
   27    H    SER   4           HN       SER   4   3.939   0.934  -3.471
   28    HA   SER   4           HA       SER   4   1.894  -0.007  -3.711
   29   1HB   SER   4          HB2       SER   4   0.027   1.058  -2.507
   30   2HB   SER   4          HB1       SER   4   1.508   1.068  -1.556
   31    HG   SER   4           HG       SER   4   1.717   3.309  -2.613
   32    H    SER   5           HN       SER   5   0.456   3.176  -4.071
   33    HA   SER   5           HA       SER   5  -0.999   2.490  -6.386
   34   1HB   SER   5          HB2       SER   5  -1.922   4.241  -5.228
   35   2HB   SER   5          HB1       SER   5  -0.368   5.011  -4.935
   36    HG   SER   5           HG       SER   5  -0.541   6.091  -6.748
   37    H    GLU   6           HN       GLU   6   1.831   4.617  -6.044
   38    HA   GLU   6           HA       GLU   6   2.156   5.092  -8.799
   39   1HB   GLU   6          HB2       GLU   6   4.065   5.281  -6.470
   40   2HB   GLU   6          HB1       GLU   6   4.504   5.765  -8.101
   41   1HG   GLU   6          HG2       GLU   6   3.826   7.686  -6.767
   42   2HG   GLU   6          HG1       GLU   6   2.714   7.425  -8.108
   43    H    LEU   7           HN       LEU   7   3.352   2.598  -6.670
   44    HA   LEU   7           HA       LEU   7   5.185   1.395  -8.476
   45   1HB   LEU   7          HB2       LEU   7   5.126   1.014  -6.004
   46   2HB   LEU   7          HB1       LEU   7   3.661   0.084  -6.225
   47    HG   LEU   7           HG       LEU   7   4.911  -1.524  -7.628
   48   1HD1  LEU   7          HD11      LEU   7   6.904   0.533  -7.517
   49   2HD1  LEU   7          HD12      LEU   7   6.859  -0.928  -8.504
   50   3HD1  LEU   7          HD13      LEU   7   7.561  -0.978  -6.887
   51   1HD2  LEU   7          HD21      LEU   7   6.230  -1.125  -4.951
   52   2HD2  LEU   7          HD22      LEU   7   6.006  -2.638  -5.829
   53   3HD2  LEU   7          HD23      LEU   7   4.611  -1.794  -5.157
   54    H    THR   8           HN       THR   8   1.805   0.655  -7.568
   55    HA   THR   8           HA       THR   8   1.533  -1.516  -9.376
   56    HB   THR   8           HB       THR   8  -0.970  -1.046  -9.176
   57    HG1  THR   8           HG1      THR   8  -0.122   0.708  -7.101
   58   1HG2  THR   8          HG21      THR   8   0.203  -2.715  -7.824
   59   2HG2  THR   8          HG22      THR   8  -1.060  -1.910  -6.893
   60   3HG2  THR   8          HG23      THR   8   0.630  -1.468  -6.652
   61    H    LEU   9           HN       LEU   9   0.941   1.949  -9.744
   62    HA   LEU   9           HA       LEU   9  -0.345   1.891 -12.238
   63   1HB   LEU   9          HB2       LEU   9  -0.262   3.903 -10.925
   64   2HB   LEU   9          HB1       LEU   9   1.489   3.943 -11.007
   65    HG   LEU   9           HG       LEU   9   1.276   4.273 -13.492
   66   1HD1  LEU   9          HD11      LEU   9  -1.522   3.932 -12.811
   67   2HD1  LEU   9          HD12      LEU   9  -0.722   3.870 -14.381
   68   3HD1  LEU   9          HD13      LEU   9  -1.225   5.421 -13.708
   69   1HD2  LEU   9          HD21      LEU   9   0.784   6.132 -11.340
   70   2HD2  LEU   9          HD22      LEU   9   0.007   6.660 -12.833
   71   3HD2  LEU   9          HD23      LEU   9   1.741   6.335 -12.807
   72    H    GLN  10           HN       GLN  10   3.126   2.138 -11.465
   73    HA   GLN  10           HA       GLN  10   4.027   2.223 -14.150
   74   1HB   GLN  10          HB2       GLN  10   5.347   2.927 -12.142
   75   2HB   GLN  10          HB1       GLN  10   5.535   1.232 -11.725
   76   1HG   GLN  10          HG2       GLN  10   7.531   1.853 -12.787
   77   2HG   GLN  10          HG1       GLN  10   6.628   0.928 -13.984
   78   1HE2  GLN  10          HE21      GLN  10   6.837   1.763 -15.936
   79   2HE2  GLN  10          HE22      GLN  10   6.918   3.443 -16.324
   80    H    GLU  11           HN       GLU  11   3.457  -0.438 -11.880
   81    HA   GLU  11           HA       GLU  11   4.593  -2.503 -13.456
   82   1HB   GLU  11          HB2       GLU  11   2.491  -2.549 -11.295
   83   2HB   GLU  11          HB1       GLU  11   3.078  -4.010 -12.075
   84   1HG   GLU  11          HG2       GLU  11   5.352  -3.478 -11.312
   85   2HG   GLU  11          HG1       GLU  11   4.721  -2.053 -10.486
   86    H    LEU  12           HN       LEU  12   1.187  -1.498 -13.059
   87    HA   LEU  12           HA       LEU  12   0.065  -3.300 -14.885
   88   1HB   LEU  12          HB2       LEU  12  -0.830  -0.492 -14.215
   89   2HB   LEU  12          HB1       LEU  12  -1.807  -1.689 -15.043
   90    HG   LEU  12           HG       LEU  12  -0.763  -2.004 -12.229
   91   1HD1  LEU  12          HD11      LEU  12  -3.154  -1.627 -11.605
   92   2HD1  LEU  12          HD12      LEU  12  -3.438  -1.083 -13.258
   93   3HD1  LEU  12          HD13      LEU  12  -2.319  -0.199 -12.218
   94   1HD2  LEU  12          HD21      LEU  12  -3.083  -3.553 -13.011
   95   2HD2  LEU  12          HD22      LEU  12  -1.572  -4.079 -12.268
   96   3HD2  LEU  12          HD23      LEU  12  -1.681  -3.910 -14.020
   97    H    LEU  13           HN       LEU  13   0.953   0.120 -15.413
   98    HA   LEU  13           HA       LEU  13   0.792  -0.249 -18.290
   99   1HB   LEU  13          HB2       LEU  13   1.401   2.131 -16.551
  100   2HB   LEU  13          HB1       LEU  13   1.579   2.183 -18.294
  101    HG   LEU  13           HG       LEU  13  -0.879   1.414 -18.365
  102   1HD1  LEU  13          HD11      LEU  13  -0.522   2.043 -15.487
  103   2HD1  LEU  13          HD12      LEU  13  -1.544   0.836 -16.267
  104   3HD1  LEU  13          HD13      LEU  13  -2.027   2.532 -16.265
  105   1HD2  LEU  13          HD21      LEU  13  -0.503   4.177 -17.272
  106   2HD2  LEU  13          HD22      LEU  13  -1.582   3.623 -18.552
  107   3HD2  LEU  13          HD23      LEU  13   0.154   3.722 -18.844
  108    H    GLY  14           HN       GLY  14   2.647  -1.911 -17.178
  109   1HA   GLY  14          HA2       GLY  14   5.097  -0.931 -18.455
  110   2HA   GLY  14          HA1       GLY  14   5.206  -1.475 -16.787
  111    H    GLU  15           HN       GLU  15   3.907  -3.755 -16.572
  112    HA   GLU  15           HA       GLU  15   5.078  -5.429 -18.702
  113   1HB   GLU  15          HB2       GLU  15   6.113  -5.766 -16.493
  114   2HB   GLU  15          HB1       GLU  15   4.545  -6.230 -15.841
  115   1HG   GLU  15          HG2       GLU  15   4.463  -8.185 -17.157
  116   2HG   GLU  15          HG1       GLU  15   5.817  -7.659 -18.152
  117    H    GLU  16           HN       GLU  16   2.220  -5.131 -16.592
  118    HA   GLU  16           HA       GLU  16   0.820  -7.331 -17.682
  119   1HB   GLU  16          HB2       GLU  16   0.309  -5.979 -15.554
  120   2HB   GLU  16          HB1       GLU  16  -0.484  -4.828 -16.614
  121   1HG   GLU  16          HG2       GLU  16  -1.237  -7.733 -16.536
  122   2HG   GLU  16          HG1       GLU  16  -1.952  -6.534 -15.462
  123    H    ARG  17           HN       ARG  17   0.522  -3.844 -18.359
  124    HA   ARG  17           HA       ARG  17  -1.092  -4.243 -20.706
  125   1HB   ARG  17          HB2       ARG  17  -1.381  -2.203 -19.468
  126   2HB   ARG  17          HB1       ARG  17   0.333  -1.830 -19.577
  127   1HG   ARG  17          HG2       ARG  17  -0.146  -1.872 -22.157
  128   2HG   ARG  17          HG1       ARG  17  -1.801  -1.563 -21.630
  129   1HD   ARG  17          HD2       ARG  17  -1.003   0.383 -20.349
  130   2HD   ARG  17          HD1       ARG  17   0.630   0.085 -20.942
  131    HE   ARG  17           HE       ARG  17  -1.496   1.368 -22.336
  132   1HH1  ARG  17          HH11      ARG  17   1.426  -0.501 -22.806
  133   2HH1  ARG  17          HH12      ARG  17   1.590   0.026 -24.448
  134   1HH2  ARG  17          HH21      ARG  17  -1.229   2.020 -24.450
  135   2HH2  ARG  17          HH22      ARG  17   0.114   1.439 -25.367
  136    H    ARG  18           HN       ARG  18   2.299  -3.646 -20.028
  137    HA   ARG  18           HA       ARG  18   4.198  -3.867 -21.258
  138   1HB   ARG  18          HB2       ARG  18   2.332  -4.987 -23.357
  139   2HB   ARG  18          HB1       ARG  18   4.076  -4.899 -23.549
  140   1HG   ARG  18          HG2       ARG  18   2.899  -6.300 -21.190
  141   2HG   ARG  18          HG1       ARG  18   2.972  -7.103 -22.754
  142   1HD   ARG  18          HD2       ARG  18   4.910  -7.705 -21.462
  143   2HD   ARG  18          HD1       ARG  18   5.407  -6.693 -22.815
  144    HE   ARG  18           HE       ARG  18   5.019  -5.010 -20.647
  145   1HH1  ARG  18          HH11      ARG  18   7.078  -7.649 -21.493
  146   2HH1  ARG  18          HH12      ARG  18   8.388  -7.099 -20.513
  147   1HH2  ARG  18          HH21      ARG  18   6.704  -4.283 -19.385
  148   2HH2  ARG  18          HH22      ARG  18   8.183  -5.195 -19.324
  Start of MODEL    5
    1   1H    ILE   1          HT1       ILE   1   5.658  12.659  -2.019
    2   2H    ILE   1          HT2       ILE   1   4.127  12.680  -2.739
    3   3H    ILE   1          HT3       ILE   1   5.408  11.875  -3.498
    4    HA   ILE   1           HA       ILE   1   4.836  10.987  -0.805
    5    HB   ILE   1           HB       ILE   1   2.939  10.287  -3.050
    6   1HG1  ILE   1          HG12      ILE   1   2.420  11.972  -0.592
    7   2HG1  ILE   1          HG11      ILE   1   2.591  12.600  -2.227
    8   1HG2  ILE   1          HG21      ILE   1   3.154   9.424  -0.185
    9   2HG2  ILE   1          HG22      ILE   1   3.086   8.425  -1.636
   10   3HG2  ILE   1          HG23      ILE   1   1.646   9.283  -1.089
   11   1HD1  ILE   1          HD11      ILE   1   0.248  12.395  -1.445
   12   2HD1  ILE   1          HD12      ILE   1   0.466  10.646  -1.387
   13   3HD1  ILE   1          HD13      ILE   1   0.591  11.499  -2.925
   14    HA   PRO   2           HA       PRO   2   7.585   7.963  -2.608
   15   1HB   PRO   2          HB2       PRO   2   7.641   6.202  -0.557
   16   2HB   PRO   2          HB1       PRO   2   8.471   7.761  -0.497
   17   1HG   PRO   2          HG2       PRO   2   5.844   6.964   0.690
   18   2HG   PRO   2          HG1       PRO   2   7.137   7.953   1.393
   19   1HD   PRO   2          HD2       PRO   2   4.876   9.001   0.282
   20   2HD   PRO   2          HD1       PRO   2   6.428   9.856   0.317
   21    H    GLU   3           HN       GLU   3   5.255   7.736  -3.860
   22    HA   GLU   3           HA       GLU   3   3.816   5.320  -3.384
   23   1HB   GLU   3          HB2       GLU   3   3.938   7.195  -5.746
   24   2HB   GLU   3          HB1       GLU   3   2.842   5.822  -5.652
   25   1HG   GLU   3          HG2       GLU   3   1.562   6.778  -3.995
   26   2HG   GLU   3          HG1       GLU   3   2.866   7.831  -3.450
   27    H    SER   4           HN       SER   4   6.371   4.445  -3.384
   28    HA   SER   4           HA       SER   4   7.369   3.579  -5.897
   29   1HB   SER   4          HB2       SER   4   8.809   2.062  -4.577
   30   2HB   SER   4          HB1       SER   4   8.818   3.703  -3.934
   31    HG   SER   4           HG       SER   4   8.525   1.822  -2.425
   32    H    SER   5           HN       SER   5   5.419   1.946  -3.422
   33    HA   SER   5           HA       SER   5   5.221  -0.555  -4.694
   34   1HB   SER   5          HB2       SER   5   4.562  -0.290  -2.383
   35   2HB   SER   5          HB1       SER   5   3.296   0.849  -2.831
   36    HG   SER   5           HG       SER   5   2.035  -0.774  -3.238
   37    H    GLU   6           HN       GLU   6   3.074   2.269  -4.763
   38    HA   GLU   6           HA       GLU   6   1.133   1.290  -6.515
   39   1HB   GLU   6          HB2       GLU   6   2.168   4.105  -6.114
   40   2HB   GLU   6          HB1       GLU   6   0.749   3.718  -7.074
   41   1HG   GLU   6          HG2       GLU   6   0.168   4.508  -4.836
   42   2HG   GLU   6          HG1       GLU   6  -0.388   2.862  -5.120
   43    H    LEU   7           HN       LEU   7   4.205   2.927  -7.156
   44    HA   LEU   7           HA       LEU   7   3.949   3.083  -9.959
   45   1HB   LEU   7          HB2       LEU   7   6.025   3.542  -7.979
   46   2HB   LEU   7          HB1       LEU   7   6.669   2.859  -9.458
   47    HG   LEU   7           HG       LEU   7   6.778   5.299  -9.480
   48   1HD1  LEU   7          HD11      LEU   7   5.006   5.443 -11.553
   49   2HD1  LEU   7          HD12      LEU   7   5.317   3.710 -11.446
   50   3HD1  LEU   7          HD13      LEU   7   6.659   4.835 -11.661
   51   1HD2  LEU   7          HD21      LEU   7   4.689   6.614  -9.629
   52   2HD2  LEU   7          HD22      LEU   7   4.907   5.841  -8.059
   53   3HD2  LEU   7          HD23      LEU   7   3.777   5.158  -9.228
   54    H    THR   8           HN       THR   8   5.363   0.534  -7.860
   55    HA   THR   8           HA       THR   8   6.432  -0.999  -9.980
   56    HB   THR   8           HB       THR   8   6.431  -2.920  -8.462
   57    HG1  THR   8           HG1      THR   8   4.691  -1.286  -6.962
   58   1HG2  THR   8          HG21      THR   8   7.758  -1.866  -6.605
   59   2HG2  THR   8          HG22      THR   8   7.323  -0.298  -7.287
   60   3HG2  THR   8          HG23      THR   8   8.275  -1.440  -8.237
   61    H    LEU   9           HN       LEU   9   3.258  -1.193  -8.385
   62    HA   LEU   9           HA       LEU   9   2.263  -3.372  -9.902
   63   1HB   LEU   9          HB2       LEU   9   0.505  -1.178  -8.864
   64   2HB   LEU   9          HB1       LEU   9   0.190  -2.903  -8.937
   65    HG   LEU   9           HG       LEU   9   2.239  -1.681  -7.110
   66   1HD1  LEU   9          HD11      LEU   9  -0.123  -0.875  -6.704
   67   2HD1  LEU   9          HD12      LEU   9   0.655  -1.697  -5.350
   68   3HD1  LEU   9          HD13      LEU   9  -0.537  -2.549  -6.331
   69   1HD2  LEU   9          HD21      LEU   9   2.418  -4.108  -7.718
   70   2HD2  LEU   9          HD22      LEU   9   0.849  -4.350  -6.950
   71   3HD2  LEU   9          HD23      LEU   9   2.220  -3.787  -5.995
   72    H    GLN  10           HN       GLN  10   1.977   0.130 -10.217
   73    HA   GLN  10           HA       GLN  10   0.358   0.264 -12.490
   74   1HB   GLN  10          HB2       GLN  10   0.811   2.178 -11.075
   75   2HB   GLN  10          HB1       GLN  10   2.520   2.113 -11.471
   76   1HG   GLN  10          HG2       GLN  10   1.967   2.668 -13.806
   77   2HG   GLN  10          HG1       GLN  10   0.270   2.800 -13.347
   78   1HE2  GLN  10          HE21      GLN  10   2.041   3.817 -10.765
   79   2HE2  GLN  10          HE22      GLN  10   2.055   5.515 -11.086
   80    H    GLU  11           HN       GLU  11   3.881   0.012 -12.158
   81    HA   GLU  11           HA       GLU  11   4.514   0.297 -14.915
   82   1HB   GLU  11          HB2       GLU  11   6.069   0.390 -12.859
   83   2HB   GLU  11          HB1       GLU  11   6.117  -1.360 -12.975
   84   1HG   GLU  11          HG2       GLU  11   8.013  -0.687 -14.117
   85   2HG   GLU  11          HG1       GLU  11   6.845  -0.975 -15.405
   86    H    LEU  12           HN       LEU  12   4.044  -2.573 -12.862
   87    HA   LEU  12           HA       LEU  12   4.457  -4.520 -14.856
   88   1HB   LEU  12          HB2       LEU  12   2.713  -4.662 -12.394
   89   2HB   LEU  12          HB1       LEU  12   3.211  -6.038 -13.358
   90    HG   LEU  12           HG       LEU  12   5.076  -4.232 -11.823
   91   1HD1  LEU  12          HD11      LEU  12   3.395  -6.216 -10.849
   92   2HD1  LEU  12          HD12      LEU  12   4.805  -5.532 -10.041
   93   3HD1  LEU  12          HD13      LEU  12   4.967  -7.001 -11.004
   94   1HD2  LEU  12          HD21      LEU  12   6.222  -6.734 -12.483
   95   2HD2  LEU  12          HD22      LEU  12   6.708  -5.129 -13.030
   96   3HD2  LEU  12          HD23      LEU  12   5.531  -6.058 -13.959
   97    H    LEU  13           HN       LEU  13   1.423  -3.081 -13.627
   98    HA   LEU  13           HA       LEU  13  -0.321  -4.466 -15.333
   99   1HB   LEU  13          HB2       LEU  13  -0.582  -1.707 -14.139
  100   2HB   LEU  13          HB1       LEU  13  -1.886  -2.553 -14.949
  101    HG   LEU  13           HG       LEU  13  -0.499  -3.483 -12.432
  102   1HD1  LEU  13          HD11      LEU  13  -1.826  -1.987 -11.446
  103   2HD1  LEU  13          HD12      LEU  13  -3.152  -3.072 -11.864
  104   3HD1  LEU  13          HD13      LEU  13  -2.759  -1.713 -12.917
  105   1HD2  LEU  13          HD21      LEU  13  -2.956  -4.598 -13.773
  106   2HD2  LEU  13          HD22      LEU  13  -2.133  -5.229 -12.346
  107   3HD2  LEU  13          HD23      LEU  13  -1.342  -5.294 -13.921
  108    H    GLY  14           HN       GLY  14   1.324  -1.356 -15.783
  109   1HA   GLY  14          HA2       GLY  14   0.215  -0.679 -18.274
  110   2HA   GLY  14          HA1       GLY  14   1.763  -0.115 -17.661
  111    H    GLU  15           HN       GLU  15   3.299  -2.334 -17.524
  112    HA   GLU  15           HA       GLU  15   4.001  -2.790 -20.224
  113   1HB   GLU  15          HB2       GLU  15   4.881  -3.955 -17.613
  114   2HB   GLU  15          HB1       GLU  15   5.414  -4.694 -19.118
  115   1HG   GLU  15          HG2       GLU  15   5.809  -1.798 -18.395
  116   2HG   GLU  15          HG1       GLU  15   7.022  -3.063 -18.202
  117    H    GLU  16           HN       GLU  16   2.149  -4.747 -17.920
  118    HA   GLU  16           HA       GLU  16   1.971  -7.040 -19.592
  119   1HB   GLU  16          HB2       GLU  16   0.710  -6.115 -17.089
  120   2HB   GLU  16          HB1       GLU  16  -0.258  -7.226 -18.045
  121   1HG   GLU  16          HG2       GLU  16   0.996  -8.456 -16.414
  122   2HG   GLU  16          HG1       GLU  16   1.602  -8.837 -18.022
  123    H    ARG  17           HN       ARG  17  -0.048  -4.143 -19.220
  124    HA   ARG  17           HA       ARG  17  -2.104  -5.134 -20.987
  125   1HB   ARG  17          HB2       ARG  17  -1.571  -2.394 -19.844
  126   2HB   ARG  17          HB1       ARG  17  -2.944  -2.762 -20.877
  127   1HG   ARG  17          HG2       ARG  17  -2.365  -4.045 -18.216
  128   2HG   ARG  17          HG1       ARG  17  -3.545  -2.767 -18.511
  129   1HD   ARG  17          HD2       ARG  17  -4.740  -4.253 -20.058
  130   2HD   ARG  17          HD1       ARG  17  -3.576  -5.532 -19.713
  131    HE   ARG  17           HE       ARG  17  -4.651  -4.689 -17.289
  132   1HH1  ARG  17          HH11      ARG  17  -5.682  -6.244 -20.189
  133   2HH1  ARG  17          HH12      ARG  17  -6.952  -7.119 -19.415
  134   1HH2  ARG  17          HH21      ARG  17  -6.297  -5.829 -16.273
  135   2HH2  ARG  17          HH22      ARG  17  -7.299  -6.885 -17.200
  136    H    ARG  18           HN       ARG  18  -0.023  -2.249 -21.313
  137    HA   ARG  18           HA       ARG  18   0.768  -1.121 -23.112
  138   1HB   ARG  18          HB2       ARG  18   1.181  -3.971 -23.972
  139   2HB   ARG  18          HB1       ARG  18   1.709  -2.621 -24.966
  140   1HG   ARG  18          HG2       ARG  18   3.172  -1.841 -23.213
  141   2HG   ARG  18          HG1       ARG  18   2.573  -3.090 -22.118
  142   1HD   ARG  18          HD2       ARG  18   3.442  -4.816 -23.608
  143   2HD   ARG  18          HD1       ARG  18   4.022  -3.578 -24.716
  144    HE   ARG  18           HE       ARG  18   5.215  -3.029 -22.264
  145   1HH1  ARG  18          HH11      ARG  18   5.103  -5.674 -24.498
  146   2HH1  ARG  18          HH12      ARG  18   6.708  -6.201 -24.151
  147   1HH2  ARG  18          HH21      ARG  18   7.324  -3.707 -21.806
  148   2HH2  ARG  18          HH22      ARG  18   7.959  -5.097 -22.641
  Start of MODEL    6
    1   1H    ILE   1          HT1       ILE   1   3.487   3.358   3.604
    2   2H    ILE   1          HT2       ILE   1   4.101   2.441   4.888
    3   3H    ILE   1          HT3       ILE   1   2.566   2.100   4.262
    4    HA   ILE   1           HA       ILE   1   4.900   0.888   3.560
    5    HB   ILE   1           HB       ILE   1   3.555  -0.142   1.740
    6   1HG1  ILE   1          HG12      ILE   1   1.394   1.777   2.648
    7   2HG1  ILE   1          HG11      ILE   1   2.272   1.898   1.127
    8   1HG2  ILE   1          HG21      ILE   1   2.480   0.098   4.521
    9   2HG2  ILE   1          HG22      ILE   1   3.339  -1.244   3.766
   10   3HG2  ILE   1          HG23      ILE   1   1.665  -0.911   3.327
   11   1HD1  ILE   1          HD11      ILE   1   0.989  -0.693   1.601
   12   2HD1  ILE   1          HD12      ILE   1   1.034   0.310   0.151
   13   3HD1  ILE   1          HD13      ILE   1  -0.116   0.672   1.438
   14    HA   PRO   2           HA       PRO   2   6.831   3.311   0.415
   15   1HB   PRO   2          HB2       PRO   2   8.047   1.368  -1.054
   16   2HB   PRO   2          HB1       PRO   2   8.631   1.896   0.527
   17   1HG   PRO   2          HG2       PRO   2   6.994  -0.503  -0.185
   18   2HG   PRO   2          HG1       PRO   2   8.346  -0.367   0.955
   19   1HD   PRO   2          HD2       PRO   2   5.753  -0.407   1.748
   20   2HD   PRO   2          HD1       PRO   2   7.011   0.482   2.628
   21    H    GLU   3           HN       GLU   3   5.726   4.293  -1.145
   22    HA   GLU   3           HA       GLU   3   3.657   3.155  -2.665
   23   1HB   GLU   3          HB2       GLU   3   5.277   5.622  -3.304
   24   2HB   GLU   3          HB1       GLU   3   3.690   5.226  -3.948
   25   1HG   GLU   3          HG2       GLU   3   2.722   5.403  -1.733
   26   2HG   GLU   3          HG1       GLU   3   4.313   5.739  -1.051
   27    H    SER   4           HN       SER   4   7.015   2.937  -3.081
   28    HA   SER   4           HA       SER   4   7.446   2.885  -5.800
   29   1HB   SER   4          HB2       SER   4   9.295   1.272  -5.297
   30   2HB   SER   4          HB1       SER   4   9.288   2.694  -4.254
   31    HG   SER   4           HG       SER   4   8.705   0.030  -3.648
   32    H    SER   5           HN       SER   5   5.986   0.382  -3.785
   33    HA   SER   5           HA       SER   5   6.031  -1.683  -5.728
   34   1HB   SER   5          HB2       SER   5   4.119  -1.264  -3.425
   35   2HB   SER   5          HB1       SER   5   4.311  -2.755  -4.344
   36    HG   SER   5           HG       SER   5   5.520  -2.749  -2.384
   37    H    GLU   6           HN       GLU   6   3.382   0.482  -4.686
   38    HA   GLU   6           HA       GLU   6   1.524  -0.328  -6.633
   39   1HB   GLU   6          HB2       GLU   6   1.786   2.403  -5.355
   40   2HB   GLU   6          HB1       GLU   6   0.356   1.769  -6.150
   41   1HG   GLU   6          HG2       GLU   6  -0.203   1.401  -3.980
   42   2HG   GLU   6          HG1       GLU   6   0.594  -0.128  -4.345
   43    H    LEU   7           HN       LEU   7   3.919   2.278  -6.641
   44    HA   LEU   7           HA       LEU   7   3.257   3.416  -9.116
   45   1HB   LEU   7          HB2       LEU   7   5.913   3.282  -7.694
   46   2HB   LEU   7          HB1       LEU   7   5.600   4.279  -9.102
   47    HG   LEU   7           HG       LEU   7   4.226   4.547  -6.426
   48   1HD1  LEU   7          HD11      LEU   7   5.648   6.868  -7.195
   49   2HD1  LEU   7          HD12      LEU   7   6.740   5.492  -7.357
   50   3HD1  LEU   7          HD13      LEU   7   5.941   5.808  -5.817
   51   1HD2  LEU   7          HD21      LEU   7   2.783   5.986  -7.342
   52   2HD2  LEU   7          HD22      LEU   7   3.243   5.269  -8.886
   53   3HD2  LEU   7          HD23      LEU   7   4.031   6.746  -8.330
   54    H    THR   8           HN       THR   8   5.589   0.804  -8.342
   55    HA   THR   8           HA       THR   8   6.415   0.517 -11.068
   56    HB   THR   8           HB       THR   8   7.308  -1.730 -10.305
   57    HG1  THR   8           HG1      THR   8   6.761  -0.785  -7.688
   58   1HG2  THR   8          HG21      THR   8   8.906  -0.486  -8.584
   59   2HG2  THR   8          HG22      THR   8   8.105   0.931  -9.262
   60   3HG2  THR   8          HG23      THR   8   8.978  -0.179 -10.319
   61    H    LEU   9           HN       LEU   9   4.136  -1.290  -9.016
   62    HA   LEU   9           HA       LEU   9   3.385  -3.232 -10.894
   63   1HB   LEU   9          HB2       LEU   9   2.790  -3.415  -8.559
   64   2HB   LEU   9          HB1       LEU   9   1.811  -1.964  -8.654
   65    HG   LEU   9           HG       LEU   9   0.343  -3.193 -10.302
   66   1HD1  LEU   9          HD11      LEU   9   1.100  -5.804  -9.297
   67   2HD1  LEU   9          HD12      LEU   9   2.385  -5.057 -10.246
   68   3HD1  LEU   9          HD13      LEU   9   0.783  -5.276 -10.949
   69   1HD2  LEU   9          HD21      LEU   9  -0.907  -4.307  -8.583
   70   2HD2  LEU   9          HD22      LEU   9  -0.201  -2.841  -7.904
   71   3HD2  LEU   9          HD23      LEU   9   0.519  -4.412  -7.551
   72    H    GLN  10           HN       GLN  10   1.942  -0.052 -10.205
   73    HA   GLN  10           HA       GLN  10  -0.156  -0.186 -12.073
   74   1HB   GLN  10          HB2       GLN  10  -0.029   1.455 -10.248
   75   2HB   GLN  10          HB1       GLN  10   1.331   2.234 -11.040
   76   1HG   GLN  10          HG2       GLN  10  -0.103   2.829 -12.922
   77   2HG   GLN  10          HG1       GLN  10  -1.467   2.042 -12.129
   78   1HE2  GLN  10          HE21      GLN  10   0.335   3.340  -9.726
   79   2HE2  GLN  10          HE22      GLN  10  -0.454   4.868  -9.563
   80    H    GLU  11           HN       GLU  11   3.173   0.983 -12.386
   81    HA   GLU  11           HA       GLU  11   2.916   2.007 -15.018
   82   1HB   GLU  11          HB2       GLU  11   4.783   2.427 -13.298
   83   2HB   GLU  11          HB1       GLU  11   5.462   0.901 -13.842
   84   1HG   GLU  11          HG2       GLU  11   6.594   2.613 -15.004
   85   2HG   GLU  11          HG1       GLU  11   5.504   1.850 -16.160
   86    H    LEU  12           HN       LEU  12   4.120  -1.117 -13.777
   87    HA   LEU  12           HA       LEU  12   4.698  -2.271 -16.284
   88   1HB   LEU  12          HB2       LEU  12   3.837  -3.633 -13.728
   89   2HB   LEU  12          HB1       LEU  12   4.558  -4.436 -15.109
   90    HG   LEU  12           HG       LEU  12   5.921  -2.339 -13.422
   91   1HD1  LEU  12          HD11      LEU  12   5.425  -4.649 -12.405
   92   2HD1  LEU  12          HD12      LEU  12   7.076  -4.034 -12.332
   93   3HD1  LEU  12          HD13      LEU  12   6.638  -5.243 -13.539
   94   1HD2  LEU  12          HD21      LEU  12   6.668  -3.806 -15.898
   95   2HD2  LEU  12          HD22      LEU  12   7.922  -3.488 -14.700
   96   3HD2  LEU  12          HD23      LEU  12   7.024  -2.148 -15.415
   97    H    LEU  13           HN       LEU  13   1.781  -2.536 -14.241
   98    HA   LEU  13           HA       LEU  13   0.359  -3.870 -16.398
   99   1HB   LEU  13          HB2       LEU  13  -0.279  -3.230 -13.552
  100   2HB   LEU  13          HB1       LEU  13  -1.583  -3.603 -14.664
  101    HG   LEU  13           HG       LEU  13  -0.338  -5.739 -15.207
  102   1HD1  LEU  13          HD11      LEU  13   1.525  -6.368 -14.137
  103   2HD1  LEU  13          HD12      LEU  13   0.998  -5.685 -12.599
  104   3HD1  LEU  13          HD13      LEU  13   1.716  -4.643 -13.827
  105   1HD2  LEU  13          HD21      LEU  13  -1.912  -5.042 -12.866
  106   2HD2  LEU  13          HD22      LEU  13  -0.923  -6.482 -12.620
  107   3HD2  LEU  13          HD23      LEU  13  -2.063  -6.413 -13.965
  108    H    GLY  14           HN       GLY  14   1.240  -1.345 -17.051
  109   1HA   GLY  14          HA2       GLY  14  -1.297  -0.077 -17.736
  110   2HA   GLY  14          HA1       GLY  14  -0.141   0.909 -16.851
  111    H    GLU  15           HN       GLU  15   2.237   0.516 -17.904
  112    HA   GLU  15           HA       GLU  15   2.120   1.775 -20.448
  113   1HB   GLU  15          HB2       GLU  15   3.978   2.087 -18.848
  114   2HB   GLU  15          HB1       GLU  15   4.470   0.420 -19.111
  115   1HG   GLU  15          HG2       GLU  15   4.907   0.922 -21.464
  116   2HG   GLU  15          HG1       GLU  15   4.424   2.595 -21.192
  117    H    GLU  16           HN       GLU  16   2.724  -1.545 -19.436
  118    HA   GLU  16           HA       GLU  16   3.361  -2.521 -22.043
  119   1HB   GLU  16          HB2       GLU  16   2.650  -3.856 -19.440
  120   2HB   GLU  16          HB1       GLU  16   2.914  -4.779 -20.912
  121   1HG   GLU  16          HG2       GLU  16   4.948  -2.877 -19.787
  122   2HG   GLU  16          HG1       GLU  16   4.877  -4.585 -19.353
  123    H    ARG  17           HN       ARG  17   0.476  -1.469 -20.748
  124    HA   ARG  17           HA       ARG  17  -1.036  -3.078 -22.692
  125   1HB   ARG  17          HB2       ARG  17  -1.853  -2.436 -19.859
  126   2HB   ARG  17          HB1       ARG  17  -2.952  -3.081 -21.072
  127   1HG   ARG  17          HG2       ARG  17  -1.718  -5.102 -21.238
  128   2HG   ARG  17          HG1       ARG  17  -0.401  -4.446 -20.266
  129   1HD   ARG  17          HD2       ARG  17  -1.981  -4.271 -18.355
  130   2HD   ARG  17          HD1       ARG  17  -3.200  -5.078 -19.342
  131    HE   ARG  17           HE       ARG  17  -2.202  -7.049 -18.809
  132   1HH1  ARG  17          HH11      ARG  17   0.182  -4.552 -18.512
  133   2HH1  ARG  17          HH12      ARG  17   1.416  -5.627 -17.961
  134   1HH2  ARG  17          HH21      ARG  17  -0.594  -8.445 -18.098
  135   2HH2  ARG  17          HH22      ARG  17   0.975  -7.824 -17.725
  136    H    ARG  18           HN       ARG  18  -0.055  -0.588 -23.307
  137    HA   ARG  18           HA       ARG  18  -2.556   0.894 -23.638
  138   1HB   ARG  18          HB2       ARG  18  -1.276   3.063 -23.291
  139   2HB   ARG  18          HB1       ARG  18  -1.650   2.133 -21.851
  140   1HG   ARG  18          HG2       ARG  18   0.487   2.440 -21.316
  141   2HG   ARG  18          HG1       ARG  18   0.826   1.188 -22.507
  142   1HD   ARG  18          HD2       ARG  18   0.724   4.127 -23.160
  143   2HD   ARG  18          HD1       ARG  18   2.203   3.282 -22.708
  144    HE   ARG  18           HE       ARG  18   0.951   1.914 -24.842
  145   1HH1  ARG  18          HH11      ARG  18   2.717   4.830 -24.181
  146   2HH1  ARG  18          HH12      ARG  18   3.293   4.979 -25.800
  147   1HH2  ARG  18          HH21      ARG  18   1.675   2.124 -26.916
  148   2HH2  ARG  18          HH22      ARG  18   2.693   3.452 -27.359
  Start of MODEL    7
    1   1H    ILE   1          HT1       ILE   1   6.653  -1.842   4.132
    2   2H    ILE   1          HT2       ILE   1   5.677  -1.166   5.337
    3   3H    ILE   1          HT3       ILE   1   6.851  -0.218   4.570
    4    HA   ILE   1           HA       ILE   1   4.663  -1.466   3.040
    5    HB   ILE   1           HB       ILE   1   4.606   1.242   4.398
    6   1HG1  ILE   1          HG12      ILE   1   2.334   0.224   5.201
    7   2HG1  ILE   1          HG11      ILE   1   3.091  -1.316   4.816
    8   1HG2  ILE   1          HG21      ILE   1   3.744   1.328   2.091
    9   2HG2  ILE   1          HG22      ILE   1   2.496   1.640   3.296
   10   3HG2  ILE   1          HG23      ILE   1   2.580   0.068   2.501
   11   1HD1  ILE   1          HD11      ILE   1   3.736   0.635   6.963
   12   2HD1  ILE   1          HD12      ILE   1   5.024  -0.382   6.317
   13   3HD1  ILE   1          HD13      ILE   1   3.592  -1.121   7.034
   14    HA   PRO   2           HA       PRO   2   7.281   0.462  -0.012
   15   1HB   PRO   2          HB2       PRO   2   6.033  -0.441  -2.214
   16   2HB   PRO   2          HB1       PRO   2   6.983  -1.504  -1.171
   17   1HG   PRO   2          HG2       PRO   2   4.030  -1.213  -1.395
   18   2HG   PRO   2          HG1       PRO   2   4.997  -2.661  -1.069
   19   1HD   PRO   2          HD2       PRO   2   3.646  -1.122   0.837
   20   2HD   PRO   2          HD1       PRO   2   4.912  -2.317   1.173
   21    H    GLU   3           HN       GLU   3   7.092   2.660  -0.069
   22    HA   GLU   3           HA       GLU   3   4.693   4.081  -0.480
   23   1HB   GLU   3          HB2       GLU   3   7.570   4.910  -0.822
   24   2HB   GLU   3          HB1       GLU   3   6.230   6.027  -1.012
   25   1HG   GLU   3          HG2       GLU   3   7.192   6.266   1.178
   26   2HG   GLU   3          HG1       GLU   3   5.566   5.602   1.315
   27    H    SER   4           HN       SER   4   7.079   2.897  -2.747
   28    HA   SER   4           HA       SER   4   6.042   4.332  -5.002
   29   1HB   SER   4          HB2       SER   4   7.558   2.958  -6.342
   30   2HB   SER   4          HB1       SER   4   8.390   3.585  -4.920
   31    HG   SER   4           HG       SER   4   7.688   0.978  -5.576
   32    H    SER   5           HN       SER   5   3.949   2.957  -3.691
   33    HA   SER   5           HA       SER   5   3.306   0.536  -5.080
   34   1HB   SER   5          HB2       SER   5   1.635   2.420  -3.422
   35   2HB   SER   5          HB1       SER   5   0.998   0.941  -4.135
   36    HG   SER   5           HG       SER   5   3.108   1.159  -2.227
   37    H    GLU   6           HN       GLU   6   2.219   3.911  -5.352
   38    HA   GLU   6           HA       GLU   6   0.457   3.509  -7.521
   39   1HB   GLU   6          HB2       GLU   6   2.001   5.979  -6.715
   40   2HB   GLU   6          HB1       GLU   6   0.683   5.953  -7.877
   41   1HG   GLU   6          HG2       GLU   6  -0.861   5.246  -6.153
   42   2HG   GLU   6          HG1       GLU   6   0.453   5.179  -4.979
   43    H    LEU   7           HN       LEU   7   3.880   4.350  -7.350
   44    HA   LEU   7           HA       LEU   7   4.335   4.790 -10.083
   45   1HB   LEU   7          HB2       LEU   7   6.237   3.756  -7.978
   46   2HB   LEU   7          HB1       LEU   7   6.709   4.368  -9.551
   47    HG   LEU   7           HG       LEU   7   5.360   5.980  -7.382
   48   1HD1  LEU   7          HD11      LEU   7   8.213   5.930  -8.352
   49   2HD1  LEU   7          HD12      LEU   7   7.624   5.452  -6.760
   50   3HD1  LEU   7          HD13      LEU   7   7.539   7.141  -7.261
   51   1HD2  LEU   7          HD21      LEU   7   5.126   6.469  -9.999
   52   2HD2  LEU   7          HD22      LEU   7   6.681   7.248  -9.706
   53   3HD2  LEU   7          HD23      LEU   7   5.257   7.749  -8.793
   54    H    THR   8           HN       THR   8   4.607   1.804  -8.130
   55    HA   THR   8           HA       THR   8   5.466   0.230 -10.365
   56    HB   THR   8           HB       THR   8   4.836  -1.739  -8.885
   57    HG1  THR   8           HG1      THR   8   4.674   0.157  -6.793
   58   1HG2  THR   8          HG21      THR   8   7.035  -0.055  -8.878
   59   2HG2  THR   8          HG22      THR   8   6.948  -1.666  -8.165
   60   3HG2  THR   8          HG23      THR   8   6.635  -0.243  -7.170
   61    H    LEU   9           HN       LEU   9   2.335   0.711  -8.749
   62    HA   LEU   9           HA       LEU   9   0.849  -1.132 -10.268
   63   1HB   LEU   9          HB2       LEU   9  -0.035  -0.192  -8.242
   64   2HB   LEU   9          HB1       LEU   9   0.031   1.429  -8.907
   65    HG   LEU   9           HG       LEU   9  -1.658   0.645 -10.635
   66   1HD1  LEU   9          HD11      LEU   9  -1.216  -1.792 -10.140
   67   2HD1  LEU   9          HD12      LEU   9  -2.910  -1.314 -10.243
   68   3HD1  LEU   9          HD13      LEU   9  -2.161  -1.570  -8.667
   69   1HD2  LEU   9          HD21      LEU   9  -2.350   2.107  -8.896
   70   2HD2  LEU   9          HD22      LEU   9  -2.344   0.802  -7.709
   71   3HD2  LEU   9          HD23      LEU   9  -3.549   0.818  -8.997
   72    H    GLN  10           HN       GLN  10   1.419   2.344 -10.775
   73    HA   GLN  10           HA       GLN  10  -0.172   2.684 -13.054
   74   1HB   GLN  10          HB2       GLN  10   0.860   4.497 -11.675
   75   2HB   GLN  10          HB1       GLN  10   2.410   4.114 -12.406
   76   1HG   GLN  10          HG2       GLN  10   1.549   5.996 -13.542
   77   2HG   GLN  10          HG1       GLN  10   1.379   4.619 -14.631
   78   1HE2  GLN  10          HE21      GLN  10  -0.527   4.324 -15.529
   79   2HE2  GLN  10          HE22      GLN  10  -2.017   5.021 -14.997
   80    H    GLU  11           HN       GLU  11   3.232   1.731 -12.745
   81    HA   GLU  11           HA       GLU  11   3.729   1.617 -15.557
   82   1HB   GLU  11          HB2       GLU  11   5.538   1.944 -13.940
   83   2HB   GLU  11          HB1       GLU  11   5.222   0.361 -13.245
   84   1HG   GLU  11          HG2       GLU  11   5.877  -0.707 -15.321
   85   2HG   GLU  11          HG1       GLU  11   6.141   0.870 -16.066
   86    H    LEU  12           HN       LEU  12   2.933  -0.804 -13.088
   87    HA   LEU  12           HA       LEU  12   3.168  -3.130 -14.588
   88   1HB   LEU  12          HB2       LEU  12   2.746  -3.073 -12.173
   89   2HB   LEU  12          HB1       LEU  12   1.130  -2.461 -12.461
   90    HG   LEU  12           HG       LEU  12   0.578  -4.590 -13.627
   91   1HD1  LEU  12          HD11      LEU  12   2.284  -5.839 -14.323
   92   2HD1  LEU  12          HD12      LEU  12   2.468  -6.351 -12.645
   93   3HD1  LEU  12          HD13      LEU  12   3.425  -5.007 -13.266
   94   1HD2  LEU  12          HD21      LEU  12   1.417  -5.679 -11.092
   95   2HD2  LEU  12          HD22      LEU  12  -0.205  -5.297 -11.671
   96   3HD2  LEU  12          HD23      LEU  12   0.774  -4.047 -10.900
   97    H    LEU  13           HN       LEU  13   0.292  -1.049 -14.199
   98    HA   LEU  13           HA       LEU  13  -1.049  -2.515 -16.339
   99   1HB   LEU  13          HB2       LEU  13  -1.961  -0.412 -14.400
  100   2HB   LEU  13          HB1       LEU  13  -2.929  -0.842 -15.798
  101    HG   LEU  13           HG       LEU  13  -2.777  -3.252 -14.935
  102   1HD1  LEU  13          HD11      LEU  13  -1.452  -1.785 -12.765
  103   2HD1  LEU  13          HD12      LEU  13  -1.339  -3.483 -13.230
  104   3HD1  LEU  13          HD13      LEU  13  -2.696  -2.925 -12.252
  105   1HD2  LEU  13          HD21      LEU  13  -4.465  -1.028 -14.138
  106   2HD2  LEU  13          HD22      LEU  13  -4.453  -2.329 -12.948
  107   3HD2  LEU  13          HD23      LEU  13  -4.904  -2.667 -14.619
  108    H    GLY  14           HN       GLY  14   1.151  -1.268 -17.296
  109   1HA   GLY  14          HA2       GLY  14  -0.004   0.489 -19.276
  110   2HA   GLY  14          HA1       GLY  14   1.113   1.303 -18.195
  111    H    GLU  15           HN       GLU  15   3.196  -0.363 -17.881
  112    HA   GLU  15           HA       GLU  15   4.455  -0.253 -20.456
  113   1HB   GLU  15          HB2       GLU  15   5.640   0.190 -18.298
  114   2HB   GLU  15          HB1       GLU  15   5.525  -1.525 -17.932
  115   1HG   GLU  15          HG2       GLU  15   7.709  -1.051 -18.791
  116   2HG   GLU  15          HG1       GLU  15   6.826  -2.015 -19.971
  117    H    GLU  16           HN       GLU  16   3.110  -2.821 -18.455
  118    HA   GLU  16           HA       GLU  16   4.105  -4.951 -20.082
  119   1HB   GLU  16          HB2       GLU  16   3.474  -5.392 -17.773
  120   2HB   GLU  16          HB1       GLU  16   1.825  -4.869 -18.092
  121   1HG   GLU  16          HG2       GLU  16   1.703  -6.745 -19.782
  122   2HG   GLU  16          HG1       GLU  16   3.217  -7.329 -19.098
  123    H    ARG  17           HN       ARG  17   1.090  -3.112 -19.915
  124    HA   ARG  17           HA       ARG  17  -0.114  -4.599 -22.091
  125   1HB   ARG  17          HB2       ARG  17  -1.039  -2.273 -20.421
  126   2HB   ARG  17          HB1       ARG  17  -1.960  -2.864 -21.794
  127   1HG   ARG  17          HG2       ARG  17  -1.176  -4.582 -19.452
  128   2HG   ARG  17          HG1       ARG  17  -2.703  -3.708 -19.562
  129   1HD   ARG  17          HD2       ARG  17  -3.178  -5.897 -20.291
  130   2HD   ARG  17          HD1       ARG  17  -3.081  -4.925 -21.757
  131    HE   ARG  17           HE       ARG  17  -1.323  -6.214 -22.426
  132   1HH1  ARG  17          HH11      ARG  17  -1.753  -6.659 -19.022
  133   2HH1  ARG  17          HH12      ARG  17  -0.438  -7.795 -18.877
  134   1HH2  ARG  17          HH21      ARG  17   0.357  -7.706 -22.234
  135   2HH2  ARG  17          HH22      ARG  17   0.715  -8.385 -20.684
  136    H    ARG  18           HN       ARG  18   2.175  -3.524 -23.127
  137    HA   ARG  18           HA       ARG  18   1.633  -0.978 -24.385
  138   1HB   ARG  18          HB2       ARG  18   3.862  -2.980 -24.740
  139   2HB   ARG  18          HB1       ARG  18   3.746  -1.506 -25.689
  140   1HG   ARG  18          HG2       ARG  18   3.906  -1.583 -22.684
  141   2HG   ARG  18          HG1       ARG  18   5.287  -1.352 -23.756
  142   1HD   ARG  18          HD2       ARG  18   2.864   0.437 -23.771
  143   2HD   ARG  18          HD1       ARG  18   4.287   0.748 -22.778
  144    HE   ARG  18           HE       ARG  18   4.021   1.162 -25.600
  145   1HH1  ARG  18          HH11      ARG  18   6.280   0.656 -22.986
  146   2HH1  ARG  18          HH12      ARG  18   7.619   1.262 -23.918
  147   1HH2  ARG  18          HH21      ARG  18   5.774   1.947 -26.757
  148   2HH2  ARG  18          HH22      ARG  18   7.336   1.985 -26.023
  Start of MODEL    8
    1   1H    ILE   1          HT1       ILE   1   0.861   5.280   2.774
    2   2H    ILE   1          HT2       ILE   1  -0.019   4.306   3.843
    3   3H    ILE   1          HT3       ILE   1  -0.797   5.036   2.531
    4    HA   ILE   1           HA       ILE   1   0.155   2.512   2.587
    5    HB   ILE   1           HB       ILE   1  -1.522   3.277   1.034
    6   1HG1  ILE   1          HG12      ILE   1   0.902   2.318  -0.507
    7   2HG1  ILE   1          HG11      ILE   1  -0.209   1.285   0.386
    8   1HG2  ILE   1          HG21      ILE   1  -1.014   4.683  -0.893
    9   2HG2  ILE   1          HG22      ILE   1   0.654   4.842  -0.343
   10   3HG2  ILE   1          HG23      ILE   1  -0.660   5.516   0.620
   11   1HD1  ILE   1          HD11      ILE   1  -1.958   1.689  -1.130
   12   2HD1  ILE   1          HD12      ILE   1  -0.522   1.405  -2.115
   13   3HD1  ILE   1          HD13      ILE   1  -1.111   3.049  -1.866
   14    HA   PRO   2           HA       PRO   2   4.545   2.786   1.951
   15   1HB   PRO   2          HB2       PRO   2   4.996   0.193   1.241
   16   2HB   PRO   2          HB1       PRO   2   4.747   0.717   2.904
   17   1HG   PRO   2          HG2       PRO   2   2.830  -0.566   1.015
   18   2HG   PRO   2          HG1       PRO   2   3.036  -0.831   2.755
   19   1HD   PRO   2          HD2       PRO   2   1.040   0.691   1.704
   20   2HD   PRO   2          HD1       PRO   2   1.737   0.980   3.309
   21    H    GLU   3           HN       GLU   3   5.462   3.671   0.229
   22    HA   GLU   3           HA       GLU   3   4.487   3.614  -2.374
   23   1HB   GLU   3          HB2       GLU   3   7.324   4.171  -1.483
   24   2HB   GLU   3          HB1       GLU   3   6.609   4.657  -3.014
   25   1HG   GLU   3          HG2       GLU   3   5.027   6.087  -1.831
   26   2HG   GLU   3          HG1       GLU   3   5.725   5.590  -0.290
   27    H    SER   4           HN       SER   4   4.097   1.569  -3.099
   28    HA   SER   4           HA       SER   4   6.347   0.169  -4.272
   29   1HB   SER   4          HB2       SER   4   5.715  -2.025  -3.173
   30   2HB   SER   4          HB1       SER   4   6.489  -0.852  -2.109
   31    HG   SER   4           HG       SER   4   4.319  -0.246  -1.441
   32    H    SER   5           HN       SER   5   2.911  -0.237  -3.373
   33    HA   SER   5           HA       SER   5   2.230  -1.791  -5.647
   34   1HB   SER   5          HB2       SER   5   0.438  -0.053  -3.937
   35   2HB   SER   5          HB1       SER   5  -0.099  -1.321  -5.035
   36    HG   SER   5           HG       SER   5   0.607  -2.832  -3.672
   37    H    GLU   6           HN       GLU   6   2.197   1.638  -4.916
   38    HA   GLU   6           HA       GLU   6   0.829   2.600  -7.175
   39   1HB   GLU   6          HB2       GLU   6   3.119   3.997  -5.788
   40   2HB   GLU   6          HB1       GLU   6   1.762   4.732  -6.623
   41   1HG   GLU   6          HG2       GLU   6   1.056   5.031  -4.497
   42   2HG   GLU   6          HG1       GLU   6   0.397   3.419  -4.764
   43    H    LEU   7           HN       LEU   7   4.285   2.072  -6.616
   44    HA   LEU   7           HA       LEU   7   5.101   2.918  -9.209
   45   1HB   LEU   7          HB2       LEU   7   6.497   1.322  -7.068
   46   2HB   LEU   7          HB1       LEU   7   7.259   1.727  -8.592
   47    HG   LEU   7           HG       LEU   7   8.051   3.302  -7.026
   48   1HD1  LEU   7          HD11      LEU   7   7.821   4.713  -8.738
   49   2HD1  LEU   7          HD12      LEU   7   6.499   5.399  -7.795
   50   3HD1  LEU   7          HD13      LEU   7   6.160   4.215  -9.057
   51   1HD2  LEU   7          HD21      LEU   7   6.586   3.076  -5.197
   52   2HD2  LEU   7          HD22      LEU   7   5.190   3.579  -6.152
   53   3HD2  LEU   7          HD23      LEU   7   6.436   4.752  -5.726
   54    H    THR   8           HN       THR   8   4.463  -0.275  -7.765
   55    HA   THR   8           HA       THR   8   5.336  -1.779  -9.992
   56    HB   THR   8           HB       THR   8   3.822  -3.603  -9.026
   57    HG1  THR   8           HG1      THR   8   3.737  -1.920  -6.749
   58   1HG2  THR   8          HG21      THR   8   5.885  -4.093  -8.302
   59   2HG2  THR   8          HG22      THR   8   5.383  -3.361  -6.778
   60   3HG2  THR   8          HG23      THR   8   6.262  -2.402  -7.969
   61    H    LEU   9           HN       LEU   9   2.078  -0.534  -9.171
   62    HA   LEU   9           HA       LEU   9   0.792  -1.855 -11.321
   63   1HB   LEU   9          HB2       LEU   9  -1.084  -0.376 -10.974
   64   2HB   LEU   9          HB1       LEU   9  -0.469  -0.944  -9.440
   65    HG   LEU   9           HG       LEU   9   0.798   1.370  -9.441
   66   1HD1  LEU   9          HD11      LEU   9  -0.056   3.072 -10.696
   67   2HD1  LEU   9          HD12      LEU   9  -1.640   2.312 -10.854
   68   3HD1  LEU   9          HD13      LEU   9  -0.284   1.738 -11.827
   69   1HD2  LEU   9          HD21      LEU   9  -2.087   1.705  -8.918
   70   2HD2  LEU   9          HD22      LEU   9  -0.698   2.002  -7.872
   71   3HD2  LEU   9          HD23      LEU   9  -1.292   0.358  -8.105
   72    H    GLN  10           HN       GLN  10   2.506   1.204 -11.130
   73    HA   GLN  10           HA       GLN  10   1.705   2.237 -13.641
   74   1HB   GLN  10          HB2       GLN  10   2.745   3.625 -11.889
   75   2HB   GLN  10          HB1       GLN  10   4.261   2.761 -12.111
   76   1HG   GLN  10          HG2       GLN  10   4.451   3.596 -14.368
   77   2HG   GLN  10          HG1       GLN  10   2.879   4.383 -14.236
   78   1HE2  GLN  10          HE21      GLN  10   3.029   6.473 -13.946
   79   2HE2  GLN  10          HE22      GLN  10   4.268   7.297 -13.074
   80    H    GLU  11           HN       GLU  11   4.395   0.159 -12.657
   81    HA   GLU  11           HA       GLU  11   5.718   0.111 -15.162
   82   1HB   GLU  11          HB2       GLU  11   6.869  -0.622 -13.163
   83   2HB   GLU  11          HB1       GLU  11   5.673  -1.877 -12.881
   84   1HG   GLU  11          HG2       GLU  11   7.634  -2.910 -13.731
   85   2HG   GLU  11          HG1       GLU  11   6.408  -2.965 -14.993
   86    H    LEU  12           HN       LEU  12   3.307  -2.030 -13.689
   87    HA   LEU  12           HA       LEU  12   3.122  -3.839 -15.853
   88   1HB   LEU  12          HB2       LEU  12   1.063  -3.137 -13.758
   89   2HB   LEU  12          HB1       LEU  12   0.986  -4.525 -14.826
   90    HG   LEU  12           HG       LEU  12   3.128  -4.054 -12.752
   91   1HD1  LEU  12          HD11      LEU  12   1.255  -6.320 -12.532
   92   2HD1  LEU  12          HD12      LEU  12   0.582  -4.723 -12.207
   93   3HD1  LEU  12          HD13      LEU  12   1.964  -5.302 -11.277
   94   1HD2  LEU  12          HD21      LEU  12   2.633  -6.233 -14.752
   95   2HD2  LEU  12          HD22      LEU  12   3.515  -6.544 -13.257
   96   3HD2  LEU  12          HD23      LEU  12   4.125  -5.357 -14.409
   97    H    LEU  13           HN       LEU  13   0.916  -1.175 -14.898
   98    HA   LEU  13           HA       LEU  13  -0.321  -1.293 -17.535
   99   1HB   LEU  13          HB2       LEU  13  -0.961   0.280 -15.052
  100   2HB   LEU  13          HB1       LEU  13  -1.775   0.562 -16.579
  101    HG   LEU  13           HG       LEU  13  -2.316  -1.971 -16.492
  102   1HD1  LEU  13          HD11      LEU  13  -1.272  -2.953 -14.750
  103   2HD1  LEU  13          HD12      LEU  13  -2.706  -2.408 -13.879
  104   3HD1  LEU  13          HD13      LEU  13  -1.216  -1.468 -13.800
  105   1HD2  LEU  13          HD21      LEU  13  -3.975  -0.196 -16.343
  106   2HD2  LEU  13          HD22      LEU  13  -3.646  -0.018 -14.620
  107   3HD2  LEU  13          HD23      LEU  13  -4.359  -1.510 -15.231
  108    H    GLY  14           HN       GLY  14   2.322  -0.556 -17.650
  109   1HA   GLY  14          HA2       GLY  14   2.071   2.141 -18.777
  110   2HA   GLY  14          HA1       GLY  14   3.339   1.866 -17.592
  111    H    GLU  15           HN       GLU  15   4.432  -0.490 -18.220
  112    HA   GLU  15           HA       GLU  15   5.391  -0.044 -20.969
  113   1HB   GLU  15          HB2       GLU  15   7.040   0.068 -19.049
  114   2HB   GLU  15          HB1       GLU  15   6.771  -1.655 -18.819
  115   1HG   GLU  15          HG2       GLU  15   8.784  -1.225 -20.121
  116   2HG   GLU  15          HG1       GLU  15   7.579  -2.104 -21.064
  117    H    GLU  16           HN       GLU  16   4.518  -2.641 -18.702
  118    HA   GLU  16           HA       GLU  16   4.604  -4.730 -20.622
  119   1HB   GLU  16          HB2       GLU  16   4.785  -5.256 -18.288
  120   2HB   GLU  16          HB1       GLU  16   3.255  -4.474 -17.932
  121   1HG   GLU  16          HG2       GLU  16   3.023  -6.871 -17.849
  122   2HG   GLU  16          HG1       GLU  16   2.076  -6.211 -19.179
  123    H    ARG  17           HN       ARG  17   1.828  -3.049 -19.125
  124    HA   ARG  17           HA       ARG  17   0.109  -4.022 -21.293
  125   1HB   ARG  17          HB2       ARG  17  -0.518  -4.314 -18.867
  126   2HB   ARG  17          HB1       ARG  17  -0.709  -2.571 -18.777
  127   1HG   ARG  17          HG2       ARG  17  -2.464  -2.673 -20.474
  128   2HG   ARG  17          HG1       ARG  17  -2.272  -4.427 -20.561
  129   1HD   ARG  17          HD2       ARG  17  -3.154  -2.809 -18.175
  130   2HD   ARG  17          HD1       ARG  17  -4.144  -3.909 -19.137
  131    HE   ARG  17           HE       ARG  17  -1.988  -5.363 -18.159
  132   1HH1  ARG  17          HH11      ARG  17  -4.738  -3.689 -16.922
  133   2HH1  ARG  17          HH12      ARG  17  -4.880  -4.701 -15.529
  134   1HH2  ARG  17          HH21      ARG  17  -2.150  -6.667 -16.348
  135   2HH2  ARG  17          HH22      ARG  17  -3.409  -6.380 -15.201
  136    H    ARG  18           HN       ARG  18   1.630  -2.263 -22.465
  137    HA   ARG  18           HA       ARG  18   0.326   0.361 -22.295
  138   1HB   ARG  18          HB2       ARG  18   2.195   1.198 -23.655
  139   2HB   ARG  18          HB1       ARG  18   2.746   0.430 -22.174
  140   1HG   ARG  18          HG2       ARG  18   3.276  -1.605 -23.472
  141   2HG   ARG  18          HG1       ARG  18   2.819  -0.746 -24.946
  142   1HD   ARG  18          HD2       ARG  18   5.012   0.047 -23.032
  143   2HD   ARG  18          HD1       ARG  18   5.240  -0.713 -24.605
  144    HE   ARG  18           HE       ARG  18   3.811   1.558 -25.124
  145   1HH1  ARG  18          HH11      ARG  18   6.828   0.848 -23.551
  146   2HH1  ARG  18          HH12      ARG  18   7.537   2.365 -24.025
  147   1HH2  ARG  18          HH21      ARG  18   4.759   3.499 -25.743
  148   2HH2  ARG  18          HH22      ARG  18   6.380   3.845 -25.262
  Start of MODEL    9
    1   1H    ILE   1          HT1       ILE   1   4.678   3.570   2.386
    2   2H    ILE   1          HT2       ILE   1   4.764   5.016   1.513
    3   3H    ILE   1          HT3       ILE   1   6.135   4.035   1.660
    4    HA   ILE   1           HA       ILE   1   3.698   2.953   0.433
    5    HB   ILE   1           HB       ILE   1   4.537   3.644  -1.797
    6   1HG1  ILE   1          HG12      ILE   1   6.343   5.509  -0.236
    7   2HG1  ILE   1          HG11      ILE   1   6.889   4.079  -1.105
    8   1HG2  ILE   1          HG21      ILE   1   2.899   5.120  -1.512
    9   2HG2  ILE   1          HG22      ILE   1   4.131   6.282  -1.016
   10   3HG2  ILE   1          HG23      ILE   1   3.287   5.319   0.197
   11   1HD1  ILE   1          HD11      ILE   1   6.713   5.076  -3.126
   12   2HD1  ILE   1          HD12      ILE   1   6.972   6.519  -2.145
   13   3HD1  ILE   1          HD13      ILE   1   5.340   6.072  -2.643
   14    HA   PRO   2           HA       PRO   2   6.367  -0.572   0.215
   15   1HB   PRO   2          HB2       PRO   2   4.791  -1.464  -2.102
   16   2HB   PRO   2          HB1       PRO   2   4.963  -2.207  -0.510
   17   1HG   PRO   2          HG2       PRO   2   2.678  -1.018  -1.279
   18   2HG   PRO   2          HG1       PRO   2   3.242  -0.970   0.402
   19   1HD   PRO   2          HD2       PRO   2   3.416   1.141  -1.718
   20   2HD   PRO   2          HD1       PRO   2   3.018   1.305   0.006
   21    H    GLU   3           HN       GLU   3   8.357  -0.553  -0.619
   22    HA   GLU   3           HA       GLU   3   9.000   0.741  -3.084
   23   1HB   GLU   3          HB2       GLU   3  10.703  -0.989  -1.282
   24   2HB   GLU   3          HB1       GLU   3  11.308   0.003  -2.602
   25   1HG   GLU   3          HG2       GLU   3  10.579   2.013  -1.470
   26   2HG   GLU   3          HG1       GLU   3   9.864   1.052  -0.177
   27    H    SER   4           HN       SER   4   7.227  -1.039  -3.901
   28    HA   SER   4           HA       SER   4   8.591  -2.555  -5.872
   29   1HB   SER   4          HB2       SER   4   7.852  -4.828  -5.159
   30   2HB   SER   4          HB1       SER   4   9.040  -4.123  -4.063
   31    HG   SER   4           HG       SER   4   7.327  -5.039  -2.896
   32    H    SER   5           HN       SER   5   5.594  -2.598  -3.951
   33    HA   SER   5           HA       SER   5   3.852  -3.391  -6.001
   34   1HB   SER   5          HB2       SER   5   3.176  -1.600  -3.666
   35   2HB   SER   5          HB1       SER   5   2.057  -2.607  -4.582
   36    HG   SER   5           HG       SER   5   2.672  -4.296  -3.476
   37    H    GLU   6           HN       GLU   6   4.801  -0.153  -4.912
   38    HA   GLU   6           HA       GLU   6   3.104   1.350  -6.559
   39   1HB   GLU   6          HB2       GLU   6   5.906   2.082  -5.685
   40   2HB   GLU   6          HB1       GLU   6   4.645   3.195  -6.189
   41   1HG   GLU   6          HG2       GLU   6   4.535   1.439  -3.749
   42   2HG   GLU   6          HG1       GLU   6   4.974   3.145  -3.757
   43    H    LEU   7           HN       LEU   7   6.373   0.130  -7.099
   44    HA   LEU   7           HA       LEU   7   6.792   1.256  -9.642
   45   1HB   LEU   7          HB2       LEU   7   8.404   0.062  -7.939
   46   2HB   LEU   7          HB1       LEU   7   7.994  -1.371  -8.857
   47    HG   LEU   7           HG       LEU   7  10.130  -0.285  -9.544
   48   1HD1  LEU   7          HD11      LEU   7   8.360  -0.024 -11.905
   49   2HD1  LEU   7          HD12      LEU   7   8.410  -1.583 -11.083
   50   3HD1  LEU   7          HD13      LEU   7   9.893  -0.875 -11.722
   51   1HD2  LEU   7          HD21      LEU   7   9.073   1.784 -11.174
   52   2HD2  LEU   7          HD22      LEU   7  10.243   1.901  -9.860
   53   3HD2  LEU   7          HD23      LEU   7   8.518   2.041  -9.519
   54    H    THR   8           HN       THR   8   5.568  -1.986  -8.683
   55    HA   THR   8           HA       THR   8   5.249  -2.886 -11.361
   56    HB   THR   8           HB       THR   8   3.807  -4.657 -10.439
   57    HG1  THR   8           HG1      THR   8   3.059  -4.581  -8.424
   58   1HG2  THR   8          HG21      THR   8   6.278  -4.846 -10.371
   59   2HG2  THR   8          HG22      THR   8   5.479  -5.744  -9.080
   60   3HG2  THR   8          HG23      THR   8   6.250  -4.196  -8.731
   61    H    LEU   9           HN       LEU   9   2.930  -1.512  -9.028
   62    HA   LEU   9           HA       LEU   9   0.639  -1.608 -10.632
   63   1HB   LEU   9          HB2       LEU   9   0.520  -1.099  -8.274
   64   2HB   LEU   9          HB1       LEU   9   1.445   0.373  -8.504
   65    HG   LEU   9           HG       LEU   9  -0.445   1.242  -9.913
   66   1HD1  LEU   9          HD11      LEU   9  -1.808  -1.225  -8.851
   67   2HD1  LEU   9          HD12      LEU   9  -1.519  -0.805 -10.540
   68   3HD1  LEU   9          HD13      LEU   9  -2.648   0.147  -9.575
   69   1HD2  LEU   9          HD21      LEU   9  -0.930   0.554  -7.023
   70   2HD2  LEU   9          HD22      LEU   9  -1.916   1.689  -7.945
   71   3HD2  LEU   9          HD23      LEU   9  -0.205   2.024  -7.675
   72    H    GLN  10           HN       GLN  10   3.087   0.961 -10.313
   73    HA   GLN  10           HA       GLN  10   1.914   2.857 -11.994
   74   1HB   GLN  10          HB2       GLN  10   3.807   3.425 -10.611
   75   2HB   GLN  10          HB1       GLN  10   4.827   2.271 -11.457
   76   1HG   GLN  10          HG2       GLN  10   4.639   3.608 -13.498
   77   2HG   GLN  10          HG1       GLN  10   3.626   4.766 -12.639
   78   1HE2  GLN  10          HE21      GLN  10   6.683   4.149 -13.656
   79   2HE2  GLN  10          HE22      GLN  10   7.556   5.169 -12.570
   80    H    GLU  11           HN       GLU  11   3.992   0.093 -12.792
   81    HA   GLU  11           HA       GLU  11   4.161   0.760 -15.574
   82   1HB   GLU  11          HB2       GLU  11   5.878  -0.617 -14.478
   83   2HB   GLU  11          HB1       GLU  11   4.685  -1.878 -14.192
   84   1HG   GLU  11          HG2       GLU  11   4.402  -2.158 -16.602
   85   2HG   GLU  11          HG1       GLU  11   5.595  -0.896 -16.888
   86    H    LEU  12           HN       LEU  12   2.221  -1.558 -13.691
   87    HA   LEU  12           HA       LEU  12   0.873  -2.748 -15.846
   88   1HB   LEU  12          HB2       LEU  12  -0.214  -2.260 -13.072
   89   2HB   LEU  12          HB1       LEU  12  -0.800  -3.445 -14.220
   90    HG   LEU  12           HG       LEU  12   1.900  -3.475 -12.870
   91   1HD1  LEU  12          HD11      LEU  12   0.967  -4.658 -11.246
   92   2HD1  LEU  12          HD12      LEU  12   0.237  -5.765 -12.408
   93   3HD1  LEU  12          HD13      LEU  12  -0.612  -4.292 -11.941
   94   1HD2  LEU  12          HD21      LEU  12   1.019  -5.903 -14.203
   95   2HD2  LEU  12          HD22      LEU  12   2.575  -5.074 -14.268
   96   3HD2  LEU  12          HD23      LEU  12   1.256  -4.558 -15.319
   97    H    LEU  13           HN       LEU  13  -0.198  -0.056 -13.752
   98    HA   LEU  13           HA       LEU  13  -2.306   0.558 -15.700
   99   1HB   LEU  13          HB2       LEU  13  -2.786   0.340 -13.226
  100   2HB   LEU  13          HB1       LEU  13  -1.872   1.818 -12.996
  101    HG   LEU  13           HG       LEU  13  -3.479   3.027 -14.424
  102   1HD1  LEU  13          HD11      LEU  13  -5.623   1.140 -14.374
  103   2HD1  LEU  13          HD12      LEU  13  -4.237   0.429 -15.201
  104   3HD1  LEU  13          HD13      LEU  13  -4.900   1.967 -15.754
  105   1HD2  LEU  13          HD21      LEU  13  -5.344   1.818 -12.544
  106   2HD2  LEU  13          HD22      LEU  13  -4.730   3.469 -12.629
  107   3HD2  LEU  13          HD23      LEU  13  -3.789   2.219 -11.815
  108    H    GLY  14           HN       GLY  14   0.122   1.122 -16.734
  109   1HA   GLY  14          HA2       GLY  14  -0.063   3.951 -17.195
  110   2HA   GLY  14          HA1       GLY  14   1.366   3.522 -16.270
  111    H    GLU  15           HN       GLU  15   2.049   1.110 -17.476
  112    HA   GLU  15           HA       GLU  15   2.822   2.035 -20.164
  113   1HB   GLU  15          HB2       GLU  15   4.733   1.736 -18.734
  114   2HB   GLU  15          HB1       GLU  15   4.175   0.148 -18.232
  115   1HG   GLU  15          HG2       GLU  15   6.029  -0.015 -19.793
  116   2HG   GLU  15          HG1       GLU  15   4.561  -0.718 -20.469
  117    H    GLU  16           HN       GLU  16   1.917  -0.903 -18.361
  118    HA   GLU  16           HA       GLU  16   1.697  -2.571 -20.627
  119   1HB   GLU  16          HB2       GLU  16   1.956  -3.333 -18.269
  120   2HB   GLU  16          HB1       GLU  16   0.286  -2.876 -17.975
  121   1HG   GLU  16          HG2       GLU  16  -0.497  -4.525 -19.536
  122   2HG   GLU  16          HG1       GLU  16   1.155  -4.912 -20.013
  123    H    ARG  17           HN       ARG  17  -0.785  -0.663 -18.909
  124    HA   ARG  17           HA       ARG  17  -2.728  -1.471 -20.962
  125   1HB   ARG  17          HB2       ARG  17  -3.084  -0.279 -18.223
  126   2HB   ARG  17          HB1       ARG  17  -4.406  -0.431 -19.374
  127   1HG   ARG  17          HG2       ARG  17  -4.398  -2.738 -19.278
  128   2HG   ARG  17          HG1       ARG  17  -2.747  -2.806 -18.661
  129   1HD   ARG  17          HD2       ARG  17  -3.639  -1.682 -16.567
  130   2HD   ARG  17          HD1       ARG  17  -5.254  -2.025 -17.193
  131    HE   ARG  17           HE       ARG  17  -4.974  -4.142 -16.415
  132   1HH1  ARG  17          HH11      ARG  17  -1.836  -2.819 -17.035
  133   2HH1  ARG  17          HH12      ARG  17  -1.009  -4.331 -16.737
  134   1HH2  ARG  17          HH21      ARG  17  -3.868  -6.065 -15.936
  135   2HH2  ARG  17          HH22      ARG  17  -2.144  -6.106 -16.079
  136    H    ARG  18           HN       ARG  18  -1.740   1.508 -19.257
  137    HA   ARG  18           HA       ARG  18  -1.666   3.684 -19.891
  138   1HB   ARG  18          HB2       ARG  18  -1.867   2.446 -22.622
  139   2HB   ARG  18          HB1       ARG  18  -1.941   4.191 -22.418
  140   1HG   ARG  18          HG2       ARG  18   0.249   4.002 -21.169
  141   2HG   ARG  18          HG1       ARG  18   0.326   2.341 -21.757
  142   1HD   ARG  18          HD2       ARG  18   0.446   3.034 -24.009
  143   2HD   ARG  18          HD1       ARG  18  -0.057   4.678 -23.611
  144    HE   ARG  18           HE       ARG  18   2.120   5.178 -23.154
  145   1HH1  ARG  18          HH11      ARG  18   1.818   1.741 -23.267
  146   2HH1  ARG  18          HH12      ARG  18   3.490   1.452 -22.858
  147   1HH2  ARG  18          HH21      ARG  18   4.278   4.801 -22.603
  148   2HH2  ARG  18          HH22      ARG  18   4.846   3.167 -22.423
  Start of MODEL   10
    1   1H    ILE   1          HT1       ILE   1   7.052   5.968   2.370
    2   2H    ILE   1          HT2       ILE   1   8.380   5.641   1.375
    3   3H    ILE   1          HT3       ILE   1   7.903   4.516   2.547
    4    HA   ILE   1           HA       ILE   1   6.217   3.698   1.329
    5    HB   ILE   1           HB       ILE   1   5.962   6.359  -0.091
    6   1HG1  ILE   1          HG12      ILE   1   4.328   5.260   2.209
    7   2HG1  ILE   1          HG11      ILE   1   5.527   6.541   2.344
    8   1HG2  ILE   1          HG21      ILE   1   5.044   4.054  -1.021
    9   2HG2  ILE   1          HG22      ILE   1   4.123   5.551  -1.170
   10   3HG2  ILE   1          HG23      ILE   1   3.737   4.402   0.112
   11   1HD1  ILE   1          HD11      ILE   1   4.118   7.810   0.648
   12   2HD1  ILE   1          HD12      ILE   1   3.465   7.633   2.276
   13   3HD1  ILE   1          HD13      ILE   1   2.866   6.610   0.970
   14    HA   PRO   2           HA       PRO   2   9.020   2.528  -1.953
   15   1HB   PRO   2          HB2       PRO   2   7.008   0.583  -2.779
   16   2HB   PRO   2          HB1       PRO   2   8.597   0.305  -2.064
   17   1HG   PRO   2          HG2       PRO   2   6.290  -0.187  -0.733
   18   2HG   PRO   2          HG1       PRO   2   7.780   0.320   0.083
   19   1HD   PRO   2          HD2       PRO   2   5.376   1.949  -0.660
   20   2HD   PRO   2          HD1       PRO   2   6.339   1.978   0.834
   21    H    GLU   3           HN       GLU   3   7.862   4.802  -2.684
   22    HA   GLU   3           HA       GLU   3   5.936   4.992  -4.605
   23   1HB   GLU   3          HB2       GLU   3   8.536   6.515  -4.682
   24   2HB   GLU   3          HB1       GLU   3   6.993   7.031  -5.347
   25   1HG   GLU   3          HG2       GLU   3   7.478   6.558  -2.418
   26   2HG   GLU   3          HG1       GLU   3   7.650   8.124  -3.204
   27    H    SER   4           HN       SER   4   9.370   4.472  -5.278
   28    HA   SER   4           HA       SER   4   9.261   4.327  -8.046
   29   1HB   SER   4          HB2       SER   4  11.365   2.981  -7.867
   30   2HB   SER   4          HB1       SER   4  11.382   4.462  -6.911
   31    HG   SER   4           HG       SER   4  11.517   1.851  -6.100
   32    H    SER   5           HN       SER   5   8.838   1.701  -5.695
   33    HA   SER   5           HA       SER   5   8.541  -0.318  -7.700
   34   1HB   SER   5          HB2       SER   5   7.747  -0.374  -4.792
   35   2HB   SER   5          HB1       SER   5   7.864  -1.770  -5.860
   36    HG   SER   5           HG       SER   5   9.908  -1.831  -5.413
   37    H    GLU   6           HN       GLU   6   6.229   1.371  -5.559
   38    HA   GLU   6           HA       GLU   6   3.934   0.037  -6.482
   39   1HB   GLU   6          HB2       GLU   6   4.210   2.814  -5.325
   40   2HB   GLU   6          HB1       GLU   6   2.679   1.983  -5.565
   41   1HG   GLU   6          HG2       GLU   6   3.440   0.200  -4.044
   42   2HG   GLU   6          HG1       GLU   6   4.926   1.104  -3.765
   43    H    LEU   7           HN       LEU   7   5.444   3.062  -7.592
   44    HA   LEU   7           HA       LEU   7   3.482   3.667  -9.532
   45   1HB   LEU   7          HB2       LEU   7   6.383   4.456  -9.334
   46   2HB   LEU   7          HB1       LEU   7   5.302   5.069 -10.571
   47    HG   LEU   7           HG       LEU   7   4.967   5.466  -7.595
   48   1HD1  LEU   7          HD11      LEU   7   5.223   7.919  -8.858
   49   2HD1  LEU   7          HD12      LEU   7   6.449   6.906  -9.619
   50   3HD1  LEU   7          HD13      LEU   7   6.437   7.110  -7.867
   51   1HD2  LEU   7          HD21      LEU   7   3.065   5.576  -9.677
   52   2HD2  LEU   7          HD22      LEU   7   3.423   7.239  -9.212
   53   3HD2  LEU   7          HD23      LEU   7   2.875   6.083  -7.998
   54    H    THR   8           HN       THR   8   6.572   1.848  -9.793
   55    HA   THR   8           HA       THR   8   6.296   1.446 -12.599
   56    HB   THR   8           HB       THR   8   7.920  -0.466 -12.269
   57    HG1  THR   8           HG1      THR   8   8.411   0.543  -9.694
   58   1HG2  THR   8          HG21      THR   8   9.336   1.720 -11.000
   59   2HG2  THR   8          HG22      THR   8   8.301   2.278 -12.314
   60   3HG2  THR   8          HG23      THR   8   9.524   1.044 -12.618
   61    H    LEU   9           HN       LEU   9   5.319  -0.462  -9.778
   62    HA   LEU   9           HA       LEU   9   4.418  -2.749 -11.150
   63   1HB   LEU   9          HB2       LEU   9   4.647  -2.790  -8.760
   64   2HB   LEU   9          HB1       LEU   9   3.502  -1.476  -8.573
   65    HG   LEU   9           HG       LEU   9   1.730  -2.996  -9.493
   66   1HD1  LEU   9          HD11      LEU   9   3.215  -5.407  -8.807
   67   2HD1  LEU   9          HD12      LEU   9   3.841  -4.579 -10.233
   68   3HD1  LEU   9          HD13      LEU   9   2.151  -5.078 -10.174
   69   1HD2  LEU   9          HD21      LEU   9   1.806  -2.611  -7.145
   70   2HD2  LEU   9          HD22      LEU   9   3.158  -3.726  -6.944
   71   3HD2  LEU   9          HD23      LEU   9   1.565  -4.341  -7.387
   72    H    GLN  10           HN       GLN  10   2.739   0.236 -10.220
   73    HA   GLN  10           HA       GLN  10   0.190  -0.395 -11.230
   74   1HB   GLN  10          HB2       GLN  10   0.667   1.498  -9.715
   75   2HB   GLN  10          HB1       GLN  10   1.541   2.305 -11.008
   76   1HG   GLN  10          HG2       GLN  10  -0.594   2.289 -12.325
   77   2HG   GLN  10          HG1       GLN  10  -1.403   1.724 -10.864
   78   1HE2  GLN  10          HE21      GLN  10  -2.188   3.225  -9.563
   79   2HE2  GLN  10          HE22      GLN  10  -1.732   4.888  -9.544
   80    H    GLU  11           HN       GLU  11   2.969   1.232 -12.708
   81    HA   GLU  11           HA       GLU  11   1.789   1.819 -15.196
   82   1HB   GLU  11          HB2       GLU  11   4.650   1.436 -14.339
   83   2HB   GLU  11          HB1       GLU  11   4.217   1.872 -15.985
   84   1HG   GLU  11          HG2       GLU  11   3.293   3.937 -15.294
   85   2HG   GLU  11          HG1       GLU  11   3.355   3.471 -13.594
   86    H    LEU  12           HN       LEU  12   3.823  -0.951 -14.194
   87    HA   LEU  12           HA       LEU  12   3.800  -2.279 -16.679
   88   1HB   LEU  12          HB2       LEU  12   3.983  -3.450 -13.901
   89   2HB   LEU  12          HB1       LEU  12   4.350  -4.314 -15.382
   90    HG   LEU  12           HG       LEU  12   5.837  -1.903 -14.345
   91   1HD1  LEU  12          HD11      LEU  12   7.500  -3.319 -13.593
   92   2HD1  LEU  12          HD12      LEU  12   6.964  -4.658 -14.608
   93   3HD1  LEU  12          HD13      LEU  12   6.038  -4.211 -13.175
   94   1HD2  LEU  12          HD21      LEU  12   6.851  -3.660 -16.522
   95   2HD2  LEU  12          HD22      LEU  12   7.162  -1.952 -16.210
   96   3HD2  LEU  12          HD23      LEU  12   5.626  -2.454 -16.917
   97    H    LEU  13           HN       LEU  13   1.692  -2.668 -13.839
   98    HA   LEU  13           HA       LEU  13   0.050  -4.706 -14.822
   99   1HB   LEU  13          HB2       LEU  13   0.084  -3.908 -12.487
  100   2HB   LEU  13          HB1       LEU  13  -0.701  -2.425 -12.991
  101    HG   LEU  13           HG       LEU  13  -2.648  -3.839 -13.761
  102   1HD1  LEU  13          HD11      LEU  13  -1.234  -5.958 -12.150
  103   2HD1  LEU  13          HD12      LEU  13  -1.452  -5.971 -13.900
  104   3HD1  LEU  13          HD13      LEU  13  -2.854  -6.075 -12.836
  105   1HD2  LEU  13          HD21      LEU  13  -1.809  -3.187 -11.045
  106   2HD2  LEU  13          HD22      LEU  13  -3.019  -4.467 -11.120
  107   3HD2  LEU  13          HD23      LEU  13  -3.347  -2.900 -11.859
  108    H    GLY  14           HN       GLY  14  -0.318  -1.190 -15.085
  109   1HA   GLY  14          HA2       GLY  14  -2.771  -1.284 -16.530
  110   2HA   GLY  14          HA1       GLY  14  -1.738   0.119 -16.325
  111    H    GLU  15           HN       GLU  15   0.614  -0.790 -17.562
  112    HA   GLU  15           HA       GLU  15  -0.013  -0.295 -20.275
  113   1HB   GLU  15          HB2       GLU  15   2.182   0.136 -18.985
  114   2HB   GLU  15          HB1       GLU  15   2.571  -1.534 -19.367
  115   1HG   GLU  15          HG2       GLU  15   3.546   0.141 -20.925
  116   2HG   GLU  15          HG1       GLU  15   2.552  -1.088 -21.705
  117    H    GLU  16           HN       GLU  16   0.763  -3.286 -18.539
  118    HA   GLU  16           HA       GLU  16   0.782  -4.927 -20.877
  119   1HB   GLU  16          HB2       GLU  16   0.457  -5.631 -17.956
  120   2HB   GLU  16          HB1       GLU  16   0.611  -6.817 -19.242
  121   1HG   GLU  16          HG2       GLU  16   2.835  -6.093 -19.735
  122   2HG   GLU  16          HG1       GLU  16   2.685  -4.728 -18.628
  123    H    ARG  17           HN       ARG  17  -1.661  -4.171 -18.396
  124    HA   ARG  17           HA       ARG  17  -3.630  -5.603 -20.062
  125   1HB   ARG  17          HB2       ARG  17  -3.450  -5.150 -17.110
  126   2HB   ARG  17          HB1       ARG  17  -5.007  -5.481 -17.860
  127   1HG   ARG  17          HG2       ARG  17  -4.458  -7.633 -18.389
  128   2HG   ARG  17          HG1       ARG  17  -2.732  -7.282 -18.499
  129   1HD   ARG  17          HD2       ARG  17  -4.301  -7.343 -15.925
  130   2HD   ARG  17          HD1       ARG  17  -3.358  -8.696 -16.549
  131    HE   ARG  17           HE       ARG  17  -2.362  -6.435 -15.162
  132   1HH1  ARG  17          HH11      ARG  17  -1.538  -8.682 -17.669
  133   2HH1  ARG  17          HH12      ARG  17   0.164  -8.402 -17.510
  134   1HH2  ARG  17          HH21      ARG  17  -0.136  -6.101 -14.983
  135   2HH2  ARG  17          HH22      ARG  17   0.951  -6.958 -16.047
  136    H    ARG  18           HN       ARG  18  -3.291  -3.371 -21.225
  137    HA   ARG  18           HA       ARG  18  -4.579  -1.056 -20.260
  138   1HB   ARG  18          HB2       ARG  18  -3.974  -2.030 -23.048
  139   2HB   ARG  18          HB1       ARG  18  -4.752  -0.484 -22.746
  140   1HG   ARG  18          HG2       ARG  18  -2.083  -1.248 -21.589
  141   2HG   ARG  18          HG1       ARG  18  -2.281  -0.390 -23.119
  142   1HD   ARG  18          HD2       ARG  18  -3.502   1.390 -21.927
  143   2HD   ARG  18          HD1       ARG  18  -3.222   0.542 -20.408
  144    HE   ARG  18           HE       ARG  18  -0.732   0.959 -21.653
  145   1HH1  ARG  18          HH11      ARG  18  -3.307   2.810 -20.242
  146   2HH1  ARG  18          HH12      ARG  18  -2.264   4.075 -19.700
  147   1HH2  ARG  18          HH21      ARG  18   0.629   2.615 -20.978
  148   2HH2  ARG  18          HH22      ARG  18  -0.044   3.960 -20.103
  Start of MODEL   11
    1   1H    ILE   1          HT1       ILE   1   1.926   9.019  -2.182
    2   2H    ILE   1          HT2       ILE   1   0.329   8.513  -1.945
    3   3H    ILE   1          HT3       ILE   1   1.322   7.693  -3.046
    4    HA   ILE   1           HA       ILE   1   1.956   7.873  -0.167
    5    HB   ILE   1           HB       ILE   1  -0.235   6.820  -0.377
    6   1HG1  ILE   1          HG12      ILE   1   1.855   4.691   0.116
    7   2HG1  ILE   1          HG11      ILE   1   1.440   5.951   1.274
    8   1HG2  ILE   1          HG21      ILE   1   0.321   4.387  -1.682
    9   2HG2  ILE   1          HG22      ILE   1   0.893   5.682  -2.734
   10   3HG2  ILE   1          HG23      ILE   1  -0.783   5.668  -2.183
   11   1HD1  ILE   1          HD11      ILE   1  -1.000   4.854   0.663
   12   2HD1  ILE   1          HD12      ILE   1  -0.022   4.486   2.084
   13   3HD1  ILE   1          HD13      ILE   1   0.081   3.461   0.652
   14    HA   PRO   2           HA       PRO   2   5.781   6.218  -1.709
   15   1HB   PRO   2          HB2       PRO   2   6.844   5.356   0.632
   16   2HB   PRO   2          HB1       PRO   2   6.748   7.063   0.184
   17   1HG   PRO   2          HG2       PRO   2   4.937   5.467   1.960
   18   2HG   PRO   2          HG1       PRO   2   5.603   7.091   2.214
   19   1HD   PRO   2          HD2       PRO   2   3.082   6.693   1.340
   20   2HD   PRO   2          HD1       PRO   2   4.056   8.081   0.815
   21    H    GLU   3           HN       GLU   3   3.602   4.411  -2.104
   22    HA   GLU   3           HA       GLU   3   4.460   1.846  -1.041
   23   1HB   GLU   3          HB2       GLU   3   2.182   2.700  -2.807
   24   2HB   GLU   3          HB1       GLU   3   2.583   1.001  -2.592
   25   1HG   GLU   3          HG2       GLU   3   2.301   1.285  -0.155
   26   2HG   GLU   3          HG1       GLU   3   1.791   2.948  -0.441
   27    H    SER   4           HN       SER   4   6.541   1.727  -1.940
   28    HA   SER   4           HA       SER   4   7.317   2.023  -4.567
   29   1HB   SER   4          HB2       SER   4   9.136   0.384  -4.030
   30   2HB   SER   4          HB1       SER   4   8.950   1.665  -2.833
   31    HG   SER   4           HG       SER   4   9.038  -0.153  -1.644
   32    H    SER   5           HN       SER   5   5.891  -0.847  -3.058
   33    HA   SER   5           HA       SER   5   6.178  -2.593  -5.249
   34   1HB   SER   5          HB2       SER   5   5.604  -3.332  -2.984
   35   2HB   SER   5          HB1       SER   5   4.021  -2.580  -3.138
   36    HG   SER   5           HG       SER   5   4.277  -4.948  -3.631
   37    H    GLU   6           HN       GLU   6   3.480  -0.461  -4.313
   38    HA   GLU   6           HA       GLU   6   1.798  -1.143  -6.487
   39   1HB   GLU   6          HB2       GLU   6   1.135   0.091  -4.361
   40   2HB   GLU   6          HB1       GLU   6   1.878   1.520  -5.054
   41   1HG   GLU   6          HG2       GLU   6  -0.310   0.031  -6.469
   42   2HG   GLU   6          HG1       GLU   6  -0.649   1.267  -5.263
   43    H    LEU   7           HN       LEU   7   4.103   1.495  -5.938
   44    HA   LEU   7           HA       LEU   7   3.831   2.813  -8.383
   45   1HB   LEU   7          HB2       LEU   7   6.271   2.532  -6.630
   46   2HB   LEU   7          HB1       LEU   7   6.122   3.675  -7.952
   47    HG   LEU   7           HG       LEU   7   4.417   3.647  -5.459
   48   1HD1  LEU   7          HD11      LEU   7   7.015   4.589  -5.823
   49   2HD1  LEU   7          HD12      LEU   7   5.914   4.975  -4.501
   50   3HD1  LEU   7          HD13      LEU   7   5.985   6.018  -5.922
   51   1HD2  LEU   7          HD21      LEU   7   3.368   4.466  -7.636
   52   2HD2  LEU   7          HD22      LEU   7   4.525   5.796  -7.556
   53   3HD2  LEU   7          HD23      LEU   7   3.346   5.573  -6.263
   54    H    THR   8           HN       THR   8   5.997   0.087  -7.511
   55    HA   THR   8           HA       THR   8   7.247   0.042 -10.095
   56    HB   THR   8           HB       THR   8   7.954  -2.309  -9.412
   57    HG1  THR   8           HG1      THR   8   7.002  -1.514  -6.851
   58   1HG2  THR   8          HG21      THR   8   9.530  -1.439  -7.667
   59   2HG2  THR   8          HG22      THR   8   8.636   0.080  -7.705
   60   3HG2  THR   8          HG23      THR   8   9.477  -0.484  -9.149
   61    H    LEU   9           HN       LEU   9   4.611  -1.813  -8.608
   62    HA   LEU   9           HA       LEU   9   4.112  -3.557 -10.763
   63   1HB   LEU   9          HB2       LEU   9   3.132  -3.976  -8.610
   64   2HB   LEU   9          HB1       LEU   9   2.299  -2.433  -8.630
   65    HG   LEU   9           HG       LEU   9   0.995  -3.297 -10.622
   66   1HD1  LEU   9          HD11      LEU   9   1.242  -5.372 -11.414
   67   2HD1  LEU   9          HD12      LEU   9   1.471  -6.067  -9.809
   68   3HD1  LEU   9          HD13      LEU   9   2.825  -5.303 -10.640
   69   1HD2  LEU   9          HD21      LEU   9   0.078  -5.148  -8.679
   70   2HD2  LEU   9          HD22      LEU   9  -0.565  -3.554  -9.078
   71   3HD2  LEU   9          HD23      LEU   9   0.680  -3.718  -7.840
   72    H    GLN  10           HN       GLN  10   2.734  -0.397  -9.934
   73    HA   GLN  10           HA       GLN  10   0.891  -0.129 -12.003
   74   1HB   GLN  10          HB2       GLN  10   1.210   1.348  -9.980
   75   2HB   GLN  10          HB1       GLN  10   2.550   2.098 -10.830
   76   1HG   GLN  10          HG2       GLN  10   0.594   3.460 -11.064
   77   2HG   GLN  10          HG1       GLN  10   0.994   2.751 -12.630
   78   1HE2  GLN  10          HE21      GLN  10  -0.834   1.781  -9.728
   79   2HE2  GLN  10          HE22      GLN  10  -2.233   1.251 -10.619
   80    H    GLU  11           HN       GLU  11   4.337   0.735 -11.924
   81    HA   GLU  11           HA       GLU  11   4.474   1.915 -14.476
   82   1HB   GLU  11          HB2       GLU  11   6.232   2.110 -12.731
   83   2HB   GLU  11          HB1       GLU  11   6.653   0.425 -12.996
   84   1HG   GLU  11          HG2       GLU  11   7.381   0.898 -15.229
   85   2HG   GLU  11          HG1       GLU  11   6.795   2.557 -15.113
   86    H    LEU  12           HN       LEU  12   4.991  -1.424 -13.372
   87    HA   LEU  12           HA       LEU  12   5.662  -2.540 -15.876
   88   1HB   LEU  12          HB2       LEU  12   4.230  -3.833 -13.548
   89   2HB   LEU  12          HB1       LEU  12   4.967  -4.691 -14.888
   90    HG   LEU  12           HG       LEU  12   6.448  -3.000 -12.873
   91   1HD1  LEU  12          HD11      LEU  12   6.079  -4.826 -11.602
   92   2HD1  LEU  12          HD12      LEU  12   7.401  -5.494 -12.561
   93   3HD1  LEU  12          HD13      LEU  12   5.729  -5.856 -12.990
   94   1HD2  LEU  12          HD21      LEU  12   8.410  -3.483 -13.973
   95   2HD2  LEU  12          HD22      LEU  12   7.300  -3.292 -15.329
   96   3HD2  LEU  12          HD23      LEU  12   7.740  -4.906 -14.771
   97    H    LEU  13           HN       LEU  13   2.551  -2.105 -14.224
   98    HA   LEU  13           HA       LEU  13   0.919  -3.323 -16.187
   99   1HB   LEU  13          HB2       LEU  13   0.265  -1.122 -14.223
  100   2HB   LEU  13          HB1       LEU  13  -0.923  -1.998 -15.168
  101    HG   LEU  13           HG       LEU  13   0.894  -3.213 -13.085
  102   1HD1  LEU  13          HD11      LEU  13  -1.767  -3.540 -12.358
  103   2HD1  LEU  13          HD12      LEU  13  -1.656  -1.869 -12.914
  104   3HD1  LEU  13          HD13      LEU  13  -0.595  -2.443 -11.628
  105   1HD2  LEU  13          HD21      LEU  13  -0.833  -5.117 -13.402
  106   2HD2  LEU  13          HD22      LEU  13   0.484  -4.950 -14.564
  107   3HD2  LEU  13          HD23      LEU  13  -1.128  -4.361 -14.968
  108    H    GLY  14           HN       GLY  14   1.998   0.033 -15.748
  109   1HA   GLY  14          HA2       GLY  14   0.525   1.184 -17.869
  110   2HA   GLY  14          HA1       GLY  14   2.007   1.836 -17.181
  111    H    GLU  15           HN       GLU  15   3.793  -0.200 -17.739
  112    HA   GLU  15           HA       GLU  15   4.451   0.298 -20.460
  113   1HB   GLU  15          HB2       GLU  15   6.153  -0.220 -18.760
  114   2HB   GLU  15          HB1       GLU  15   5.479  -1.832 -18.565
  115   1HG   GLU  15          HG2       GLU  15   6.034  -2.286 -20.943
  116   2HG   GLU  15          HG1       GLU  15   6.840  -0.720 -21.006
  117    H    GLU  16           HN       GLU  16   2.832  -2.307 -18.771
  118    HA   GLU  16           HA       GLU  16   2.695  -4.152 -20.929
  119   1HB   GLU  16          HB2       GLU  16   2.420  -4.853 -18.613
  120   2HB   GLU  16          HB1       GLU  16   1.007  -3.826 -18.440
  121   1HG   GLU  16          HG2       GLU  16  -0.060  -5.237 -20.255
  122   2HG   GLU  16          HG1       GLU  16   1.284  -6.357 -20.022
  123    H    ARG  17           HN       ARG  17   0.328  -1.868 -19.547
  124    HA   ARG  17           HA       ARG  17  -1.467  -2.295 -21.801
  125   1HB   ARG  17          HB2       ARG  17  -1.726  -0.569 -19.339
  126   2HB   ARG  17          HB1       ARG  17  -2.971  -0.742 -20.568
  127   1HG   ARG  17          HG2       ARG  17  -3.054  -3.165 -20.088
  128   2HG   ARG  17          HG1       ARG  17  -1.888  -2.913 -18.787
  129   1HD   ARG  17          HD2       ARG  17  -4.180  -2.993 -17.935
  130   2HD   ARG  17          HD1       ARG  17  -3.442  -1.414 -17.663
  131    HE   ARG  17           HE       ARG  17  -4.851  -1.342 -20.083
  132   1HH1  ARG  17          HH11      ARG  17  -5.452  -1.578 -16.689
  133   2HH1  ARG  17          HH12      ARG  17  -7.002  -0.824 -16.788
  134   1HH2  ARG  17          HH21      ARG  17  -6.859  -0.353 -20.215
  135   2HH2  ARG  17          HH22      ARG  17  -7.797  -0.126 -18.785
  136    H    ARG  18           HN       ARG  18   0.647  -1.296 -22.977
  137    HA   ARG  18           HA       ARG  18   0.939   1.510 -23.022
  138   1HB   ARG  18          HB2       ARG  18   1.664  -0.664 -24.956
  139   2HB   ARG  18          HB1       ARG  18   1.897   1.026 -25.381
  140   1HG   ARG  18          HG2       ARG  18   3.075  -0.321 -22.964
  141   2HG   ARG  18          HG1       ARG  18   3.923  -0.036 -24.483
  142   1HD   ARG  18          HD2       ARG  18   2.656   2.216 -22.956
  143   2HD   ARG  18          HD1       ARG  18   4.265   1.629 -22.544
  144    HE   ARG  18           HE       ARG  18   5.086   2.556 -24.494
  145   1HH1  ARG  18          HH11      ARG  18   1.630   2.870 -24.442
  146   2HH1  ARG  18          HH12      ARG  18   1.596   3.912 -25.816
  147   1HH2  ARG  18          HH21      ARG  18   5.021   3.909 -26.272
  148   2HH2  ARG  18          HH22      ARG  18   3.501   4.497 -26.844
  Start of MODEL   12
    1   1H    ILE   1          HT1       ILE   1   9.454   5.024   1.309
    2   2H    ILE   1          HT2       ILE   1   9.182   4.615   2.928
    3   3H    ILE   1          HT3       ILE   1   9.188   6.240   2.457
    4    HA   ILE   1           HA       ILE   1   6.950   5.162   2.858
    5    HB   ILE   1           HB       ILE   1   7.177   7.325   1.801
    6   1HG1  ILE   1          HG12      ILE   1   5.231   7.202   0.160
    7   2HG1  ILE   1          HG11      ILE   1   5.242   5.462   0.432
    8   1HG2  ILE   1          HG21      ILE   1   8.471   7.509   0.014
    9   2HG2  ILE   1          HG22      ILE   1   7.103   6.924  -0.932
   10   3HG2  ILE   1          HG23      ILE   1   8.327   5.792  -0.360
   11   1HD1  ILE   1          HD11      ILE   1   4.105   7.561   2.029
   12   2HD1  ILE   1          HD12      ILE   1   5.236   6.594   2.975
   13   3HD1  ILE   1          HD13      ILE   1   3.889   5.815   2.145
   14    HA   PRO   2           HA       PRO   2   6.630   1.258   0.714
   15   1HB   PRO   2          HB2       PRO   2   4.176   0.564   1.606
   16   2HB   PRO   2          HB1       PRO   2   5.618   0.499   2.625
   17   1HG   PRO   2          HG2       PRO   2   3.491   2.602   2.484
   18   2HG   PRO   2          HG1       PRO   2   4.264   1.886   3.911
   19   1HD   PRO   2          HD2       PRO   2   4.980   4.303   2.903
   20   2HD   PRO   2          HD1       PRO   2   6.124   3.228   3.731
   21    H    GLU   3           HN       GLU   3   6.297   3.219  -1.131
   22    HA   GLU   3           HA       GLU   3   3.655   3.247  -2.267
   23   1HB   GLU   3          HB2       GLU   3   6.319   4.124  -3.391
   24   2HB   GLU   3          HB1       GLU   3   4.775   4.383  -4.190
   25   1HG   GLU   3          HG2       GLU   3   4.022   5.771  -2.361
   26   2HG   GLU   3          HG1       GLU   3   5.514   5.456  -1.478
   27    H    SER   4           HN       SER   4   4.183   0.632  -1.943
   28    HA   SER   4           HA       SER   4   5.336  -0.596  -4.267
   29   1HB   SER   4          HB2       SER   4   4.454  -2.709  -3.287
   30   2HB   SER   4          HB1       SER   4   5.408  -1.767  -2.142
   31    HG   SER   4           HG       SER   4   3.720  -1.721  -0.908
   32    H    SER   5           HN       SER   5   2.026  -0.024  -3.136
   33    HA   SER   5           HA       SER   5   0.729  -1.395  -5.236
   34   1HB   SER   5          HB2       SER   5  -1.212   0.203  -4.528
   35   2HB   SER   5          HB1       SER   5  -0.628  -1.033  -3.420
   36    HG   SER   5           HG       SER   5  -0.305   1.769  -3.322
   37    H    GLU   6           HN       GLU   6   1.571   2.015  -4.819
   38    HA   GLU   6           HA       GLU   6   0.360   2.981  -7.164
   39   1HB   GLU   6          HB2       GLU   6   2.784   4.000  -5.666
   40   2HB   GLU   6          HB1       GLU   6   1.966   4.885  -6.943
   41   1HG   GLU   6          HG2       GLU   6   1.243   5.732  -4.825
   42   2HG   GLU   6          HG1       GLU   6  -0.098   4.871  -5.576
   43    H    LEU   7           HN       LEU   7   3.540   1.633  -6.526
   44    HA   LEU   7           HA       LEU   7   4.582   2.064  -9.140
   45   1HB   LEU   7          HB2       LEU   7   5.929   1.705  -7.054
   46   2HB   LEU   7          HB1       LEU   7   5.458   0.022  -7.104
   47    HG   LEU   7           HG       LEU   7   6.579  -0.211  -9.297
   48   1HD1  LEU   7          HD11      LEU   7   6.725   2.670  -9.051
   49   2HD1  LEU   7          HD12      LEU   7   6.954   1.644 -10.467
   50   3HD1  LEU   7          HD13      LEU   7   8.304   1.955  -9.375
   51   1HD2  LEU   7          HD21      LEU   7   8.494   0.941  -7.290
   52   2HD2  LEU   7          HD22      LEU   7   8.758  -0.377  -8.432
   53   3HD2  LEU   7          HD23      LEU   7   7.692  -0.611  -7.046
   54    H    THR   8           HN       THR   8   3.240  -0.805  -7.472
   55    HA   THR   8           HA       THR   8   3.534  -2.549  -9.680
   56    HB   THR   8           HB       THR   8   1.707  -3.913  -8.543
   57    HG1  THR   8           HG1      THR   8   2.117  -2.144  -6.363
   58   1HG2  THR   8          HG21      THR   8   3.665  -4.819  -7.910
   59   2HG2  THR   8          HG22      THR   8   3.357  -4.007  -6.375
   60   3HG2  THR   8          HG23      THR   8   4.397  -3.249  -7.581
   61    H    LEU   9           HN       LEU   9   0.658  -0.721  -8.583
   62    HA   LEU   9           HA       LEU   9  -1.076  -1.606 -10.609
   63   1HB   LEU   9          HB2       LEU   9  -1.948  -0.465  -8.688
   64   2HB   LEU   9          HB1       LEU   9  -1.018   0.976  -9.056
   65    HG   LEU   9           HG       LEU   9  -2.364   1.213 -11.159
   66   1HD1  LEU   9          HD11      LEU   9  -4.264  -0.060 -11.568
   67   2HD1  LEU   9          HD12      LEU   9  -4.317  -0.692  -9.922
   68   3HD1  LEU   9          HD13      LEU   9  -3.078  -1.256 -11.044
   69   1HD2  LEU   9          HD21      LEU   9  -3.298   2.728  -9.820
   70   2HD2  LEU   9          HD22      LEU   9  -3.189   1.667  -8.416
   71   3HD2  LEU   9          HD23      LEU   9  -4.563   1.538  -9.513
   72    H    GLN  10           HN       GLN  10   1.042   1.247 -10.500
   73    HA   GLN  10           HA       GLN  10   0.292   2.288 -13.012
   74   1HB   GLN  10          HB2       GLN  10   1.455   3.602 -11.292
   75   2HB   GLN  10          HB1       GLN  10   2.892   2.615 -11.509
   76   1HG   GLN  10          HG2       GLN  10   3.069   3.407 -13.824
   77   2HG   GLN  10          HG1       GLN  10   1.651   4.423 -13.570
   78   1HE2  GLN  10          HE21      GLN  10   3.241   4.370 -10.711
   79   2HE2  GLN  10          HE22      GLN  10   4.216   5.783 -10.897
   80    H    GLU  11           HN       GLU  11   2.904   0.068 -12.051
   81    HA   GLU  11           HA       GLU  11   4.136  -0.040 -14.589
   82   1HB   GLU  11          HB2       GLU  11   5.166  -0.832 -12.444
   83   2HB   GLU  11          HB1       GLU  11   4.136  -2.257 -12.542
   84   1HG   GLU  11          HG2       GLU  11   6.399  -2.672 -13.394
   85   2HG   GLU  11          HG1       GLU  11   5.159  -2.904 -14.629
   86    H    LEU  12           HN       LEU  12   1.523  -1.977 -13.173
   87    HA   LEU  12           HA       LEU  12   1.323  -3.976 -15.104
   88   1HB   LEU  12          HB2       LEU  12  -0.933  -2.625 -13.620
   89   2HB   LEU  12          HB1       LEU  12  -1.045  -4.161 -14.460
   90    HG   LEU  12           HG       LEU  12   0.669  -3.581 -12.055
   91   1HD1  LEU  12          HD11      LEU  12  -1.937  -5.027 -12.420
   92   2HD1  LEU  12          HD12      LEU  12  -1.554  -3.710 -11.311
   93   3HD1  LEU  12          HD13      LEU  12  -0.885  -5.319 -11.035
   94   1HD2  LEU  12          HD21      LEU  12   1.629  -5.229 -13.671
   95   2HD2  LEU  12          HD22      LEU  12   0.196  -6.225 -13.420
   96   3HD2  LEU  12          HD23      LEU  12   1.283  -5.890 -12.073
   97    H    LEU  13           HN       LEU  13   0.268  -0.648 -15.203
   98    HA   LEU  13           HA       LEU  13  -0.685  -1.103 -17.959
   99   1HB   LEU  13          HB2       LEU  13  -1.846   1.221 -17.485
  100   2HB   LEU  13          HB1       LEU  13  -2.601  -0.294 -17.037
  101    HG   LEU  13           HG       LEU  13  -1.421   0.137 -14.730
  102   1HD1  LEU  13          HD11      LEU  13  -1.780   2.818 -14.547
  103   2HD1  LEU  13          HD12      LEU  13  -1.083   2.675 -16.161
  104   3HD1  LEU  13          HD13      LEU  13  -0.218   2.029 -14.766
  105   1HD2  LEU  13          HD21      LEU  13  -3.667   0.045 -14.504
  106   2HD2  LEU  13          HD22      LEU  13  -3.961   1.123 -15.868
  107   3HD2  LEU  13          HD23      LEU  13  -3.486   1.787 -14.305
  108    H    GLY  14           HN       GLY  14   2.031  -0.693 -17.122
  109   1HA   GLY  14          HA2       GLY  14   2.586   1.892 -18.454
  110   2HA   GLY  14          HA1       GLY  14   3.570   1.266 -17.140
  111    H    GLU  15           HN       GLU  15   5.230  -0.113 -17.585
  112    HA   GLU  15           HA       GLU  15   6.011  -0.400 -20.341
  113   1HB   GLU  15          HB2       GLU  15   7.684  -0.050 -18.589
  114   2HB   GLU  15          HB1       GLU  15   7.223  -1.560 -17.822
  115   1HG   GLU  15          HG2       GLU  15   9.266  -1.878 -19.026
  116   2HG   GLU  15          HG1       GLU  15   7.983  -2.775 -19.831
  117    H    GLU  16           HN       GLU  16   4.550  -2.469 -17.918
  118    HA   GLU  16           HA       GLU  16   4.899  -4.939 -19.235
  119   1HB   GLU  16          HB2       GLU  16   2.844  -4.003 -17.239
  120   2HB   GLU  16          HB1       GLU  16   2.915  -5.657 -17.829
  121   1HG   GLU  16          HG2       GLU  16   5.203  -4.261 -16.463
  122   2HG   GLU  16          HG1       GLU  16   4.026  -5.276 -15.633
  123    H    ARG  17           HN       ARG  17   2.709  -2.326 -19.894
  124    HA   ARG  17           HA       ARG  17   1.433  -3.996 -21.954
  125   1HB   ARG  17          HB2       ARG  17   0.067  -2.175 -19.988
  126   2HB   ARG  17          HB1       ARG  17  -0.694  -2.653 -21.499
  127   1HG   ARG  17          HG2       ARG  17  -0.612  -4.976 -20.854
  128   2HG   ARG  17          HG1       ARG  17   0.272  -4.565 -19.383
  129   1HD   ARG  17          HD2       ARG  17  -2.120  -4.950 -18.957
  130   2HD   ARG  17          HD1       ARG  17  -1.622  -3.310 -18.551
  131    HE   ARG  17           HE       ARG  17  -3.094  -2.542 -20.106
  132   1HH1  ARG  17          HH11      ARG  17  -2.426  -5.856 -20.805
  133   2HH1  ARG  17          HH12      ARG  17  -3.581  -5.946 -22.087
  134   1HH2  ARG  17          HH21      ARG  17  -4.598  -2.651 -21.763
  135   2HH2  ARG  17          HH22      ARG  17  -4.812  -4.131 -22.628
  136    H    ARG  18           HN       ARG  18   3.555  -2.337 -22.606
  137    HA   ARG  18           HA       ARG  18   2.228  -0.025 -23.846
  138   1HB   ARG  18          HB2       ARG  18   4.620   0.793 -24.257
  139   2HB   ARG  18          HB1       ARG  18   3.990   0.862 -22.624
  140   1HG   ARG  18          HG2       ARG  18   6.200   0.121 -22.420
  141   2HG   ARG  18          HG1       ARG  18   5.209  -1.319 -22.205
  142   1HD   ARG  18          HD2       ARG  18   6.222  -0.658 -24.930
  143   2HD   ARG  18          HD1       ARG  18   7.339  -1.341 -23.749
  144    HE   ARG  18           HE       ARG  18   4.991  -2.655 -24.922
  145   1HH1  ARG  18          HH11      ARG  18   7.742  -2.794 -22.759
  146   2HH1  ARG  18          HH12      ARG  18   7.654  -4.528 -22.625
  147   1HH2  ARG  18          HH21      ARG  18   4.902  -4.861 -24.692
  148   2HH2  ARG  18          HH22      ARG  18   6.058  -5.688 -23.708
  Start of MODEL   13
    1   1H    ILE   1          HT1       ILE   1   7.536   4.730   3.298
    2   2H    ILE   1          HT2       ILE   1   7.715   6.400   3.104
    3   3H    ILE   1          HT3       ILE   1   8.212   5.346   1.862
    4    HA   ILE   1           HA       ILE   1   5.398   5.479   2.802
    5    HB   ILE   1           HB       ILE   1   4.925   6.950   0.870
    6   1HG1  ILE   1          HG12      ILE   1   7.932   7.262   0.697
    7   2HG1  ILE   1          HG11      ILE   1   6.940   6.384  -0.461
    8   1HG2  ILE   1          HG21      ILE   1   6.508   8.905   1.985
    9   2HG2  ILE   1          HG22      ILE   1   6.375   7.709   3.275
   10   3HG2  ILE   1          HG23      ILE   1   4.918   8.402   2.561
   11   1HD1  ILE   1          HD11      ILE   1   5.870   8.378  -1.175
   12   2HD1  ILE   1          HD12      ILE   1   7.606   8.689  -1.150
   13   3HD1  ILE   1          HD13      ILE   1   6.581   9.304   0.146
   14    HA   PRO   2           HA       PRO   2   4.677   2.256  -0.155
   15   1HB   PRO   2          HB2       PRO   2   2.715   3.116  -1.839
   16   2HB   PRO   2          HB1       PRO   2   2.419   2.643  -0.163
   17   1HG   PRO   2          HG2       PRO   2   2.745   5.379  -1.331
   18   2HG   PRO   2          HG1       PRO   2   1.579   4.809  -0.124
   19   1HD   PRO   2          HD2       PRO   2   3.791   6.196   0.552
   20   2HD   PRO   2          HD1       PRO   2   3.099   4.941   1.598
   21    H    GLU   3           HN       GLU   3   6.932   3.600  -0.889
   22    HA   GLU   3           HA       GLU   3   7.105   4.664  -3.455
   23   1HB   GLU   3          HB2       GLU   3   9.141   3.049  -1.917
   24   2HB   GLU   3          HB1       GLU   3   9.500   4.024  -3.336
   25   1HG   GLU   3          HG2       GLU   3   9.645   5.880  -2.131
   26   2HG   GLU   3          HG1       GLU   3   8.110   5.564  -1.325
   27    H    SER   4           HN       SER   4   7.620   1.310  -2.459
   28    HA   SER   4           HA       SER   4   8.060   0.318  -5.085
   29   1HB   SER   4          HB2       SER   4   7.772  -1.922  -4.043
   30   2HB   SER   4          HB1       SER   4   8.900  -0.897  -3.157
   31    HG   SER   4           HG       SER   4   6.790  -2.109  -2.201
   32    H    SER   5           HN       SER   5   5.204   0.457  -3.009
   33    HA   SER   5           HA       SER   5   3.490  -1.063  -4.651
   34   1HB   SER   5          HB2       SER   5   2.986  -0.581  -2.313
   35   2HB   SER   5          HB1       SER   5   2.770   1.122  -2.705
   36    HG   SER   5           HG       SER   5   0.960   0.626  -3.872
   37    H    GLU   6           HN       GLU   6   4.098   2.446  -4.545
   38    HA   GLU   6           HA       GLU   6   2.069   3.287  -6.260
   39   1HB   GLU   6          HB2       GLU   6   3.801   4.661  -4.933
   40   2HB   GLU   6          HB1       GLU   6   4.841   4.457  -6.332
   41   1HG   GLU   6          HG2       GLU   6   3.764   6.570  -6.507
   42   2HG   GLU   6          HG1       GLU   6   3.076   5.503  -7.730
   43    H    LEU   7           HN       LEU   7   5.241   1.983  -6.972
   44    HA   LEU   7           HA       LEU   7   5.278   2.386  -9.757
   45   1HB   LEU   7          HB2       LEU   7   7.206   1.787  -8.261
   46   2HB   LEU   7          HB1       LEU   7   6.597   0.150  -8.233
   47    HG   LEU   7           HG       LEU   7   6.893   0.014 -10.687
   48   1HD1  LEU   7          HD11      LEU   7   8.281   1.745 -11.786
   49   2HD1  LEU   7          HD12      LEU   7   8.124   2.743 -10.341
   50   3HD1  LEU   7          HD13      LEU   7   6.694   2.334 -11.289
   51   1HD2  LEU   7          HD21      LEU   7   8.627  -0.856  -9.265
   52   2HD2  LEU   7          HD22      LEU   7   9.329   0.750  -9.072
   53   3HD2  LEU   7          HD23      LEU   7   9.369  -0.047 -10.645
   54    H    THR   8           HN       THR   8   4.208  -0.395  -7.800
   55    HA   THR   8           HA       THR   8   3.783  -2.274  -9.773
   56    HB   THR   8           HB       THR   8   2.152  -3.349  -8.381
   57    HG1  THR   8           HG1      THR   8   2.043  -0.924  -6.872
   58   1HG2  THR   8          HG21      THR   8   3.371  -3.492  -6.279
   59   2HG2  THR   8          HG22      THR   8   4.215  -1.989  -6.652
   60   3HG2  THR   8          HG23      THR   8   4.492  -3.424  -7.639
   61    H    LEU   9           HN       LEU   9   1.473   0.239  -8.793
   62    HA   LEU   9           HA       LEU   9  -0.666  -0.507 -10.427
   63   1HB   LEU   9          HB2       LEU   9  -0.912   1.134  -8.670
   64   2HB   LEU   9          HB1       LEU   9   0.202   2.221  -9.476
   65    HG   LEU   9           HG       LEU   9  -1.452   2.360 -11.371
   66   1HD1  LEU   9          HD11      LEU   9  -3.209   1.016 -11.408
   67   2HD1  LEU   9          HD12      LEU   9  -3.783   1.718  -9.895
   68   3HD1  LEU   9          HD13      LEU   9  -2.717   0.313  -9.868
   69   1HD2  LEU   9          HD21      LEU   9  -1.207   4.111  -9.677
   70   2HD2  LEU   9          HD22      LEU   9  -2.397   3.292  -8.664
   71   3HD2  LEU   9          HD23      LEU   9  -2.877   3.958 -10.225
   72    H    GLN  10           HN       GLN  10   1.921   1.850 -11.089
   73    HA   GLN  10           HA       GLN  10   1.100   2.526 -13.687
   74   1HB   GLN  10          HB2       GLN  10   2.783   3.701 -12.145
   75   2HB   GLN  10          HB1       GLN  10   3.963   2.558 -12.764
   76   1HG   GLN  10          HG2       GLN  10   4.167   4.575 -14.004
   77   2HG   GLN  10          HG1       GLN  10   3.445   3.362 -15.060
   78   1HE2  GLN  10          HE21      GLN  10   1.807   4.056 -16.222
   79   2HE2  GLN  10          HE22      GLN  10   0.741   5.352 -15.815
   80    H    GLU  11           HN       GLU  11   3.265  -0.024 -12.510
   81    HA   GLU  11           HA       GLU  11   4.240  -0.875 -15.025
   82   1HB   GLU  11          HB2       GLU  11   3.869  -2.439 -12.465
   83   2HB   GLU  11          HB1       GLU  11   4.777  -3.008 -13.858
   84   1HG   GLU  11          HG2       GLU  11   6.296  -1.078 -13.604
   85   2HG   GLU  11          HG1       GLU  11   5.419  -0.622 -12.143
   86    H    LEU  12           HN       LEU  12   1.469  -2.027 -13.099
   87    HA   LEU  12           HA       LEU  12   0.672  -4.126 -14.766
   88   1HB   LEU  12          HB2       LEU  12  -1.078  -2.298 -13.119
   89   2HB   LEU  12          HB1       LEU  12  -1.564  -3.851 -13.771
   90    HG   LEU  12           HG       LEU  12   0.612  -3.433 -11.724
   91   1HD1  LEU  12          HD11      LEU  12  -0.900  -3.683 -10.101
   92   2HD1  LEU  12          HD12      LEU  12  -1.751  -4.962 -10.968
   93   3HD1  LEU  12          HD13      LEU  12  -2.096  -3.271 -11.329
   94   1HD2  LEU  12          HD21      LEU  12   0.683  -5.823 -11.541
   95   2HD2  LEU  12          HD22      LEU  12   0.912  -5.391 -13.236
   96   3HD2  LEU  12          HD23      LEU  12  -0.649  -5.998 -12.684
   97    H    LEU  13           HN       LEU  13  -0.229  -0.702 -14.854
   98    HA   LEU  13           HA       LEU  13  -1.749  -1.121 -17.302
   99   1HB   LEU  13          HB2       LEU  13  -1.363   1.252 -15.502
  100   2HB   LEU  13          HB1       LEU  13  -2.115   1.408 -17.078
  101    HG   LEU  13           HG       LEU  13  -3.720  -0.439 -16.258
  102   1HD1  LEU  13          HD11      LEU  13  -2.421  -1.018 -14.249
  103   2HD1  LEU  13          HD12      LEU  13  -4.080  -0.549 -13.877
  104   3HD1  LEU  13          HD13      LEU  13  -2.759   0.584 -13.593
  105   1HD2  LEU  13          HD21      LEU  13  -4.163   2.042 -16.614
  106   2HD2  LEU  13          HD22      LEU  13  -3.978   2.210 -14.868
  107   3HD2  LEU  13          HD23      LEU  13  -5.252   1.182 -15.525
  108    H    GLY  14           HN       GLY  14   0.935  -1.690 -17.609
  109   1HA   GLY  14          HA2       GLY  14   1.584   0.128 -19.761
  110   2HA   GLY  14          HA1       GLY  14   2.715   0.195 -18.421
  111    H    GLU  15           HN       GLU  15   3.160  -2.328 -17.679
  112    HA   GLU  15           HA       GLU  15   4.736  -3.347 -19.826
  113   1HB   GLU  15          HB2       GLU  15   4.104  -4.480 -17.102
  114   2HB   GLU  15          HB1       GLU  15   5.254  -5.201 -18.223
  115   1HG   GLU  15          HG2       GLU  15   5.426  -2.487 -16.933
  116   2HG   GLU  15          HG1       GLU  15   6.461  -3.885 -16.634
  117    H    GLU  16           HN       GLU  16   1.800  -4.596 -18.232
  118    HA   GLU  16           HA       GLU  16   1.625  -6.902 -19.891
  119   1HB   GLU  16          HB2       GLU  16  -0.437  -5.505 -18.180
  120   2HB   GLU  16          HB1       GLU  16  -0.743  -7.012 -19.030
  121   1HG   GLU  16          HG2       GLU  16   1.441  -6.651 -16.993
  122   2HG   GLU  16          HG1       GLU  16  -0.169  -7.258 -16.617
  123    H    ARG  17           HN       ARG  17   0.426  -3.621 -20.152
  124    HA   ARG  17           HA       ARG  17  -1.297  -4.184 -22.388
  125   1HB   ARG  17          HB2       ARG  17  -0.423  -1.648 -21.029
  126   2HB   ARG  17          HB1       ARG  17  -1.368  -1.619 -22.512
  127   1HG   ARG  17          HG2       ARG  17  -3.159  -2.840 -21.430
  128   2HG   ARG  17          HG1       ARG  17  -2.204  -2.971 -19.952
  129   1HD   ARG  17          HD2       ARG  17  -2.299  -0.619 -19.588
  130   2HD   ARG  17          HD1       ARG  17  -2.978  -0.335 -21.188
  131    HE   ARG  17           HE       ARG  17  -5.034  -0.702 -20.300
  132   1HH1  ARG  17          HH11      ARG  17  -2.723  -2.228 -18.205
  133   2HH1  ARG  17          HH12      ARG  17  -3.926  -2.774 -17.094
  134   1HH2  ARG  17          HH21      ARG  17  -6.578  -1.408 -18.842
  135   2HH2  ARG  17          HH22      ARG  17  -6.095  -2.307 -17.448
  136    H    ARG  18           HN       ARG  18   1.842  -2.524 -21.985
  137    HA   ARG  18           HA       ARG  18   3.517  -2.036 -23.430
  138   1HB   ARG  18          HB2       ARG  18   2.278  -4.413 -24.756
  139   2HB   ARG  18          HB1       ARG  18   3.563  -3.537 -25.573
  140   1HG   ARG  18          HG2       ARG  18   3.947  -4.451 -22.756
  141   2HG   ARG  18          HG1       ARG  18   4.132  -5.589 -24.089
  142   1HD   ARG  18          HD2       ARG  18   6.290  -4.793 -23.786
  143   2HD   ARG  18          HD1       ARG  18   5.686  -3.799 -25.107
  144    HE   ARG  18           HE       ARG  18   5.774  -1.957 -23.732
  145   1HH1  ARG  18          HH11      ARG  18   6.295  -4.820 -21.860
  146   2HH1  ARG  18          HH12      ARG  18   6.810  -3.951 -20.438
  147   1HH2  ARG  18          HH21      ARG  18   6.386  -0.837 -21.870
  148   2HH2  ARG  18          HH22      ARG  18   6.794  -1.717 -20.421
  Start of MODEL   14
    1   1H    ILE   1          HT1       ILE   1   6.312   6.178   3.670
    2   2H    ILE   1          HT2       ILE   1   7.059   5.418   4.986
    3   3H    ILE   1          HT3       ILE   1   5.375   5.573   4.944
    4    HA   ILE   1           HA       ILE   1   6.748   3.387   4.184
    5    HB   ILE   1           HB       ILE   1   4.635   2.675   3.065
    6   1HG1  ILE   1          HG12      ILE   1   3.706   5.478   3.739
    7   2HG1  ILE   1          HG11      ILE   1   4.033   4.886   2.114
    8   1HG2  ILE   1          HG21      ILE   1   4.609   3.929   5.785
    9   2HG2  ILE   1          HG22      ILE   1   4.715   2.225   5.346
   10   3HG2  ILE   1          HG23      ILE   1   3.192   3.092   5.152
   11   1HD1  ILE   1          HD11      ILE   1   1.673   4.866   2.500
   12   2HD1  ILE   1          HD12      ILE   1   1.879   3.938   3.987
   13   3HD1  ILE   1          HD13      ILE   1   2.248   3.199   2.428
   14    HA   PRO   2           HA       PRO   2   8.464   4.007   0.158
   15   1HB   PRO   2          HB2       PRO   2   8.045   1.136  -0.338
   16   2HB   PRO   2          HB1       PRO   2   9.551   2.051  -0.241
   17   1HG   PRO   2          HG2       PRO   2   8.822   0.334   1.688
   18   2HG   PRO   2          HG1       PRO   2   9.689   1.836   2.054
   19   1HD   PRO   2          HD2       PRO   2   6.770   1.217   2.328
   20   2HD   PRO   2          HD1       PRO   2   7.840   2.108   3.432
   21    H    GLU   3           HN       GLU   3   7.683   4.601  -1.769
   22    HA   GLU   3           HA       GLU   3   4.927   4.235  -2.430
   23   1HB   GLU   3          HB2       GLU   3   7.219   5.401  -4.020
   24   2HB   GLU   3          HB1       GLU   3   5.540   5.455  -4.527
   25   1HG   GLU   3          HG2       GLU   3   6.183   7.570  -3.580
   26   2HG   GLU   3          HG1       GLU   3   4.996   6.789  -2.539
   27    H    SER   4           HN       SER   4   5.787   1.686  -2.259
   28    HA   SER   4           HA       SER   4   6.778   0.543  -4.654
   29   1HB   SER   4          HB2       SER   4   5.997  -1.612  -3.705
   30   2HB   SER   4          HB1       SER   4   6.925  -0.660  -2.548
   31    HG   SER   4           HG       SER   4   4.949  -1.593  -1.708
   32    H    SER   5           HN       SER   5   3.548   1.387  -3.627
   33    HA   SER   5           HA       SER   5   2.096  -0.188  -5.446
   34   1HB   SER   5          HB2       SER   5   0.274   1.502  -5.071
   35   2HB   SER   5          HB1       SER   5   0.965   0.794  -3.617
   36    HG   SER   5           HG       SER   5   0.683   3.287  -3.986
   37    H    GLU   6           HN       GLU   6   3.312   3.149  -5.758
   38    HA   GLU   6           HA       GLU   6   2.176   3.665  -8.278
   39   1HB   GLU   6          HB2       GLU   6   4.706   4.762  -7.039
   40   2HB   GLU   6          HB1       GLU   6   3.954   5.401  -8.495
   41   1HG   GLU   6          HG2       GLU   6   1.925   5.903  -7.194
   42   2HG   GLU   6          HG1       GLU   6   2.746   5.335  -5.740
   43    H    LEU   7           HN       LEU   7   5.320   2.306  -7.370
   44    HA   LEU   7           HA       LEU   7   6.287   2.019 -10.020
   45   1HB   LEU   7          HB2       LEU   7   7.093   0.912  -7.364
   46   2HB   LEU   7          HB1       LEU   7   7.786   0.229  -8.821
   47    HG   LEU   7           HG       LEU   7   9.306   1.863  -7.947
   48   1HD1  LEU   7          HD11      LEU   7   7.951   3.214 -10.260
   49   2HD1  LEU   7          HD12      LEU   7   8.877   1.723 -10.438
   50   3HD1  LEU   7          HD13      LEU   7   9.667   3.187  -9.852
   51   1HD2  LEU   7          HD21      LEU   7   6.887   3.622  -7.827
   52   2HD2  LEU   7          HD22      LEU   7   8.505   4.315  -7.939
   53   3HD2  LEU   7          HD23      LEU   7   8.082   3.278  -6.576
   54    H    THR   8           HN       THR   8   4.576  -0.242  -7.821
   55    HA   THR   8           HA       THR   8   4.773  -2.455  -9.608
   56    HB   THR   8           HB       THR   8   2.771  -3.350  -8.288
   57    HG1  THR   8           HG1      THR   8   3.386  -1.264  -6.472
   58   1HG2  THR   8          HG21      THR   8   4.543  -4.358  -7.366
   59   2HG2  THR   8          HG22      THR   8   4.432  -3.137  -6.098
   60   3HG2  THR   8          HG23      THR   8   5.525  -2.896  -7.461
   61    H    LEU   9           HN       LEU   9   2.276   0.011  -9.089
   62    HA   LEU   9           HA       LEU   9   0.380  -1.006 -10.905
   63   1HB   LEU   9          HB2       LEU   9  -0.197   0.714  -9.303
   64   2HB   LEU   9          HB1       LEU   9   0.949   1.825 -10.030
   65    HG   LEU   9           HG       LEU   9  -0.427   1.749 -12.126
   66   1HD1  LEU   9          HD11      LEU   9  -2.656   0.650 -10.470
   67   2HD1  LEU   9          HD12      LEU   9  -1.552  -0.445 -11.302
   68   3HD1  LEU   9          HD13      LEU   9  -2.490   0.728 -12.225
   69   1HD2  LEU   9          HD21      LEU   9  -1.928   2.707  -9.696
   70   2HD2  LEU   9          HD22      LEU   9  -2.027   3.338 -11.340
   71   3HD2  LEU   9          HD23      LEU   9  -0.549   3.549 -10.402
   72    H    GLN  10           HN       GLN  10   3.002   1.370 -11.344
   73    HA   GLN  10           HA       GLN  10   2.523   1.969 -14.035
   74   1HB   GLN  10          HB2       GLN  10   4.025   3.300 -12.656
   75   2HB   GLN  10          HB1       GLN  10   5.138   1.948 -12.522
   76   1HG   GLN  10          HG2       GLN  10   5.690   2.078 -14.840
   77   2HG   GLN  10          HG1       GLN  10   4.413   3.257 -15.130
   78   1HE2  GLN  10          HE21      GLN  10   5.228   5.184 -15.484
   79   2HE2  GLN  10          HE22      GLN  10   6.577   5.886 -14.668
   80    H    GLU  11           HN       GLU  11   4.443  -0.657 -12.587
   81    HA   GLU  11           HA       GLU  11   5.494  -1.617 -15.048
   82   1HB   GLU  11          HB2       GLU  11   6.469  -2.271 -12.899
   83   2HB   GLU  11          HB1       GLU  11   5.001  -3.140 -12.480
   84   1HG   GLU  11          HG2       GLU  11   5.368  -4.668 -14.346
   85   2HG   GLU  11          HG1       GLU  11   6.826  -3.786 -14.789
   86    H    LEU  12           HN       LEU  12   2.638  -2.532 -13.140
   87    HA   LEU  12           HA       LEU  12   1.722  -4.609 -14.790
   88   1HB   LEU  12          HB2       LEU  12   0.113  -2.670 -13.122
   89   2HB   LEU  12          HB1       LEU  12  -0.498  -4.171 -13.791
   90    HG   LEU  12           HG       LEU  12   1.700  -3.940 -11.735
   91   1HD1  LEU  12          HD11      LEU  12  -0.307  -5.327 -10.563
   92   2HD1  LEU  12          HD12      LEU  12  -1.220  -4.188 -11.552
   93   3HD1  LEU  12          HD13      LEU  12  -0.052  -3.592 -10.373
   94   1HD2  LEU  12          HD21      LEU  12   2.077  -6.145 -11.927
   95   2HD2  LEU  12          HD22      LEU  12   1.373  -5.951 -13.532
   96   3HD2  LEU  12          HD23      LEU  12   0.373  -6.515 -12.193
   97    H    LEU  13           HN       LEU  13   0.921  -1.139 -14.796
   98    HA   LEU  13           HA       LEU  13  -0.842  -1.168 -16.987
   99   1HB   LEU  13          HB2       LEU  13   1.009   1.047 -16.092
  100   2HB   LEU  13          HB1       LEU  13  -0.346   1.239 -17.188
  101    HG   LEU  13           HG       LEU  13  -0.521   0.448 -14.280
  102   1HD1  LEU  13          HD11      LEU  13  -0.117   2.693 -14.167
  103   2HD1  LEU  13          HD12      LEU  13  -1.869   2.703 -14.368
  104   3HD1  LEU  13          HD13      LEU  13  -0.821   3.014 -15.752
  105   1HD2  LEU  13          HD21      LEU  13  -3.020   1.237 -15.244
  106   2HD2  LEU  13          HD22      LEU  13  -2.517  -0.387 -14.775
  107   3HD2  LEU  13          HD23      LEU  13  -2.376   0.129 -16.456
  108    H    GLY  14           HN       GLY  14   2.662  -0.833 -16.815
  109   1HA   GLY  14          HA2       GLY  14   3.132  -0.269 -19.543
  110   2HA   GLY  14          HA1       GLY  14   4.303  -0.939 -18.416
  111    H    GLU  15           HN       GLU  15   2.930  -3.333 -17.756
  112    HA   GLU  15           HA       GLU  15   3.666  -4.932 -20.025
  113   1HB   GLU  15          HB2       GLU  15   3.999  -5.722 -17.727
  114   2HB   GLU  15          HB1       GLU  15   2.265  -5.697 -17.451
  115   1HG   GLU  15          HG2       GLU  15   2.918  -7.951 -17.811
  116   2HG   GLU  15          HG1       GLU  15   2.020  -7.419 -19.229
  117    H    GLU  16           HN       GLU  16   0.553  -4.001 -18.568
  118    HA   GLU  16           HA       GLU  16  -0.958  -5.611 -20.405
  119   1HB   GLU  16          HB2       GLU  16  -2.941  -4.575 -19.407
  120   2HB   GLU  16          HB1       GLU  16  -1.836  -5.178 -18.181
  121   1HG   GLU  16          HG2       GLU  16  -1.051  -2.950 -17.727
  122   2HG   GLU  16          HG1       GLU  16  -2.019  -2.304 -19.049
  123    H    ARG  17           HN       ARG  17  -0.100  -2.151 -20.274
  124    HA   ARG  17           HA       ARG  17  -1.411  -1.898 -22.912
  125   1HB   ARG  17          HB2       ARG  17  -1.453  -0.090 -20.548
  126   2HB   ARG  17          HB1       ARG  17  -1.529   0.627 -22.153
  127   1HG   ARG  17          HG2       ARG  17  -3.524  -0.571 -22.676
  128   2HG   ARG  17          HG1       ARG  17  -3.392  -1.535 -21.205
  129   1HD   ARG  17          HD2       ARG  17  -3.523   1.423 -20.939
  130   2HD   ARG  17          HD1       ARG  17  -5.000   0.562 -21.366
  131    HE   ARG  17           HE       ARG  17  -3.817  -0.726 -19.170
  132   1HH1  ARG  17          HH11      ARG  17  -5.334   2.303 -19.901
  133   2HH1  ARG  17          HH12      ARG  17  -6.012   2.469 -18.322
  134   1HH2  ARG  17          HH21      ARG  17  -4.673  -0.534 -17.168
  135   2HH2  ARG  17          HH22      ARG  17  -5.641   0.864 -16.764
  136    H    ARG  18           HN       ARG  18   1.047  -2.690 -23.227
  137    HA   ARG  18           HA       ARG  18   2.807  -0.367 -23.497
  138   1HB   ARG  18          HB2       ARG  18   4.465  -2.143 -24.310
  139   2HB   ARG  18          HB1       ARG  18   4.005  -2.167 -22.615
  140   1HG   ARG  18          HG2       ARG  18   2.379  -3.961 -23.124
  141   2HG   ARG  18          HG1       ARG  18   2.974  -3.981 -24.781
  142   1HD   ARG  18          HD2       ARG  18   3.998  -5.735 -23.390
  143   2HD   ARG  18          HD1       ARG  18   5.185  -4.595 -24.024
  144    HE   ARG  18           HE       ARG  18   4.479  -3.622 -21.551
  145   1HH1  ARG  18          HH11      ARG  18   5.781  -6.591 -22.749
  146   2HH1  ARG  18          HH12      ARG  18   6.655  -6.929 -21.299
  147   1HH2  ARG  18          HH21      ARG  18   5.659  -4.044 -19.694
  148   2HH2  ARG  18          HH22      ARG  18   6.590  -5.495 -19.579
  Start of MODEL   15
    1   1H    ILE   1          HT1       ILE   1   1.681  10.793   0.048
    2   2H    ILE   1          HT2       ILE   1   2.108   9.606  -1.096
    3   3H    ILE   1          HT3       ILE   1   3.275  10.704  -0.518
    4    HA   ILE   1           HA       ILE   1   3.488   9.695   1.509
    5    HB   ILE   1           HB       ILE   1   1.788   8.156   2.445
    6   1HG1  ILE   1          HG12      ILE   1   0.110   8.968   0.060
    7   2HG1  ILE   1          HG11      ILE   1   0.844   7.383   0.283
    8   1HG2  ILE   1          HG21      ILE   1  -0.020   9.930   2.732
    9   2HG2  ILE   1          HG22      ILE   1   0.964  10.934   1.666
   10   3HG2  ILE   1          HG23      ILE   1   1.624  10.366   3.200
   11   1HD1  ILE   1          HD11      ILE   1  -0.496   7.134   2.363
   12   2HD1  ILE   1          HD12      ILE   1  -1.456   7.246   0.887
   13   3HD1  ILE   1          HD13      ILE   1  -1.313   8.643   1.955
   14    HA   PRO   2           HA       PRO   2   5.290   5.849   0.134
   15   1HB   PRO   2          HB2       PRO   2   3.857   4.023   1.950
   16   2HB   PRO   2          HB1       PRO   2   5.582   4.390   1.853
   17   1HG   PRO   2          HG2       PRO   2   4.084   5.270   3.888
   18   2HG   PRO   2          HG1       PRO   2   5.396   6.252   3.210
   19   1HD   PRO   2          HD2       PRO   2   2.442   6.462   2.748
   20   2HD   PRO   2          HD1       PRO   2   3.631   7.752   3.021
   21    H    GLU   3           HN       GLU   3   3.218   6.446  -1.524
   22    HA   GLU   3           HA       GLU   3   1.430   4.235  -1.949
   23   1HB   GLU   3          HB2       GLU   3   2.120   6.669  -3.605
   24   2HB   GLU   3          HB1       GLU   3   0.891   5.499  -4.066
   25   1HG   GLU   3          HG2       GLU   3  -0.611   6.356  -2.661
   26   2HG   GLU   3          HG1       GLU   3   0.555   6.478  -1.347
   27    H    SER   4           HN       SER   4   3.786   3.010  -1.857
   28    HA   SER   4           HA       SER   4   5.237   2.797  -4.271
   29   1HB   SER   4          HB2       SER   4   6.189   0.744  -3.306
   30   2HB   SER   4          HB1       SER   4   6.165   2.060  -2.132
   31    HG   SER   4           HG       SER   4   5.289  -0.257  -1.657
   32    H    SER   5           HN       SER   5   2.434   1.008  -3.071
   33    HA   SER   5           HA       SER   5   2.402  -1.088  -4.906
   34   1HB   SER   5          HB2       SER   5  -0.061  -1.173  -4.462
   35   2HB   SER   5          HB1       SER   5   0.943  -1.126  -3.016
   36    HG   SER   5           HG       SER   5  -1.020   0.385  -3.343
   37    H    GLU   6           HN       GLU   6   1.188   2.198  -5.231
   38    HA   GLU   6           HA       GLU   6  -0.193   1.916  -7.668
   39   1HB   GLU   6          HB2       GLU   6  -0.340   3.904  -6.210
   40   2HB   GLU   6          HB1       GLU   6   1.329   4.295  -6.576
   41   1HG   GLU   6          HG2       GLU   6   0.700   4.562  -8.953
   42   2HG   GLU   6          HG1       GLU   6  -0.983   4.295  -8.498
   43    H    LEU   7           HN       LEU   7   3.119   2.881  -6.922
   44    HA   LEU   7           HA       LEU   7   4.035   3.135  -9.575
   45   1HB   LEU   7          HB2       LEU   7   5.385   2.801  -6.925
   46   2HB   LEU   7          HB1       LEU   7   6.329   2.694  -8.396
   47    HG   LEU   7           HG       LEU   7   5.554   4.979  -9.013
   48   1HD1  LEU   7          HD11      LEU   7   4.801   6.009  -6.529
   49   2HD1  LEU   7          HD12      LEU   7   3.816   4.565  -6.763
   50   3HD1  LEU   7          HD13      LEU   7   3.801   5.848  -7.973
   51   1HD2  LEU   7          HD21      LEU   7   6.892   6.137  -7.212
   52   2HD2  LEU   7          HD22      LEU   7   7.701   4.811  -8.046
   53   3HD2  LEU   7          HD23      LEU   7   7.037   4.562  -6.432
   54    H    THR   8           HN       THR   8   4.176   0.370  -7.280
   55    HA   THR   8           HA       THR   8   5.673  -1.306  -9.008
   56    HB   THR   8           HB       THR   8   4.797  -3.202  -7.655
   57    HG1  THR   8           HG1      THR   8   2.725  -2.120  -7.186
   58   1HG2  THR   8          HG21      THR   8   5.881  -0.802  -6.195
   59   2HG2  THR   8          HG22      THR   8   6.795  -2.134  -6.902
   60   3HG2  THR   8          HG23      THR   8   5.779  -2.414  -5.487
   61    H    LEU   9           HN       LEU   9   2.168  -0.896  -8.585
   62    HA   LEU   9           HA       LEU   9   1.381  -2.946 -10.371
   63   1HB   LEU   9          HB2       LEU   9  -0.191  -1.978  -8.808
   64   2HB   LEU   9          HB1       LEU   9  -0.001  -0.395  -9.538
   65    HG   LEU   9           HG       LEU   9  -0.979  -1.344 -11.648
   66   1HD1  LEU   9          HD11      LEU   9  -2.344  -3.416 -11.353
   67   2HD1  LEU   9          HD12      LEU   9  -1.496  -3.687  -9.830
   68   3HD1  LEU   9          HD13      LEU   9  -0.600  -3.676 -11.349
   69   1HD2  LEU   9          HD21      LEU   9  -2.384   0.010 -10.340
   70   2HD2  LEU   9          HD22      LEU   9  -2.560  -1.228  -9.097
   71   3HD2  LEU   9          HD23      LEU   9  -3.321  -1.446 -10.672
   72    H    GLN  10           HN       GLN  10   1.859   0.543 -10.805
   73    HA   GLN  10           HA       GLN  10   1.202   0.699 -13.524
   74   1HB   GLN  10          HB2       GLN  10   1.456   2.642 -12.013
   75   2HB   GLN  10          HB1       GLN  10   3.190   2.370 -11.979
   76   1HG   GLN  10          HG2       GLN  10   2.735   4.149 -13.495
   77   2HG   GLN  10          HG1       GLN  10   3.242   2.744 -14.431
   78   1HE2  GLN  10          HE21      GLN  10   1.053   5.184 -14.260
   79   2HE2  GLN  10          HE22      GLN  10  -0.195   4.517 -15.249
   80    H    GLU  11           HN       GLU  11   4.283  -0.016 -11.912
   81    HA   GLU  11           HA       GLU  11   5.886  -0.010 -14.241
   82   1HB   GLU  11          HB2       GLU  11   6.791   0.083 -11.939
   83   2HB   GLU  11          HB1       GLU  11   6.300  -1.587 -11.694
   84   1HG   GLU  11          HG2       GLU  11   7.852  -2.361 -13.328
   85   2HG   GLU  11          HG1       GLU  11   8.225  -0.714 -13.833
   86    H    LEU  12           HN       LEU  12   4.198  -2.655 -12.544
   87    HA   LEU  12           HA       LEU  12   5.029  -4.750 -14.228
   88   1HB   LEU  12          HB2       LEU  12   2.429  -4.464 -12.716
   89   2HB   LEU  12          HB1       LEU  12   3.039  -5.956 -13.405
   90    HG   LEU  12           HG       LEU  12   4.355  -4.387 -11.190
   91   1HD1  LEU  12          HD11      LEU  12   2.939  -7.044 -11.085
   92   2HD1  LEU  12          HD12      LEU  12   2.244  -5.512 -10.554
   93   3HD1  LEU  12          HD13      LEU  12   3.660  -6.169  -9.734
   94   1HD2  LEU  12          HD21      LEU  12   5.183  -7.144 -11.621
   95   2HD2  LEU  12          HD22      LEU  12   6.156  -5.693 -11.380
   96   3HD2  LEU  12          HD23      LEU  12   5.550  -6.092 -12.987
   97    H    LEU  13           HN       LEU  13   2.144  -2.667 -14.357
   98    HA   LEU  13           HA       LEU  13   1.035  -3.811 -16.700
   99   1HB   LEU  13          HB2       LEU  13   0.749  -1.012 -15.597
  100   2HB   LEU  13          HB1       LEU  13  -0.244  -1.691 -16.872
  101    HG   LEU  13           HG       LEU  13  -0.120  -2.704 -14.029
  102   1HD1  LEU  13          HD11      LEU  13  -1.374  -0.842 -13.735
  103   2HD1  LEU  13          HD12      LEU  13  -2.643  -1.900 -14.352
  104   3HD1  LEU  13          HD13      LEU  13  -1.847  -0.756 -15.432
  105   1HD2  LEU  13          HD21      LEU  13  -1.492  -4.411 -14.601
  106   2HD2  LEU  13          HD22      LEU  13  -0.697  -4.215 -16.163
  107   3HD2  LEU  13          HD23      LEU  13  -2.281  -3.493 -15.884
  108    H    GLY  14           HN       GLY  14   3.315  -1.178 -16.170
  109   1HA   GLY  14          HA2       GLY  14   3.477  -0.205 -18.803
  110   2HA   GLY  14          HA1       GLY  14   4.720  -0.036 -17.571
  111    H    GLU  15           HN       GLU  15   5.451  -2.673 -17.119
  112    HA   GLU  15           HA       GLU  15   7.145  -3.171 -19.345
  113   1HB   GLU  15          HB2       GLU  15   7.715  -3.869 -17.027
  114   2HB   GLU  15          HB1       GLU  15   6.443  -5.085 -17.106
  115   1HG   GLU  15          HG2       GLU  15   7.605  -6.113 -19.034
  116   2HG   GLU  15          HG1       GLU  15   8.909  -4.950 -18.827
  117    H    GLU  16           HN       GLU  16   4.126  -4.659 -18.226
  118    HA   GLU  16           HA       GLU  16   4.014  -6.720 -20.152
  119   1HB   GLU  16          HB2       GLU  16   1.971  -5.346 -18.440
  120   2HB   GLU  16          HB1       GLU  16   1.451  -6.474 -19.684
  121   1HG   GLU  16          HG2       GLU  16   3.476  -7.219 -17.600
  122   2HG   GLU  16          HG1       GLU  16   1.742  -7.373 -17.327
  123    H    ARG  17           HN       ARG  17   2.751  -3.389 -20.175
  124    HA   ARG  17           HA       ARG  17   1.954  -3.789 -22.980
  125   1HB   ARG  17          HB2       ARG  17   1.245  -1.600 -21.025
  126   2HB   ARG  17          HB1       ARG  17   0.739  -1.623 -22.710
  127   1HG   ARG  17          HG2       ARG  17   0.029  -3.661 -20.607
  128   2HG   ARG  17          HG1       ARG  17  -1.040  -2.429 -21.282
  129   1HD   ARG  17          HD2       ARG  17  -0.972  -3.456 -23.442
  130   2HD   ARG  17          HD1       ARG  17   0.294  -4.570 -22.933
  131    HE   ARG  17           HE       ARG  17  -1.317  -5.927 -22.070
  132   1HH1  ARG  17          HH11      ARG  17  -2.701  -2.791 -22.524
  133   2HH1  ARG  17          HH12      ARG  17  -4.283  -3.290 -22.045
  134   1HH2  ARG  17          HH21      ARG  17  -3.371  -6.570 -21.445
  135   2HH2  ARG  17          HH22      ARG  17  -4.658  -5.420 -21.429
  136    H    ARG  18           HN       ARG  18   4.594  -3.752 -22.891
  137    HA   ARG  18           HA       ARG  18   5.719  -1.117 -23.117
  138   1HB   ARG  18          HB2       ARG  18   6.743  -3.894 -23.506
  139   2HB   ARG  18          HB1       ARG  18   7.654  -2.555 -24.187
  140   1HG   ARG  18          HG2       ARG  18   6.910  -2.874 -21.284
  141   2HG   ARG  18          HG1       ARG  18   8.493  -3.205 -21.989
  142   1HD   ARG  18          HD2       ARG  18   8.715  -1.064 -21.083
  143   2HD   ARG  18          HD1       ARG  18   8.428  -0.773 -22.798
  144    HE   ARG  18           HE       ARG  18   6.062  -0.743 -21.120
  145   1HH1  ARG  18          HH11      ARG  18   8.580   1.093 -22.630
  146   2HH1  ARG  18          HH12      ARG  18   7.734   2.594 -22.505
  147   1HH2  ARG  18          HH21      ARG  18   4.970   1.208 -20.945
  148   2HH2  ARG  18          HH22      ARG  18   5.695   2.660 -21.538
  Start of MODEL   16
    1   1H    ILE   1          HT1       ILE   1   4.886   6.507   3.573
    2   2H    ILE   1          HT2       ILE   1   3.616   5.925   4.530
    3   3H    ILE   1          HT3       ILE   1   3.609   7.532   4.003
    4    HA   ILE   1           HA       ILE   1   2.267   5.563   2.813
    5    HB   ILE   1           HB       ILE   1   1.858   7.882   2.371
    6   1HG1  ILE   1          HG12      ILE   1   2.697   6.557  -0.218
    7   2HG1  ILE   1          HG11      ILE   1   1.170   6.282   0.612
    8   1HG2  ILE   1          HG21      ILE   1   4.274   8.544   2.443
    9   2HG2  ILE   1          HG22      ILE   1   3.310   9.348   1.204
   10   3HG2  ILE   1          HG23      ILE   1   4.393   8.028   0.761
   11   1HD1  ILE   1          HD11      ILE   1   0.282   7.975  -0.489
   12   2HD1  ILE   1          HD12      ILE   1   1.825   8.275  -1.289
   13   3HD1  ILE   1          HD13      ILE   1   1.455   9.072   0.240
   14    HA   PRO   2           HA       PRO   2   5.133   2.966   0.618
   15   1HB   PRO   2          HB2       PRO   2   2.850   2.072  -0.991
   16   2HB   PRO   2          HB1       PRO   2   3.836   1.164   0.158
   17   1HG   PRO   2          HG2       PRO   2   1.283   1.834   0.688
   18   2HG   PRO   2          HG1       PRO   2   2.520   1.753   1.957
   19   1HD   PRO   2          HD2       PRO   2   1.409   4.154   0.544
   20   2HD   PRO   2          HD1       PRO   2   1.763   3.928   2.271
   21    H    GLU   3           HN       GLU   3   5.908   5.086  -0.405
   22    HA   GLU   3           HA       GLU   3   4.975   5.858  -2.982
   23   1HB   GLU   3          HB2       GLU   3   7.640   6.392  -1.657
   24   2HB   GLU   3          HB1       GLU   3   7.008   7.236  -3.064
   25   1HG   GLU   3          HG2       GLU   3   5.204   8.153  -1.758
   26   2HG   GLU   3          HG1       GLU   3   5.708   7.221  -0.350
   27    H    SER   4           HN       SER   4   5.108   3.299  -3.413
   28    HA   SER   4           HA       SER   4   7.107   2.997  -5.467
   29   1HB   SER   4          HB2       SER   4   8.070   0.896  -4.575
   30   2HB   SER   4          HB1       SER   4   8.427   2.276  -3.537
   31    HG   SER   4           HG       SER   4   7.727   0.484  -2.320
   32    H    SER   5           HN       SER   5   4.611   1.424  -3.500
   33    HA   SER   5           HA       SER   5   3.945  -0.674  -5.218
   34   1HB   SER   5          HB2       SER   5   2.032   0.863  -3.449
   35   2HB   SER   5          HB1       SER   5   1.838  -0.790  -4.029
   36    HG   SER   5           HG       SER   5   2.789  -1.274  -2.218
   37    H    GLU   6           HN       GLU   6   2.722   2.637  -5.089
   38    HA   GLU   6           HA       GLU   6   0.722   2.466  -7.036
   39   1HB   GLU   6          HB2       GLU   6   1.076   4.373  -5.495
   40   2HB   GLU   6          HB1       GLU   6   2.518   4.810  -6.391
   41   1HG   GLU   6          HG2       GLU   6   1.197   5.263  -8.363
   42   2HG   GLU   6          HG1       GLU   6  -0.267   4.754  -7.521
   43    H    LEU   7           HN       LEU   7   4.122   3.410  -7.324
   44    HA   LEU   7           HA       LEU   7   4.176   3.830 -10.104
   45   1HB   LEU   7          HB2       LEU   7   5.930   4.513  -8.447
   46   2HB   LEU   7          HB1       LEU   7   6.439   2.841  -8.368
   47    HG   LEU   7           HG       LEU   7   7.000   2.912 -10.774
   48   1HD1  LEU   7          HD11      LEU   7   5.347   4.997 -10.987
   49   2HD1  LEU   7          HD12      LEU   7   6.665   4.701 -12.120
   50   3HD1  LEU   7          HD13      LEU   7   6.871   5.866 -10.812
   51   1HD2  LEU   7          HD21      LEU   7   8.837   3.247  -9.372
   52   2HD2  LEU   7          HD22      LEU   7   8.284   4.848  -8.877
   53   3HD2  LEU   7          HD23      LEU   7   8.913   4.596 -10.506
   54    H    THR   8           HN       THR   8   4.913   0.975  -8.138
   55    HA   THR   8           HA       THR   8   5.656  -0.758 -10.240
   56    HB   THR   8           HB       THR   8   4.227  -1.685  -7.760
   57    HG1  THR   8           HG1      THR   8   5.911  -0.281  -7.085
   58   1HG2  THR   8          HG21      THR   8   5.174  -3.734  -8.137
   59   2HG2  THR   8          HG22      THR   8   6.574  -3.056  -8.968
   60   3HG2  THR   8          HG23      THR   8   5.023  -3.168  -9.800
   61    H    LEU   9           HN       LEU   9   2.499  -0.206  -8.680
   62    HA   LEU   9           HA       LEU   9   1.018  -2.094 -10.151
   63   1HB   LEU   9          HB2       LEU   9   0.151  -1.034  -8.137
   64   2HB   LEU   9          HB1       LEU   9   0.156   0.530  -8.929
   65    HG   LEU   9           HG       LEU   9  -1.517  -0.419 -10.568
   66   1HD1  LEU   9          HD11      LEU   9  -2.261  -2.470  -8.576
   67   2HD1  LEU   9          HD12      LEU   9  -0.863  -2.821  -9.593
   68   3HD1  LEU   9          HD13      LEU   9  -2.426  -2.474 -10.332
   69   1HD2  LEU   9          HD21      LEU   9  -3.319   0.178  -9.224
   70   2HD2  LEU   9          HD22      LEU   9  -1.959   1.013  -8.473
   71   3HD2  LEU   9          HD23      LEU   9  -2.576  -0.481  -7.766
   72    H    GLN  10           HN       GLN  10   1.663   1.343 -10.721
   73    HA   GLN  10           HA       GLN  10   0.158   1.635 -13.085
   74   1HB   GLN  10          HB2       GLN  10   0.977   3.544 -11.818
   75   2HB   GLN  10          HB1       GLN  10   2.639   3.077 -12.135
   76   1HG   GLN  10          HG2       GLN  10   2.338   3.526 -14.500
   77   2HG   GLN  10          HG1       GLN  10   0.646   3.934 -14.220
   78   1HE2  GLN  10          HE21      GLN  10   2.179   5.011 -11.571
   79   2HE2  GLN  10          HE22      GLN  10   2.521   6.631 -12.057
   80    H    GLU  11           HN       GLU  11   3.477   0.613 -12.481
   81    HA   GLU  11           HA       GLU  11   4.269   0.395 -15.215
   82   1HB   GLU  11          HB2       GLU  11   5.935   0.602 -13.463
   83   2HB   GLU  11          HB1       GLU  11   5.350  -0.857 -12.679
   84   1HG   GLU  11          HG2       GLU  11   6.126  -2.199 -14.543
   85   2HG   GLU  11          HG1       GLU  11   6.655  -0.745 -15.390
   86    H    LEU  12           HN       LEU  12   3.092  -1.918 -12.786
   87    HA   LEU  12           HA       LEU  12   3.170  -4.264 -14.305
   88   1HB   LEU  12          HB2       LEU  12   2.707  -4.186 -11.900
   89   2HB   LEU  12          HB1       LEU  12   1.170  -3.405 -12.209
   90    HG   LEU  12           HG       LEU  12   0.464  -5.482 -13.444
   91   1HD1  LEU  12          HD11      LEU  12   1.751  -7.547 -12.812
   92   2HD1  LEU  12          HD12      LEU  12   3.058  -6.482 -12.296
   93   3HD1  LEU  12          HD13      LEU  12   2.541  -6.490 -13.981
   94   1HD2  LEU  12          HD21      LEU  12  -0.115  -6.669 -11.446
   95   2HD2  LEU  12          HD22      LEU  12  -0.164  -4.940 -11.096
   96   3HD2  LEU  12          HD23      LEU  12   1.205  -5.911 -10.555
   97    H    LEU  13           HN       LEU  13   0.524  -1.881 -13.985
   98    HA   LEU  13           HA       LEU  13  -0.992  -3.233 -16.069
   99   1HB   LEU  13          HB2       LEU  13  -1.537  -0.950 -14.225
  100   2HB   LEU  13          HB1       LEU  13  -2.500  -1.119 -15.681
  101    HG   LEU  13           HG       LEU  13  -2.984  -3.490 -14.918
  102   1HD1  LEU  13          HD11      LEU  13  -2.438  -4.243 -12.855
  103   2HD1  LEU  13          HD12      LEU  13  -2.441  -2.631 -12.141
  104   3HD1  LEU  13          HD13      LEU  13  -1.066  -3.164 -13.110
  105   1HD2  LEU  13          HD21      LEU  13  -4.815  -2.792 -13.526
  106   2HD2  LEU  13          HD22      LEU  13  -4.574  -1.593 -14.797
  107   3HD2  LEU  13          HD23      LEU  13  -4.007  -1.269 -13.159
  108    H    GLY  14           HN       GLY  14   1.473  -2.326 -16.937
  109   1HA   GLY  14          HA2       GLY  14   0.625  -0.554 -19.095
  110   2HA   GLY  14          HA1       GLY  14   1.931   0.036 -18.081
  111    H    GLU  15           HN       GLU  15   3.530  -2.116 -17.676
  112    HA   GLU  15           HA       GLU  15   4.918  -2.348 -20.123
  113   1HB   GLU  15          HB2       GLU  15   6.134  -2.536 -18.078
  114   2HB   GLU  15          HB1       GLU  15   5.140  -3.875 -17.532
  115   1HG   GLU  15          HG2       GLU  15   7.343  -4.628 -18.208
  116   2HG   GLU  15          HG1       GLU  15   6.094  -5.312 -19.241
  117    H    GLU  16           HN       GLU  16   2.929  -4.748 -18.386
  118    HA   GLU  16           HA       GLU  16   3.121  -6.629 -20.569
  119   1HB   GLU  16          HB2       GLU  16   1.392  -6.671 -18.085
  120   2HB   GLU  16          HB1       GLU  16   1.560  -8.000 -19.223
  121   1HG   GLU  16          HG2       GLU  16   3.083  -8.698 -17.723
  122   2HG   GLU  16          HG1       GLU  16   4.138  -7.620 -18.633
  123    H    ARG  17           HN       ARG  17   1.917  -3.938 -21.006
  124    HA   ARG  17           HA       ARG  17  -0.483  -4.843 -22.406
  125   1HB   ARG  17          HB2       ARG  17  -0.446  -2.496 -20.498
  126   2HB   ARG  17          HB1       ARG  17  -1.728  -2.799 -21.659
  127   1HG   ARG  17          HG2       ARG  17  -2.178  -4.955 -20.546
  128   2HG   ARG  17          HG1       ARG  17  -0.951  -4.555 -19.342
  129   1HD   ARG  17          HD2       ARG  17  -2.214  -2.583 -18.684
  130   2HD   ARG  17          HD1       ARG  17  -3.421  -2.924 -19.922
  131    HE   ARG  17           HE       ARG  17  -3.152  -5.138 -18.197
  132   1HH1  ARG  17          HH11      ARG  17  -4.422  -1.928 -18.275
  133   2HH1  ARG  17          HH12      ARG  17  -5.645  -2.251 -17.100
  134   1HH2  ARG  17          HH21      ARG  17  -4.746  -5.568 -16.676
  135   2HH2  ARG  17          HH22      ARG  17  -5.828  -4.311 -16.196
  136    H    ARG  18           HN       ARG  18   2.255  -4.001 -23.174
  137    HA   ARG  18           HA       ARG  18   1.452  -1.830 -24.989
  138   1HB   ARG  18          HB2       ARG  18   3.739  -0.844 -24.791
  139   2HB   ARG  18          HB1       ARG  18   2.768  -0.718 -23.335
  140   1HG   ARG  18          HG2       ARG  18   4.923  -1.272 -22.605
  141   2HG   ARG  18          HG1       ARG  18   4.006  -2.775 -22.505
  142   1HD   ARG  18          HD2       ARG  18   4.948  -3.465 -24.670
  143   2HD   ARG  18          HD1       ARG  18   5.891  -1.979 -24.720
  144    HE   ARG  18           HE       ARG  18   6.567  -3.203 -22.333
  145   1HH1  ARG  18          HH11      ARG  18   6.664  -3.994 -25.710
  146   2HH1  ARG  18          HH12      ARG  18   8.048  -5.016 -25.558
  147   1HH2  ARG  18          HH21      ARG  18   8.360  -4.552 -22.122
  148   2HH2  ARG  18          HH22      ARG  18   9.003  -5.331 -23.543
  Start of MODEL   17
    1   1H    ILE   1          HT1       ILE   1   5.564   3.207   4.088
    2   2H    ILE   1          HT2       ILE   1   6.124   3.632   2.536
    3   3H    ILE   1          HT3       ILE   1   6.958   2.476   3.465
    4    HA   ILE   1           HA       ILE   1   5.245   0.883   3.271
    5    HB   ILE   1           HB       ILE   1   3.144   1.388   2.068
    6   1HG1  ILE   1          HG12      ILE   1   4.063   4.270   2.185
    7   2HG1  ILE   1          HG11      ILE   1   4.004   3.289   0.724
    8   1HG2  ILE   1          HG21      ILE   1   3.732   1.884   4.655
    9   2HG2  ILE   1          HG22      ILE   1   2.114   2.013   3.965
   10   3HG2  ILE   1          HG23      ILE   1   3.109   3.457   4.157
   11   1HD1  ILE   1          HD11      ILE   1   2.068   4.957   1.377
   12   2HD1  ILE   1          HD12      ILE   1   1.512   3.563   2.303
   13   3HD1  ILE   1          HD13      ILE   1   1.744   3.428   0.560
   14    HA   PRO   2           HA       PRO   2   6.661  -0.200  -0.789
   15   1HB   PRO   2          HB2       PRO   2   4.607  -1.389  -2.104
   16   2HB   PRO   2          HB1       PRO   2   5.451  -2.151  -0.753
   17   1HG   PRO   2          HG2       PRO   2   2.830  -0.710  -0.780
   18   2HG   PRO   2          HG1       PRO   2   3.280  -2.201   0.064
   19   1HD   PRO   2          HD2       PRO   2   3.154   0.213   1.296
   20   2HD   PRO   2          HD1       PRO   2   4.263  -1.077   1.801
   21    H    GLU   3           HN       GLU   3   6.182   2.474  -0.811
   22    HA   GLU   3           HA       GLU   3   4.377   3.516  -2.654
   23   1HB   GLU   3          HB2       GLU   3   7.136   4.590  -2.066
   24   2HB   GLU   3          HB1       GLU   3   5.784   5.499  -2.724
   25   1HG   GLU   3          HG2       GLU   3   5.369   6.118  -0.633
   26   2HG   GLU   3          HG1       GLU   3   4.761   4.483  -0.382
   27    H    SER   4           HN       SER   4   7.798   2.802  -3.229
   28    HA   SER   4           HA       SER   4   7.747   3.328  -5.998
   29   1HB   SER   4          HB2       SER   4   9.905   2.117  -6.075
   30   2HB   SER   4          HB1       SER   4   9.845   3.280  -4.751
   31    HG   SER   4           HG       SER   4  10.659   1.060  -4.298
   32    H    SER   5           HN       SER   5   7.285   0.346  -4.172
   33    HA   SER   5           HA       SER   5   7.231  -1.427  -6.359
   34   1HB   SER   5          HB2       SER   5   7.503  -2.197  -4.082
   35   2HB   SER   5          HB1       SER   5   5.884  -1.642  -3.672
   36    HG   SER   5           HG       SER   5   6.113  -3.944  -4.183
   37    H    GLU   6           HN       GLU   6   4.529   0.134  -4.599
   38    HA   GLU   6           HA       GLU   6   2.457  -0.956  -6.147
   39   1HB   GLU   6          HB2       GLU   6   2.236   0.334  -3.980
   40   2HB   GLU   6          HB1       GLU   6   2.454   1.803  -4.916
   41   1HG   GLU   6          HG2       GLU   6   0.452   1.342  -6.184
   42   2HG   GLU   6          HG1       GLU   6   0.250  -0.200  -5.355
   43    H    LEU   7           HN       LEU   7   4.270   2.064  -6.500
   44    HA   LEU   7           HA       LEU   7   2.941   2.981  -8.808
   45   1HB   LEU   7          HB2       LEU   7   5.713   3.561  -7.778
   46   2HB   LEU   7          HB1       LEU   7   4.980   4.400  -9.131
   47    HG   LEU   7           HG       LEU   7   3.958   4.411  -6.290
   48   1HD1  LEU   7          HD11      LEU   7   5.688   6.233  -7.868
   49   2HD1  LEU   7          HD12      LEU   7   5.729   5.834  -6.151
   50   3HD1  LEU   7          HD13      LEU   7   4.512   6.951  -6.768
   51   1HD2  LEU   7          HD21      LEU   7   2.510   4.783  -8.617
   52   2HD2  LEU   7          HD22      LEU   7   2.915   6.421  -8.104
   53   3HD2  LEU   7          HD23      LEU   7   2.061   5.338  -7.004
   54    H    THR   8           HN       THR   8   5.962   1.037  -8.472
   55    HA   THR   8           HA       THR   8   6.411   0.996 -11.288
   56    HB   THR   8           HB       THR   8   7.907  -0.977 -10.818
   57    HG1  THR   8           HG1      THR   8   7.512  -0.352  -8.082
   58   1HG2  THR   8          HG21      THR   8   9.630   0.386 -10.167
   59   2HG2  THR   8          HG22      THR   8   8.663   1.205  -8.940
   60   3HG2  THR   8          HG23      THR   8   8.439   1.596 -10.645
   61    H    LEU   9           HN       LEU   9   4.861  -1.333  -9.080
   62    HA   LEU   9           HA       LEU   9   4.357  -3.329 -10.988
   63   1HB   LEU   9          HB2       LEU   9   4.108  -3.767  -8.637
   64   2HB   LEU   9          HB1       LEU   9   2.838  -2.565  -8.499
   65    HG   LEU   9           HG       LEU   9   1.439  -3.979 -10.026
   66   1HD1  LEU   9          HD11      LEU   9   3.435  -5.221 -10.953
   67   2HD1  LEU   9          HD12      LEU   9   2.038  -6.208 -10.521
   68   3HD1  LEU   9          HD13      LEU   9   3.441  -6.148  -9.452
   69   1HD2  LEU   9          HD21      LEU   9   1.928  -4.201  -7.289
   70   2HD2  LEU   9          HD22      LEU   9   1.870  -5.861  -7.884
   71   3HD2  LEU   9          HD23      LEU   9   0.511  -4.775  -8.169
   72    H    GLN  10           HN       GLN  10   2.220  -0.663  -9.909
   73    HA   GLN  10           HA       GLN  10   0.062  -1.298 -11.583
   74   1HB   GLN  10          HB2       GLN  10  -0.156   0.248  -9.708
   75   2HB   GLN  10          HB1       GLN  10   0.890   1.405 -10.519
   76   1HG   GLN  10          HG2       GLN  10  -0.722   1.784 -12.231
   77   2HG   GLN  10          HG1       GLN  10  -1.726   0.455 -11.655
   78   1HE2  GLN  10          HE21      GLN  10  -3.492   1.194 -10.756
   79   2HE2  GLN  10          HE22      GLN  10  -3.613   2.573  -9.724
   80    H    GLU  11           HN       GLU  11   2.837   0.850 -12.178
   81    HA   GLU  11           HA       GLU  11   1.896   1.740 -14.701
   82   1HB   GLU  11          HB2       GLU  11   4.383   1.993 -13.159
   83   2HB   GLU  11          HB1       GLU  11   4.575   2.105 -14.903
   84   1HG   GLU  11          HG2       GLU  11   2.697   3.759 -13.229
   85   2HG   GLU  11          HG1       GLU  11   4.242   4.291 -13.888
   86    H    LEU  12           HN       LEU  12   3.957  -0.986 -13.780
   87    HA   LEU  12           HA       LEU  12   4.802  -1.723 -16.365
   88   1HB   LEU  12          HB2       LEU  12   4.173  -3.485 -13.989
   89   2HB   LEU  12          HB1       LEU  12   4.976  -4.039 -15.445
   90    HG   LEU  12           HG       LEU  12   6.041  -1.961 -13.539
   91   1HD1  LEU  12          HD11      LEU  12   5.940  -4.601 -13.062
   92   2HD1  LEU  12          HD12      LEU  12   7.255  -3.562 -12.512
   93   3HD1  LEU  12          HD13      LEU  12   7.443  -4.517 -13.982
   94   1HD2  LEU  12          HD21      LEU  12   6.837  -1.462 -15.728
   95   2HD2  LEU  12          HD22      LEU  12   7.177  -3.160 -16.058
   96   3HD2  LEU  12          HD23      LEU  12   8.142  -2.281 -14.872
   97    H    LEU  13           HN       LEU  13   1.943  -2.636 -14.491
   98    HA   LEU  13           HA       LEU  13   0.746  -4.003 -16.760
   99   1HB   LEU  13          HB2       LEU  13  -0.123  -3.522 -13.924
  100   2HB   LEU  13          HB1       LEU  13  -1.253  -4.119 -15.123
  101    HG   LEU  13           HG       LEU  13   0.408  -6.005 -15.536
  102   1HD1  LEU  13          HD11      LEU  13   1.434  -5.734 -12.806
  103   2HD1  LEU  13          HD12      LEU  13   2.078  -4.564 -13.958
  104   3HD1  LEU  13          HD13      LEU  13   2.235  -6.291 -14.275
  105   1HD2  LEU  13          HD21      LEU  13  -1.519  -6.686 -14.485
  106   2HD2  LEU  13          HD22      LEU  13  -1.261  -5.634 -13.093
  107   3HD2  LEU  13          HD23      LEU  13  -0.306  -7.105 -13.276
  108    H    GLY  14           HN       GLY  14   1.331  -1.489 -17.427
  109   1HA   GLY  14          HA2       GLY  14  -1.273  -0.358 -18.039
  110   2HA   GLY  14          HA1       GLY  14  -0.200   0.675 -17.101
  111    H    GLU  15           HN       GLU  15   2.245   0.338 -18.145
  112    HA   GLU  15           HA       GLU  15   2.303   1.861 -20.478
  113   1HB   GLU  15          HB2       GLU  15   4.270   0.069 -19.120
  114   2HB   GLU  15          HB1       GLU  15   4.639   0.611 -20.748
  115   1HG   GLU  15          HG2       GLU  15   3.996   2.470 -18.476
  116   2HG   GLU  15          HG1       GLU  15   5.631   1.977 -18.912
  117    H    GLU  16           HN       GLU  16   2.881  -1.638 -20.197
  118    HA   GLU  16           HA       GLU  16   2.570  -1.990 -23.058
  119   1HB   GLU  16          HB2       GLU  16   2.968  -4.090 -20.919
  120   2HB   GLU  16          HB1       GLU  16   3.173  -4.303 -22.651
  121   1HG   GLU  16          HG2       GLU  16   4.864  -2.598 -20.836
  122   2HG   GLU  16          HG1       GLU  16   5.320  -4.130 -21.578
  123    H    ARG  17           HN       ARG  17   0.228  -0.995 -21.855
  124    HA   ARG  17           HA       ARG  17  -1.611  -3.136 -22.549
  125   1HB   ARG  17          HB2       ARG  17  -1.276  -3.499 -20.165
  126   2HB   ARG  17          HB1       ARG  17  -1.688  -1.823 -19.831
  127   1HG   ARG  17          HG2       ARG  17  -3.533  -3.344 -19.328
  128   2HG   ARG  17          HG1       ARG  17  -3.954  -2.194 -20.599
  129   1HD   ARG  17          HD2       ARG  17  -3.410  -3.946 -22.278
  130   2HD   ARG  17          HD1       ARG  17  -3.164  -5.083 -20.954
  131    HE   ARG  17           HE       ARG  17  -5.686  -3.985 -20.625
  132   1HH1  ARG  17          HH11      ARG  17  -4.025  -5.927 -22.949
  133   2HH1  ARG  17          HH12      ARG  17  -5.457  -6.734 -23.476
  134   1HH2  ARG  17          HH21      ARG  17  -7.548  -5.032 -21.310
  135   2HH2  ARG  17          HH22      ARG  17  -7.443  -6.225 -22.552
  136    H    ARG  18           HN       ARG  18  -1.416   0.224 -21.308
  137    HA   ARG  18           HA       ARG  18  -4.004   0.923 -22.293
  138   1HB   ARG  18          HB2       ARG  18  -3.380   3.231 -21.743
  139   2HB   ARG  18          HB1       ARG  18  -3.017   2.122 -20.429
  140   1HG   ARG  18          HG2       ARG  18  -0.641   2.071 -21.484
  141   2HG   ARG  18          HG1       ARG  18  -1.154   3.579 -22.244
  142   1HD   ARG  18          HD2       ARG  18  -1.483   4.635 -20.162
  143   2HD   ARG  18          HD1       ARG  18  -1.412   3.105 -19.288
  144    HE   ARG  18           HE       ARG  18   1.003   3.823 -20.707
  145   1HH1  ARG  18          HH11      ARG  18  -0.726   3.951 -17.708
  146   2HH1  ARG  18          HH12      ARG  18   0.711   4.191 -16.748
  147   1HH2  ARG  18          HH21      ARG  18   2.839   4.126 -19.495
  148   2HH2  ARG  18          HH22      ARG  18   2.710   4.273 -17.741
  Start of MODEL   18
    1   1H    ILE   1          HT1       ILE   1   4.146   5.439   2.740
    2   2H    ILE   1          HT2       ILE   1   2.740   5.076   3.610
    3   3H    ILE   1          HT3       ILE   1   2.761   6.394   2.551
    4    HA   ILE   1           HA       ILE   1   1.984   3.794   2.005
    5    HB   ILE   1           HB       ILE   1   2.502   6.158   0.183
    6   1HG1  ILE   1          HG12      ILE   1  -0.095   6.158   0.251
    7   2HG1  ILE   1          HG11      ILE   1   0.095   5.180   1.700
    8   1HG2  ILE   1          HG21      ILE   1   2.324   4.640  -1.463
    9   2HG2  ILE   1          HG22      ILE   1   0.600   4.727  -1.100
   10   3HG2  ILE   1          HG23      ILE   1   1.582   3.433  -0.413
   11   1HD1  ILE   1          HD11      ILE   1   1.221   7.941   1.292
   12   2HD1  ILE   1          HD12      ILE   1   1.358   6.966   2.755
   13   3HD1  ILE   1          HD13      ILE   1  -0.223   7.538   2.222
   14    HA   PRO   2           HA       PRO   2   5.816   1.873   0.743
   15   1HB   PRO   2          HB2       PRO   2   4.075  -0.096  -0.595
   16   2HB   PRO   2          HB1       PRO   2   5.266  -0.338   0.685
   17   1HG   PRO   2          HG2       PRO   2   2.635  -0.497   1.175
   18   2HG   PRO   2          HG1       PRO   2   3.764   0.180   2.364
   19   1HD   PRO   2          HD2       PRO   2   1.908   1.600   0.489
   20   2HD   PRO   2          HD1       PRO   2   2.284   1.958   2.189
   21    H    GLU   3           HN       GLU   3   7.065   2.313  -0.952
   22    HA   GLU   3           HA       GLU   3   6.242   3.642  -3.246
   23   1HB   GLU   3          HB2       GLU   3   8.656   1.867  -3.343
   24   2HB   GLU   3          HB1       GLU   3   8.432   3.465  -4.037
   25   1HG   GLU   3          HG2       GLU   3   9.880   3.856  -2.284
   26   2HG   GLU   3          HG1       GLU   3   8.311   4.265  -1.589
   27    H    SER   4           HN       SER   4   6.493   0.218  -2.684
   28    HA   SER   4           HA       SER   4   6.438  -0.828  -5.241
   29   1HB   SER   4          HB2       SER   4   5.414  -2.835  -4.245
   30   2HB   SER   4          HB1       SER   4   6.730  -2.215  -3.249
   31    HG   SER   4           HG       SER   4   4.617  -2.809  -2.211
   32    H    SER   5           HN       SER   5   3.821   0.667  -3.460
   33    HA   SER   5           HA       SER   5   1.639  -0.343  -4.937
   34   1HB   SER   5          HB2       SER   5   1.074   0.762  -2.972
   35   2HB   SER   5          HB1       SER   5   2.096   2.148  -3.330
   36    HG   SER   5           HG       SER   5   0.511   3.049  -4.398
   37    H    GLU   6           HN       GLU   6   3.173   2.858  -5.235
   38    HA   GLU   6           HA       GLU   6   1.904   3.510  -7.660
   39   1HB   GLU   6          HB2       GLU   6   4.395   4.572  -6.331
   40   2HB   GLU   6          HB1       GLU   6   3.765   5.236  -7.832
   41   1HG   GLU   6          HG2       GLU   6   3.041   6.563  -5.934
   42   2HG   GLU   6          HG1       GLU   6   1.662   5.788  -6.712
   43    H    LEU   7           HN       LEU   7   4.922   1.905  -6.901
   44    HA   LEU   7           HA       LEU   7   5.995   1.858  -9.510
   45   1HB   LEU   7          HB2       LEU   7   6.419   0.019  -7.160
   46   2HB   LEU   7          HB1       LEU   7   7.319  -0.107  -8.659
   47    HG   LEU   7           HG       LEU   7   7.330   2.261  -6.786
   48   1HD1  LEU   7          HD11      LEU   7   8.522   0.303  -5.920
   49   2HD1  LEU   7          HD12      LEU   7   9.625   1.618  -6.325
   50   3HD1  LEU   7          HD13      LEU   7   9.472   0.232  -7.404
   51   1HD2  LEU   7          HD21      LEU   7   7.910   3.393  -8.630
   52   2HD2  LEU   7          HD22      LEU   7   8.200   1.921  -9.557
   53   3HD2  LEU   7          HD23      LEU   7   9.451   2.548  -8.484
   54    H    THR   8           HN       THR   8   3.874  -0.476  -7.770
   55    HA   THR   8           HA       THR   8   3.902  -2.367  -9.910
   56    HB   THR   8           HB       THR   8   1.740  -3.221  -8.831
   57    HG1  THR   8           HG1      THR   8   2.554  -1.530  -6.692
   58   1HG2  THR   8          HG21      THR   8   2.946  -4.448  -7.250
   59   2HG2  THR   8          HG22      THR   8   4.053  -3.114  -6.925
   60   3HG2  THR   8          HG23      THR   8   4.159  -3.997  -8.448
   61    H    LEU   9           HN       LEU   9   1.614   0.235  -9.081
   62    HA   LEU   9           HA       LEU   9  -0.268  -0.311 -11.117
   63   1HB   LEU   9          HB2       LEU   9   0.404   2.440 -10.098
   64   2HB   LEU   9          HB1       LEU   9  -1.133   1.862 -10.715
   65    HG   LEU   9           HG       LEU   9   0.127   0.859  -8.179
   66   1HD1  LEU   9          HD11      LEU   9  -2.184   2.766  -8.311
   67   2HD1  LEU   9          HD12      LEU   9  -0.519   3.348  -8.272
   68   3HD1  LEU   9          HD13      LEU   9  -1.145   2.372  -6.942
   69   1HD2  LEU   9          HD21      LEU   9  -1.507  -0.627  -9.321
   70   2HD2  LEU   9          HD22      LEU   9  -2.714   0.650  -9.171
   71   3HD2  LEU   9          HD23      LEU   9  -2.032  -0.093  -7.724
   72    H    GLN  10           HN       GLN  10   2.497   1.903 -11.007
   73    HA   GLN  10           HA       GLN  10   2.285   2.888 -13.640
   74   1HB   GLN  10          HB2       GLN  10   3.606   4.050 -12.021
   75   2HB   GLN  10          HB1       GLN  10   4.598   2.634 -11.721
   76   1HG   GLN  10          HG2       GLN  10   5.558   2.825 -13.950
   77   2HG   GLN  10          HG1       GLN  10   4.536   4.224 -14.276
   78   1HE2  GLN  10          HE21      GLN  10   5.245   4.469 -11.122
   79   2HE2  GLN  10          HE22      GLN  10   6.664   5.450 -11.201
   80    H    GLU  11           HN       GLU  11   3.803   0.039 -12.265
   81    HA   GLU  11           HA       GLU  11   5.277  -0.756 -14.573
   82   1HB   GLU  11          HB2       GLU  11   5.691  -1.571 -12.255
   83   2HB   GLU  11          HB1       GLU  11   4.175  -2.454 -12.323
   84   1HG   GLU  11          HG2       GLU  11   5.061  -3.810 -14.159
   85   2HG   GLU  11          HG1       GLU  11   6.591  -2.937 -14.049
   86    H    LEU  12           HN       LEU  12   2.122  -1.754 -13.269
   87    HA   LEU  12           HA       LEU  12   1.454  -3.535 -15.354
   88   1HB   LEU  12          HB2       LEU  12  -0.370  -1.908 -13.578
   89   2HB   LEU  12          HB1       LEU  12  -0.869  -3.267 -14.564
   90    HG   LEU  12           HG       LEU  12   1.094  -3.442 -12.278
   91   1HD1  LEU  12          HD11      LEU  12  -1.099  -2.874 -11.439
   92   2HD1  LEU  12          HD12      LEU  12  -0.747  -4.567 -11.086
   93   3HD1  LEU  12          HD13      LEU  12  -1.833  -4.150 -12.412
   94   1HD2  LEU  12          HD21      LEU  12   1.343  -5.135 -14.086
   95   2HD2  LEU  12          HD22      LEU  12  -0.321  -5.634 -13.787
   96   3HD2  LEU  12          HD23      LEU  12   0.896  -5.819 -12.524
   97    H    LEU  13           HN       LEU  13   0.500  -0.135 -14.802
   98    HA   LEU  13           HA       LEU  13  -0.569   0.015 -17.505
   99   1HB   LEU  13          HB2       LEU  13  -0.539   1.929 -15.191
  100   2HB   LEU  13          HB1       LEU  13  -1.045   2.431 -16.793
  101    HG   LEU  13           HG       LEU  13  -2.699   0.456 -16.658
  102   1HD1  LEU  13          HD11      LEU  13  -1.995  -0.731 -14.769
  103   2HD1  LEU  13          HD12      LEU  13  -3.450   0.118 -14.247
  104   3HD1  LEU  13          HD13      LEU  13  -1.861   0.731 -13.791
  105   1HD2  LEU  13          HD21      LEU  13  -4.223   2.051 -16.357
  106   2HD2  LEU  13          HD22      LEU  13  -2.876   3.152 -16.067
  107   3HD2  LEU  13          HD23      LEU  13  -3.678   2.364 -14.709
  108    H    GLY  14           HN       GLY  14   2.144  -0.482 -17.512
  109   1HA   GLY  14          HA2       GLY  14   3.076   1.877 -18.962
  110   2HA   GLY  14          HA1       GLY  14   4.055   1.376 -17.593
  111    H    GLU  15           HN       GLU  15   4.236  -1.280 -17.738
  112    HA   GLU  15           HA       GLU  15   5.345  -1.759 -20.429
  113   1HB   GLU  15          HB2       GLU  15   6.350  -2.603 -17.720
  114   2HB   GLU  15          HB1       GLU  15   6.882  -3.401 -19.196
  115   1HG   GLU  15          HG2       GLU  15   7.801  -1.367 -20.046
  116   2HG   GLU  15          HG1       GLU  15   7.107  -0.442 -18.717
  117    H    GLU  16           HN       GLU  16   3.450  -3.166 -17.799
  118    HA   GLU  16           HA       GLU  16   3.274  -5.802 -18.720
  119   1HB   GLU  16          HB2       GLU  16   2.434  -5.119 -16.529
  120   2HB   GLU  16          HB1       GLU  16   1.185  -4.144 -17.286
  121   1HG   GLU  16          HG2       GLU  16   1.104  -6.917 -18.147
  122   2HG   GLU  16          HG1       GLU  16   0.931  -6.740 -16.402
  123    H    ARG  17           HN       ARG  17   1.218  -3.000 -19.502
  124    HA   ARG  17           HA       ARG  17   0.139  -4.525 -21.784
  125   1HB   ARG  17          HB2       ARG  17  -1.550  -2.506 -21.767
  126   2HB   ARG  17          HB1       ARG  17  -1.763  -3.855 -20.662
  127   1HG   ARG  17          HG2       ARG  17  -0.307  -2.341 -19.073
  128   2HG   ARG  17          HG1       ARG  17  -0.930  -1.059 -20.112
  129   1HD   ARG  17          HD2       ARG  17  -2.438  -1.235 -18.296
  130   2HD   ARG  17          HD1       ARG  17  -3.236  -1.994 -19.675
  131    HE   ARG  17           HE       ARG  17  -1.872  -4.009 -18.314
  132   1HH1  ARG  17          HH11      ARG  17  -4.527  -1.835 -17.742
  133   2HH1  ARG  17          HH12      ARG  17  -5.266  -2.866 -16.572
  134   1HH2  ARG  17          HH21      ARG  17  -2.792  -5.316 -16.781
  135   2HH2  ARG  17          HH22      ARG  17  -4.292  -4.837 -16.030
  136    H    ARG  18           HN       ARG  18   2.681  -3.545 -22.029
  137    HA   ARG  18           HA       ARG  18   2.773  -0.940 -23.195
  138   1HB   ARG  18          HB2       ARG  18   4.679  -2.182 -22.066
  139   2HB   ARG  18          HB1       ARG  18   4.812  -3.139 -23.533
  140   1HG   ARG  18          HG2       ARG  18   4.908  -0.169 -23.718
  141   2HG   ARG  18          HG1       ARG  18   6.326  -1.050 -23.155
  142   1HD   ARG  18          HD2       ARG  18   6.525  -2.239 -25.182
  143   2HD   ARG  18          HD1       ARG  18   4.908  -1.773 -25.706
  144    HE   ARG  18           HE       ARG  18   7.329  -0.223 -25.933
  145   1HH1  ARG  18          HH11      ARG  18   3.850  -0.221 -26.053
  146   2HH1  ARG  18          HH12      ARG  18   3.790   1.320 -26.864
  147   1HH2  ARG  18          HH21      ARG  18   7.219   1.758 -26.978
  148   2HH2  ARG  18          HH22      ARG  18   5.680   2.426 -27.385
  Start of MODEL   19
    1   1H    ILE   1          HT1       ILE   1   0.494   6.288   2.390
    2   2H    ILE   1          HT2       ILE   1   1.822   5.278   2.670
    3   3H    ILE   1          HT3       ILE   1   0.296   4.856   3.271
    4    HA   ILE   1           HA       ILE   1  -0.195   3.772   1.433
    5    HB   ILE   1           HB       ILE   1   0.557   6.322  -0.024
    6   1HG1  ILE   1          HG12      ILE   1  -2.046   6.364  -0.247
    7   2HG1  ILE   1          HG11      ILE   1  -2.009   5.277   1.135
    8   1HG2  ILE   1          HG21      ILE   1  -1.087   4.036  -1.090
    9   2HG2  ILE   1          HG22      ILE   1   0.622   4.279  -1.455
   10   3HG2  ILE   1          HG23      ILE   1  -0.566   5.483  -1.955
   11   1HD1  ILE   1          HD11      ILE   1  -1.028   8.109   0.987
   12   2HD1  ILE   1          HD12      ILE   1  -0.652   7.027   2.328
   13   3HD1  ILE   1          HD13      ILE   1  -2.328   7.452   1.981
   14    HA   PRO   2           HA       PRO   2   3.761   2.003   0.349
   15   1HB   PRO   2          HB2       PRO   2   2.287   0.189  -1.416
   16   2HB   PRO   2          HB1       PRO   2   3.191  -0.173   0.056
   17   1HG   PRO   2          HG2       PRO   2   0.501  -0.320  -0.049
   18   2HG   PRO   2          HG1       PRO   2   1.367   0.166   1.420
   19   1HD   PRO   2          HD2       PRO   2  -0.029   1.875  -0.610
   20   2HD   PRO   2          HD1       PRO   2  -0.040   1.997   1.163
   21    H    GLU   3           HN       GLU   3   3.606   4.269  -0.990
   22    HA   GLU   3           HA       GLU   3   3.322   4.054  -3.815
   23   1HB   GLU   3          HB2       GLU   3   4.725   6.158  -2.155
   24   2HB   GLU   3          HB1       GLU   3   4.282   6.324  -3.849
   25   1HG   GLU   3          HG2       GLU   3   1.965   6.297  -3.335
   26   2HG   GLU   3          HG1       GLU   3   2.276   5.813  -1.670
   27    H    SER   4           HN       SER   4   4.796   1.994  -3.602
   28    HA   SER   4           HA       SER   4   7.299   2.689  -4.887
   29   1HB   SER   4          HB2       SER   4   8.674   1.280  -3.355
   30   2HB   SER   4          HB1       SER   4   8.024   2.716  -2.567
   31    HG   SER   4           HG       SER   4   7.839   0.441  -1.563
   32    H    SER   5           HN       SER   5   5.782  -0.131  -3.294
   33    HA   SER   5           HA       SER   5   6.590  -1.920  -5.390
   34   1HB   SER   5          HB2       SER   5   4.555  -2.338  -3.184
   35   2HB   SER   5          HB1       SER   5   5.242  -3.599  -4.206
   36    HG   SER   5           HG       SER   5   6.655  -3.701  -2.642
   37    H    GLU   6           HN       GLU   6   3.427  -0.705  -4.311
   38    HA   GLU   6           HA       GLU   6   1.923  -1.754  -6.446
   39   1HB   GLU   6          HB2       GLU   6   1.412   0.640  -4.671
   40   2HB   GLU   6          HB1       GLU   6   0.228  -0.046  -5.771
   41   1HG   GLU   6          HG2       GLU   6   1.482  -1.425  -3.407
   42   2HG   GLU   6          HG1       GLU   6  -0.167  -0.810  -3.511
   43    H    LEU   7           HN       LEU   7   3.644   1.263  -5.990
   44    HA   LEU   7           HA       LEU   7   2.760   2.650  -8.268
   45   1HB   LEU   7          HB2       LEU   7   4.223   3.388  -6.212
   46   2HB   LEU   7          HB1       LEU   7   5.563   2.906  -7.231
   47    HG   LEU   7           HG       LEU   7   5.077   5.345  -7.276
   48   1HD1  LEU   7          HD11      LEU   7   4.686   5.253  -9.952
   49   2HD1  LEU   7          HD12      LEU   7   5.241   3.610  -9.634
   50   3HD1  LEU   7          HD13      LEU   7   6.238   4.985  -9.158
   51   1HD2  LEU   7          HD21      LEU   7   2.423   4.428  -7.656
   52   2HD2  LEU   7          HD22      LEU   7   2.893   5.352  -9.083
   53   3HD2  LEU   7          HD23      LEU   7   3.003   6.084  -7.482
   54    H    THR   8           HN       THR   8   5.578   0.502  -7.764
   55    HA   THR   8           HA       THR   8   6.540   0.648 -10.429
   56    HB   THR   8           HB       THR   8   6.870  -1.709  -8.573
   57    HG1  THR   8           HG1      THR   8   7.644   0.082  -7.451
   58   1HG2  THR   8          HG21      THR   8   7.662  -1.364 -11.199
   59   2HG2  THR   8          HG22      THR   8   8.322  -2.535 -10.057
   60   3HG2  THR   8          HG23      THR   8   9.109  -0.970 -10.269
   61    H    LEU   9           HN       LEU   9   4.326  -1.610  -8.787
   62    HA   LEU   9           HA       LEU   9   3.937  -3.405 -10.910
   63   1HB   LEU   9          HB2       LEU   9   3.139  -3.875  -8.664
   64   2HB   LEU   9          HB1       LEU   9   2.032  -2.518  -8.739
   65    HG   LEU   9           HG       LEU   9   0.816  -3.674 -10.580
   66   1HD1  LEU   9          HD11      LEU   9   1.255  -6.181 -10.695
   67   2HD1  LEU   9          HD12      LEU   9   2.816  -5.825  -9.956
   68   3HD1  LEU   9          HD13      LEU   9   2.399  -5.124 -11.520
   69   1HD2  LEU   9          HD21      LEU   9   0.563  -3.969  -7.906
   70   2HD2  LEU   9          HD22      LEU   9   0.764  -5.650  -8.401
   71   3HD2  LEU   9          HD23      LEU   9  -0.537  -4.678  -9.088
   72    H    GLN  10           HN       GLN  10   2.165  -0.466 -10.015
   73    HA   GLN  10           HA       GLN  10   0.291  -0.448 -12.109
   74   1HB   GLN  10          HB2       GLN  10  -0.004   0.994 -10.212
   75   2HB   GLN  10          HB1       GLN  10   1.547   1.771 -10.487
   76   1HG   GLN  10          HG2       GLN  10   0.668   2.721 -12.580
   77   2HG   GLN  10          HG1       GLN  10  -0.899   1.994 -12.225
   78   1HE2  GLN  10          HE21      GLN  10  -2.269   3.437 -11.498
   79   2HE2  GLN  10          HE22      GLN  10  -1.908   4.749 -10.436
   80    H    GLU  11           HN       GLU  11   3.553   0.861 -11.847
   81    HA   GLU  11           HA       GLU  11   3.644   2.161 -14.364
   82   1HB   GLU  11          HB2       GLU  11   5.153   2.650 -12.493
   83   2HB   GLU  11          HB1       GLU  11   5.888   1.067 -12.663
   84   1HG   GLU  11          HG2       GLU  11   6.763   1.665 -14.824
   85   2HG   GLU  11          HG1       GLU  11   5.923   3.217 -14.766
   86    H    LEU  12           HN       LEU  12   4.835  -1.043 -13.267
   87    HA   LEU  12           HA       LEU  12   5.886  -1.887 -15.739
   88   1HB   LEU  12          HB2       LEU  12   4.587  -3.527 -13.559
   89   2HB   LEU  12          HB1       LEU  12   5.508  -4.198 -14.891
   90    HG   LEU  12           HG       LEU  12   6.593  -2.368 -12.754
   91   1HD1  LEU  12          HD11      LEU  12   5.955  -4.871 -12.291
   92   2HD1  LEU  12          HD12      LEU  12   7.473  -4.199 -11.695
   93   3HD1  LEU  12          HD13      LEU  12   7.459  -5.188 -13.156
   94   1HD2  LEU  12          HD21      LEU  12   8.629  -3.721 -14.163
   95   2HD2  LEU  12          HD22      LEU  12   8.297  -1.989 -14.127
   96   3HD2  LEU  12          HD23      LEU  12   7.557  -3.004 -15.366
   97    H    LEU  13           HN       LEU  13   2.655  -2.403 -14.337
   98    HA   LEU  13           HA       LEU  13   1.518  -3.746 -16.533
   99   1HB   LEU  13          HB2       LEU  13   0.519  -3.588 -14.260
  100   2HB   LEU  13          HB1       LEU  13   0.139  -1.906 -14.573
  101    HG   LEU  13           HG       LEU  13  -1.347  -2.608 -16.425
  102   1HD1  LEU  13          HD11      LEU  13  -0.079  -4.804 -16.753
  103   2HD1  LEU  13          HD12      LEU  13  -1.836  -4.846 -16.893
  104   3HD1  LEU  13          HD13      LEU  13  -1.056  -5.420 -15.420
  105   1HD2  LEU  13          HD21      LEU  13  -3.116  -3.555 -14.998
  106   2HD2  LEU  13          HD22      LEU  13  -2.288  -2.197 -14.235
  107   3HD2  LEU  13          HD23      LEU  13  -1.918  -3.848 -13.737
  108    H    GLY  14           HN       GLY  14   2.027  -0.346 -15.869
  109   1HA   GLY  14          HA2       GLY  14   0.395   0.746 -17.910
  110   2HA   GLY  14          HA1       GLY  14   1.762   1.547 -17.145
  111    H    GLU  15           HN       GLU  15   3.876  -0.077 -17.822
  112    HA   GLU  15           HA       GLU  15   4.338   0.679 -20.538
  113   1HB   GLU  15          HB2       GLU  15   6.185   0.465 -18.908
  114   2HB   GLU  15          HB1       GLU  15   5.916  -1.273 -18.843
  115   1HG   GLU  15          HG2       GLU  15   6.433  -1.414 -21.250
  116   2HG   GLU  15          HG1       GLU  15   6.776   0.313 -21.256
  117    H    GLU  16           HN       GLU  16   3.479  -2.361 -18.974
  118    HA   GLU  16           HA       GLU  16   3.718  -4.045 -21.214
  119   1HB   GLU  16          HB2       GLU  16   1.925  -4.219 -18.788
  120   2HB   GLU  16          HB1       GLU  16   2.102  -5.511 -19.967
  121   1HG   GLU  16          HG2       GLU  16   4.365  -5.854 -19.395
  122   2HG   GLU  16          HG1       GLU  16   4.433  -4.354 -18.473
  123    H    ARG  17           HN       ARG  17   1.084  -1.966 -20.104
  124    HA   ARG  17           HA       ARG  17  -0.783  -2.922 -22.082
  125   1HB   ARG  17          HB2       ARG  17  -0.806  -0.666 -20.108
  126   2HB   ARG  17          HB1       ARG  17  -2.069  -0.823 -21.320
  127   1HG   ARG  17          HG2       ARG  17  -2.755  -2.926 -20.445
  128   2HG   ARG  17          HG1       ARG  17  -1.351  -3.002 -19.376
  129   1HD   ARG  17          HD2       ARG  17  -3.491  -0.884 -19.238
  130   2HD   ARG  17          HD1       ARG  17  -3.453  -2.330 -18.228
  131    HE   ARG  17           HE       ARG  17  -1.000  -1.146 -17.891
  132   1HH1  ARG  17          HH11      ARG  17  -4.289  -0.153 -17.457
  133   2HH1  ARG  17          HH12      ARG  17  -3.930   0.858 -16.102
  134   1HH2  ARG  17          HH21      ARG  17  -0.535   0.161 -16.126
  135   2HH2  ARG  17          HH22      ARG  17  -1.806   1.035 -15.352
  136    H    ARG  18           HN       ARG  18   1.556  -2.110 -23.423
  137    HA   ARG  18           HA       ARG  18   1.375   0.525 -24.469
  138   1HB   ARG  18          HB2       ARG  18   2.800  -1.963 -25.315
  139   2HB   ARG  18          HB1       ARG  18   2.713  -0.606 -26.431
  140   1HG   ARG  18          HG2       ARG  18   3.801  -0.464 -23.629
  141   2HG   ARG  18          HG1       ARG  18   4.775  -0.627 -25.092
  142   1HD   ARG  18          HD2       ARG  18   4.230   1.514 -25.840
  143   2HD   ARG  18          HD1       ARG  18   2.814   1.620 -24.795
  144    HE   ARG  18           HE       ARG  18   5.485   2.351 -24.133
  145   1HH1  ARG  18          HH11      ARG  18   2.513   1.165 -22.841
  146   2HH1  ARG  18          HH12      ARG  18   2.876   1.632 -21.216
  147   1HH2  ARG  18          HH21      ARG  18   5.965   2.987 -22.021
  148   2HH2  ARG  18          HH22      ARG  18   4.834   2.663 -20.757
  Start of MODEL   20
    1   1H    ILE   1          HT1       ILE   1   8.029   3.843   4.164
    2   2H    ILE   1          HT2       ILE   1   9.256   2.902   4.852
    3   3H    ILE   1          HT3       ILE   1   7.788   3.104   5.668
    4    HA   ILE   1           HA       ILE   1   8.300   0.939   4.309
    5    HB   ILE   1           HB       ILE   1   5.616   2.335   4.222
    6   1HG1  ILE   1          HG12      ILE   1   6.521   2.272   6.496
    7   2HG1  ILE   1          HG11      ILE   1   5.156   1.172   6.341
    8   1HG2  ILE   1          HG21      ILE   1   6.492  -0.310   3.401
    9   2HG2  ILE   1          HG22      ILE   1   4.980   0.535   3.072
   10   3HG2  ILE   1          HG23      ILE   1   5.179  -0.363   4.577
   11   1HD1  ILE   1          HD11      ILE   1   8.059   0.547   6.643
   12   2HD1  ILE   1          HD12      ILE   1   6.957  -0.629   5.926
   13   3HD1  ILE   1          HD13      ILE   1   6.682  -0.048   7.568
   14    HA   PRO   2           HA       PRO   2   8.791   1.974  -0.013
   15   1HB   PRO   2          HB2       PRO   2   8.670  -0.898  -0.538
   16   2HB   PRO   2          HB1       PRO   2  10.028   0.214  -0.717
   17   1HG   PRO   2          HG2       PRO   2   9.948  -1.689   1.203
   18   2HG   PRO   2          HG1       PRO   2  10.768  -0.133   1.430
   19   1HD   PRO   2          HD2       PRO   2   8.077  -1.021   2.404
   20   2HD   PRO   2          HD1       PRO   2   9.327  -0.078   3.245
   21    H    GLU   3           HN       GLU   3   6.292   2.555   0.507
   22    HA   GLU   3           HA       GLU   3   4.349   0.787  -0.632
   23   1HB   GLU   3          HB2       GLU   3   4.191   3.710   0.112
   24   2HB   GLU   3          HB1       GLU   3   2.816   2.741  -0.397
   25   1HG   GLU   3          HG2       GLU   3   4.523   2.095   1.992
   26   2HG   GLU   3          HG1       GLU   3   3.043   3.049   2.067
   27    H    SER   4           HN       SER   4   6.173   0.907  -2.588
   28    HA   SER   4           HA       SER   4   5.341   2.914  -4.548
   29   1HB   SER   4          HB2       SER   4   7.157   1.997  -5.941
   30   2HB   SER   4          HB1       SER   4   7.740   2.438  -4.336
   31    HG   SER   4           HG       SER   4   7.327  -0.110  -5.449
   32    H    SER   5           HN       SER   5   3.746   0.472  -3.566
   33    HA   SER   5           HA       SER   5   3.445  -1.389  -5.634
   34   1HB   SER   5          HB2       SER   5   1.321  -0.423  -3.712
   35   2HB   SER   5          HB1       SER   5   1.297  -1.936  -4.615
   36    HG   SER   5           HG       SER   5   2.237  -1.647  -2.249
   37    H    GLU   6           HN       GLU   6   1.763   1.672  -5.044
   38    HA   GLU   6           HA       GLU   6  -0.095   1.551  -7.143
   39   1HB   GLU   6          HB2       GLU   6  -0.060   3.209  -5.259
   40   2HB   GLU   6          HB1       GLU   6   1.278   4.017  -6.056
   41   1HG   GLU   6          HG2       GLU   6  -0.147   4.475  -7.987
   42   2HG   GLU   6          HG1       GLU   6  -1.494   3.676  -7.176
   43    H    LEU   7           HN       LEU   7   3.170   2.852  -6.974
   44    HA   LEU   7           HA       LEU   7   3.370   3.839  -9.600
   45   1HB   LEU   7          HB2       LEU   7   4.912   4.354  -7.708
   46   2HB   LEU   7          HB1       LEU   7   5.582   2.746  -7.864
   47    HG   LEU   7           HG       LEU   7   6.320   3.300 -10.163
   48   1HD1  LEU   7          HD11      LEU   7   6.322   6.080 -10.159
   49   2HD1  LEU   7          HD12      LEU   7   4.686   5.630  -9.678
   50   3HD1  LEU   7          HD13      LEU   7   5.360   5.020 -11.189
   51   1HD2  LEU   7          HD21      LEU   7   7.937   5.219  -9.288
   52   2HD2  LEU   7          HD22      LEU   7   8.098   3.541  -8.770
   53   3HD2  LEU   7          HD23      LEU   7   7.273   4.708  -7.736
   54    H    THR   8           HN       THR   8   4.410   0.722  -8.190
   55    HA   THR   8           HA       THR   8   5.382  -0.357 -10.616
   56    HB   THR   8           HB       THR   8   5.140  -2.591  -9.514
   57    HG1  THR   8           HG1      THR   8   3.297  -1.934  -8.174
   58   1HG2  THR   8          HG21      THR   8   6.464  -1.293  -7.351
   59   2HG2  THR   8          HG22      THR   8   6.832  -0.426  -8.842
   60   3HG2  THR   8          HG23      THR   8   7.168  -2.153  -8.720
   61    H    LEU   9           HN       LEU   9   2.183  -0.584  -9.071
   62    HA   LEU   9           HA       LEU   9   1.020  -2.384 -10.904
   63   1HB   LEU   9          HB2       LEU   9  -0.015  -1.858  -8.777
   64   2HB   LEU   9          HB1       LEU   9  -0.218  -0.183  -9.252
   65    HG   LEU   9           HG       LEU   9  -1.726  -1.042 -11.115
   66   1HD1  LEU   9          HD11      LEU   9  -2.782  -3.236 -10.653
   67   2HD1  LEU   9          HD12      LEU   9  -1.540  -3.536  -9.437
   68   3HD1  LEU   9          HD13      LEU   9  -1.089  -3.353 -11.132
   69   1HD2  LEU   9          HD21      LEU   9  -3.471  -0.545  -9.803
   70   2HD2  LEU   9          HD22      LEU   9  -2.243  -0.231  -8.577
   71   3HD2  LEU   9          HD23      LEU   9  -3.068  -1.790  -8.620
   72    H    GLN  10           HN       GLN  10   1.000   1.166 -10.806
   73    HA   GLN  10           HA       GLN  10  -0.491   1.640 -13.130
   74   1HB   GLN  10          HB2       GLN  10   0.183   3.281 -11.321
   75   2HB   GLN  10          HB1       GLN  10   1.763   3.350 -12.079
   76   1HG   GLN  10          HG2       GLN  10   0.600   5.229 -12.854
   77   2HG   GLN  10          HG1       GLN  10   0.572   4.077 -14.188
   78   1HE2  GLN  10          HE21      GLN  10  -1.263   6.130 -12.316
   79   2HE2  GLN  10          HE22      GLN  10  -2.830   5.528 -12.724
   80    H    GLU  11           HN       GLU  11   2.976   1.129 -12.650
   81    HA   GLU  11           HA       GLU  11   3.770   1.668 -15.333
   82   1HB   GLU  11          HB2       GLU  11   5.375   1.824 -13.552
   83   2HB   GLU  11          HB1       GLU  11   5.087   0.159 -13.073
   84   1HG   GLU  11          HG2       GLU  11   6.034  -0.572 -15.245
   85   2HG   GLU  11          HG1       GLU  11   6.427   1.112 -15.592
   86    H    LEU  12           HN       LEU  12   3.292  -1.412 -13.575
   87    HA   LEU  12           HA       LEU  12   3.858  -3.130 -15.717
   88   1HB   LEU  12          HB2       LEU  12   1.939  -3.558 -13.424
   89   2HB   LEU  12          HB1       LEU  12   2.548  -4.818 -14.478
   90    HG   LEU  12           HG       LEU  12   4.245  -3.133 -12.640
   91   1HD1  LEU  12          HD11      LEU  12   4.376  -5.015 -11.198
   92   2HD1  LEU  12          HD12      LEU  12   3.510  -6.037 -12.346
   93   3HD1  LEU  12          HD13      LEU  12   2.665  -4.728 -11.517
   94   1HD2  LEU  12          HD21      LEU  12   5.020  -5.643 -14.106
   95   2HD2  LEU  12          HD22      LEU  12   6.064  -4.516 -13.240
   96   3HD2  LEU  12          HD23      LEU  12   5.306  -4.028 -14.755
   97    H    LEU  13           HN       LEU  13   0.752  -1.781 -14.632
   98    HA   LEU  13           HA       LEU  13  -0.603  -2.921 -16.938
   99   1HB   LEU  13          HB2       LEU  13  -1.506  -1.386 -14.535
  100   2HB   LEU  13          HB1       LEU  13  -2.562  -1.537 -15.928
  101    HG   LEU  13           HG       LEU  13  -2.202  -4.055 -15.722
  102   1HD1  LEU  13          HD11      LEU  13  -1.857  -4.489 -13.107
  103   2HD1  LEU  13          HD12      LEU  13  -0.802  -3.090 -13.311
  104   3HD1  LEU  13          HD13      LEU  13  -0.539  -4.542 -14.278
  105   1HD2  LEU  13          HD21      LEU  13  -4.049  -2.305 -14.587
  106   2HD2  LEU  13          HD22      LEU  13  -3.651  -3.450 -13.307
  107   3HD2  LEU  13          HD23      LEU  13  -4.248  -4.036 -14.859
  108    H    GLY  14           HN       GLY  14   1.435  -1.138 -17.596
  109   1HA   GLY  14          HA2       GLY  14  -0.124   0.807 -19.128
  110   2HA   GLY  14          HA1       GLY  14   1.142   1.440 -18.090
  111    H    GLU  15           HN       GLU  15   3.312   0.051 -18.433
  112    HA   GLU  15           HA       GLU  15   4.134   0.667 -21.080
  113   1HB   GLU  15          HB2       GLU  15   5.499  -0.689 -18.774
  114   2HB   GLU  15          HB1       GLU  15   6.289  -0.499 -20.336
  115   1HG   GLU  15          HG2       GLU  15   5.183   1.756 -18.673
  116   2HG   GLU  15          HG1       GLU  15   6.881   1.280 -18.745
  117    H    GLU  16           HN       GLU  16   3.708  -2.498 -19.461
  118    HA   GLU  16           HA       GLU  16   4.315  -3.922 -21.891
  119   1HB   GLU  16          HB2       GLU  16   4.770  -4.882 -19.649
  120   2HB   GLU  16          HB1       GLU  16   3.039  -4.949 -19.345
  121   1HG   GLU  16          HG2       GLU  16   2.732  -6.558 -21.092
  122   2HG   GLU  16          HG1       GLU  16   4.411  -6.392 -21.601
  123    H    ARG  17           HN       ARG  17   1.539  -2.584 -20.401
  124    HA   ARG  17           HA       ARG  17  -0.491  -4.098 -21.678
  125   1HB   ARG  17          HB2       ARG  17  -0.911  -2.868 -19.642
  126   2HB   ARG  17          HB1       ARG  17  -0.488  -1.354 -20.422
  127   1HG   ARG  17          HG2       ARG  17  -2.452  -1.567 -21.875
  128   2HG   ARG  17          HG1       ARG  17  -2.882  -3.070 -21.048
  129   1HD   ARG  17          HD2       ARG  17  -3.107  -1.896 -18.952
  130   2HD   ARG  17          HD1       ARG  17  -2.552  -0.398 -19.694
  131    HE   ARG  17           HE       ARG  17  -4.831  -1.316 -21.051
  132   1HH1  ARG  17          HH11      ARG  17  -3.856   0.042 -18.025
  133   2HH1  ARG  17          HH12      ARG  17  -5.395   0.777 -17.721
  134   1HH2  ARG  17          HH21      ARG  17  -6.821  -0.349 -20.670
  135   2HH2  ARG  17          HH22      ARG  17  -7.068   0.557 -19.220
  136    H    ARG  18           HN       ARG  18   1.034  -0.972 -22.451
  137    HA   ARG  18           HA       ARG  18  -0.598  -0.471 -24.743
  138   1HB   ARG  18          HB2       ARG  18   0.961   1.367 -25.196
  139   2HB   ARG  18          HB1       ARG  18   0.459   1.353 -23.511
  140   1HG   ARG  18          HG2       ARG  18   2.576   0.246 -22.916
  141   2HG   ARG  18          HG1       ARG  18   3.079   0.348 -24.603
  142   1HD   ARG  18          HD2       ARG  18   2.886   2.807 -24.478
  143   2HD   ARG  18          HD1       ARG  18   2.467   2.667 -22.771
  144    HE   ARG  18           HE       ARG  18   4.697   2.495 -22.310
  145   1HH1  ARG  18          HH11      ARG  18   4.189   1.532 -25.611
  146   2HH1  ARG  18          HH12      ARG  18   5.861   1.222 -25.901
  147   1HH2  ARG  18          HH21      ARG  18   6.867   2.066 -22.682
  148   2HH2  ARG  18          HH22      ARG  18   7.369   1.535 -24.266
  Start of MODEL   21
    1   1H    ILE   1          HT1       ILE   1   3.347   3.983   3.382
    2   2H    ILE   1          HT2       ILE   1   1.816   3.568   2.794
    3   3H    ILE   1          HT3       ILE   1   2.541   5.019   2.312
    4    HA   ILE   1           HA       ILE   1   4.046   2.594   1.786
    5    HB   ILE   1           HB       ILE   1   1.834   1.822   1.179
    6   1HG1  ILE   1          HG12      ILE   1   3.341   2.657  -1.310
    7   2HG1  ILE   1          HG11      ILE   1   3.713   1.246  -0.325
    8   1HG2  ILE   1          HG21      ILE   1   1.218   3.670  -0.954
    9   2HG2  ILE   1          HG22      ILE   1   1.304   4.486   0.607
   10   3HG2  ILE   1          HG23      ILE   1   0.214   3.117   0.386
   11   1HD1  ILE   1          HD11      ILE   1   0.957   1.186  -1.088
   12   2HD1  ILE   1          HD12      ILE   1   2.244   0.034  -1.444
   13   3HD1  ILE   1          HD13      ILE   1   1.974   1.412  -2.511
   14    HA   PRO   2           HA       PRO   2   6.442   5.768  -0.197
   15   1HB   PRO   2          HB2       PRO   2   7.422   3.557  -1.917
   16   2HB   PRO   2          HB1       PRO   2   8.331   4.684  -0.905
   17   1HG   PRO   2          HG2       PRO   2   8.012   2.143  -0.169
   18   2HG   PRO   2          HG1       PRO   2   7.966   3.454   1.025
   19   1HD   PRO   2          HD2       PRO   2   5.706   1.907  -0.183
   20   2HD   PRO   2          HD1       PRO   2   5.923   2.467   1.489
   21    H    GLU   3           HN       GLU   3   6.131   7.104  -1.891
   22    HA   GLU   3           HA       GLU   3   3.991   6.872  -3.627
   23   1HB   GLU   3          HB2       GLU   3   6.485   8.463  -4.209
   24   2HB   GLU   3          HB1       GLU   3   4.856   8.794  -4.776
   25   1HG   GLU   3          HG2       GLU   3   5.788   8.949  -1.918
   26   2HG   GLU   3          HG1       GLU   3   5.533  10.317  -2.998
   27    H    SER   4           HN       SER   4   7.371   6.090  -4.216
   28    HA   SER   4           HA       SER   4   7.203   5.530  -6.956
   29   1HB   SER   4          HB2       SER   4   9.310   4.270  -6.642
   30   2HB   SER   4          HB1       SER   4   9.346   5.847  -5.855
   31    HG   SER   4           HG       SER   4  10.025   3.741  -4.693
   32    H    SER   5           HN       SER   5   6.487   3.497  -4.172
   33    HA   SER   5           HA       SER   5   6.475   0.997  -5.441
   34   1HB   SER   5          HB2       SER   5   6.377   1.196  -3.038
   35   2HB   SER   5          HB1       SER   5   4.800   1.976  -3.126
   36    HG   SER   5           HG       SER   5   4.096   0.000  -2.925
   37    H    GLU   6           HN       GLU   6   3.732   3.231  -4.894
   38    HA   GLU   6           HA       GLU   6   1.839   1.656  -6.282
   39   1HB   GLU   6          HB2       GLU   6   1.894   4.614  -5.687
   40   2HB   GLU   6          HB1       GLU   6   0.524   3.796  -6.425
   41   1HG   GLU   6          HG2       GLU   6   0.530   2.270  -4.402
   42   2HG   GLU   6          HG1       GLU   6   1.653   3.415  -3.673
   43    H    LEU   7           HN       LEU   7   4.034   4.203  -7.313
   44    HA   LEU   7           HA       LEU   7   3.075   4.496  -9.954
   45   1HB   LEU   7          HB2       LEU   7   5.851   4.928  -8.845
   46   2HB   LEU   7          HB1       LEU   7   5.319   5.449 -10.432
   47    HG   LEU   7           HG       LEU   7   4.195   6.431  -7.806
   48   1HD1  LEU   7          HD11      LEU   7   6.153   7.619  -9.753
   49   2HD1  LEU   7          HD12      LEU   7   6.367   7.328  -8.026
   50   3HD1  LEU   7          HD13      LEU   7   5.262   8.587  -8.579
   51   1HD2  LEU   7          HD21      LEU   7   3.042   8.093  -9.204
   52   2HD2  LEU   7          HD22      LEU   7   2.520   6.446  -9.560
   53   3HD2  LEU   7          HD23      LEU   7   3.635   7.272 -10.648
   54    H    THR   8           HN       THR   8   5.464   2.298  -8.506
   55    HA   THR   8           HA       THR   8   6.357   1.167 -10.973
   56    HB   THR   8           HB       THR   8   6.290  -0.331  -8.359
   57    HG1  THR   8           HG1      THR   8   7.253   1.793  -8.063
   58   1HG2  THR   8          HG21      THR   8   8.150  -0.398 -10.733
   59   2HG2  THR   8          HG22      THR   8   6.980  -1.635 -10.275
   60   3HG2  THR   8          HG23      THR   8   8.377  -1.319  -9.247
   61    H    LEU   9           HN       LEU   9   3.770   0.391  -8.722
   62    HA   LEU   9           HA       LEU   9   2.936  -2.078  -9.691
   63   1HB   LEU   9          HB2       LEU   9   2.062  -1.199  -7.644
   64   2HB   LEU   9          HB1       LEU   9   1.383   0.193  -8.465
   65    HG   LEU   9           HG       LEU   9  -0.130  -1.416  -9.699
   66   1HD1  LEU   9          HD11      LEU   9   0.284  -3.378  -7.522
   67   2HD1  LEU   9          HD12      LEU   9   1.457  -3.364  -8.839
   68   3HD1  LEU   9          HD13      LEU   9  -0.254  -3.619  -9.184
   69   1HD2  LEU   9          HD21      LEU   9  -0.382  -1.234  -6.701
   70   2HD2  LEU   9          HD22      LEU   9  -1.690  -1.589  -7.830
   71   3HD2  LEU   9          HD23      LEU   9  -0.899  -0.013  -7.865
   72    H    GLN  10           HN       GLN  10   2.042   1.182 -10.797
   73    HA   GLN  10           HA       GLN  10   0.066   0.416 -12.640
   74   1HB   GLN  10          HB2       GLN  10   0.383   2.741 -11.938
   75   2HB   GLN  10          HB1       GLN  10   1.938   2.785 -12.755
   76   1HG   GLN  10          HG2       GLN  10   0.787   2.388 -14.901
   77   2HG   GLN  10          HG1       GLN  10  -0.757   2.439 -14.054
   78   1HE2  GLN  10          HE21      GLN  10   1.112   4.179 -15.988
   79   2HE2  GLN  10          HE22      GLN  10   0.730   5.776 -15.457
   80    H    GLU  11           HN       GLU  11   3.579   0.758 -13.001
   81    HA   GLU  11           HA       GLU  11   3.593   0.167 -15.795
   82   1HB   GLU  11          HB2       GLU  11   5.471   1.355 -14.843
   83   2HB   GLU  11          HB1       GLU  11   5.799   0.032 -13.731
   84   1HG   GLU  11          HG2       GLU  11   6.430  -1.408 -15.557
   85   2HG   GLU  11          HG1       GLU  11   5.978  -0.173 -16.730
   86    H    LEU  12           HN       LEU  12   4.324  -1.781 -12.881
   87    HA   LEU  12           HA       LEU  12   4.866  -4.195 -14.216
   88   1HB   LEU  12          HB2       LEU  12   3.621  -3.802 -11.495
   89   2HB   LEU  12          HB1       LEU  12   4.330  -5.295 -12.079
   90    HG   LEU  12           HG       LEU  12   5.811  -2.710 -11.599
   91   1HD1  LEU  12          HD11      LEU  12   5.817  -3.389  -9.481
   92   2HD1  LEU  12          HD12      LEU  12   6.872  -4.702 -10.006
   93   3HD1  LEU  12          HD13      LEU  12   5.130  -4.958  -9.901
   94   1HD2  LEU  12          HD21      LEU  12   6.506  -4.552 -13.431
   95   2HD2  LEU  12          HD22      LEU  12   7.254  -5.253 -11.996
   96   3HD2  LEU  12          HD23      LEU  12   7.674  -3.616 -12.499
   97    H    LEU  13           HN       LEU  13   1.781  -3.078 -12.786
   98    HA   LEU  13           HA       LEU  13   0.394  -5.249 -14.190
   99   1HB   LEU  13          HB2       LEU  13  -0.006  -4.787 -11.749
  100   2HB   LEU  13          HB1       LEU  13  -0.742  -3.267 -12.218
  101    HG   LEU  13           HG       LEU  13  -2.462  -4.515 -13.489
  102   1HD1  LEU  13          HD11      LEU  13  -2.339  -7.064 -12.412
  103   2HD1  LEU  13          HD12      LEU  13  -0.683  -6.722 -12.914
  104   3HD1  LEU  13          HD13      LEU  13  -2.000  -6.607 -14.081
  105   1HD2  LEU  13          HD21      LEU  13  -2.988  -3.815 -11.257
  106   2HD2  LEU  13          HD22      LEU  13  -2.152  -5.209 -10.573
  107   3HD2  LEU  13          HD23      LEU  13  -3.634  -5.437 -11.501
  108    H    GLY  14           HN       GLY  14   1.366  -3.394 -15.951
  109   1HA   GLY  14          HA2       GLY  14  -1.072  -2.477 -17.186
  110   2HA   GLY  14          HA1       GLY  14  -0.063  -1.161 -16.611
  111    H    GLU  15           HN       GLU  15   2.455  -1.812 -17.265
  112    HA   GLU  15           HA       GLU  15   2.446  -1.512 -20.115
  113   1HB   GLU  15          HB2       GLU  15   4.086  -0.410 -18.571
  114   2HB   GLU  15          HB1       GLU  15   4.827  -1.983 -18.312
  115   1HG   GLU  15          HG2       GLU  15   6.092  -0.722 -19.931
  116   2HG   GLU  15          HG1       GLU  15   5.349  -2.122 -20.703
  117    H    GLU  16           HN       GLU  16   3.290  -4.145 -17.910
  118    HA   GLU  16           HA       GLU  16   4.257  -5.900 -19.956
  119   1HB   GLU  16          HB2       GLU  16   4.866  -6.040 -17.526
  120   2HB   GLU  16          HB1       GLU  16   3.236  -6.607 -17.196
  121   1HG   GLU  16          HG2       GLU  16   3.639  -8.562 -18.619
  122   2HG   GLU  16          HG1       GLU  16   5.281  -7.995 -18.916
  123    H    ARG  17           HN       ARG  17   1.310  -4.677 -19.598
  124    HA   ARG  17           HA       ARG  17   0.011  -6.959 -20.876
  125   1HB   ARG  17          HB2       ARG  17  -1.789  -7.078 -19.404
  126   2HB   ARG  17          HB1       ARG  17  -0.428  -6.820 -18.321
  127   1HG   ARG  17          HG2       ARG  17  -0.980  -4.435 -18.212
  128   2HG   ARG  17          HG1       ARG  17  -2.358  -4.715 -19.275
  129   1HD   ARG  17          HD2       ARG  17  -3.446  -6.058 -17.641
  130   2HD   ARG  17          HD1       ARG  17  -2.001  -6.107 -16.630
  131    HE   ARG  17           HE       ARG  17  -2.622  -4.107 -15.735
  132   1HH1  ARG  17          HH11      ARG  17  -4.307  -4.488 -18.741
  133   2HH1  ARG  17          HH12      ARG  17  -5.175  -3.005 -18.572
  134   1HH2  ARG  17          HH21      ARG  17  -3.711  -2.181 -15.544
  135   2HH2  ARG  17          HH22      ARG  17  -4.834  -1.698 -16.768
  136    H    ARG  18           HN       ARG  18   1.034  -4.303 -21.744
  137    HA   ARG  18           HA       ARG  18  -1.185  -2.590 -22.254
  138   1HB   ARG  18          HB2       ARG  18   0.318  -1.417 -23.812
  139   2HB   ARG  18          HB1       ARG  18   1.077  -1.699 -22.252
  140   1HG   ARG  18          HG2       ARG  18   2.615  -3.130 -23.100
  141   2HG   ARG  18          HG1       ARG  18   1.533  -3.726 -24.354
  142   1HD   ARG  18          HD2       ARG  18   3.241  -2.500 -25.452
  143   2HD   ARG  18          HD1       ARG  18   1.791  -1.502 -25.494
  144    HE   ARG  18           HE       ARG  18   3.319  -0.801 -23.222
  145   1HH1  ARG  18          HH11      ARG  18   3.336  -0.535 -26.686
  146   2HH1  ARG  18          HH12      ARG  18   4.373   0.845 -26.698
  147   1HH2  ARG  18          HH21      ARG  18   4.704   0.958 -23.228
  148   2HH2  ARG  18          HH22      ARG  18   5.145   1.693 -24.747
  Start of MODEL   22
    1   1H    ILE   1          HT1       ILE   1  11.409   6.959  -0.988
    2   2H    ILE   1          HT2       ILE   1  11.008   8.082  -2.189
    3   3H    ILE   1          HT3       ILE   1  10.907   6.424  -2.515
    4    HA   ILE   1           HA       ILE   1   9.344   7.414  -0.274
    5    HB   ILE   1           HB       ILE   1   8.893   9.178  -1.823
    6   1HG1  ILE   1          HG12      ILE   1   6.465   8.700  -2.447
    7   2HG1  ILE   1          HG11      ILE   1   6.715   7.093  -1.773
    8   1HG2  ILE   1          HG21      ILE   1   7.849   8.444  -4.116
    9   2HG2  ILE   1          HG22      ILE   1   8.832   7.005  -3.845
   10   3HG2  ILE   1          HG23      ILE   1   9.594   8.594  -3.909
   11   1HD1  ILE   1          HD11      ILE   1   7.092   7.970   0.393
   12   2HD1  ILE   1          HD12      ILE   1   5.648   8.759  -0.242
   13   3HD1  ILE   1          HD13      ILE   1   7.187   9.620  -0.221
   14    HA   PRO   2           HA       PRO   2   8.245   3.111  -0.873
   15   1HB   PRO   2          HB2       PRO   2   6.428   3.453   1.380
   16   2HB   PRO   2          HB1       PRO   2   7.909   2.499   1.278
   17   1HG   PRO   2          HG2       PRO   2   7.714   4.744   2.781
   18   2HG   PRO   2          HG1       PRO   2   9.228   4.227   2.018
   19   1HD   PRO   2          HD2       PRO   2   7.274   6.318   1.125
   20   2HD   PRO   2          HD1       PRO   2   9.050   6.367   1.137
   21    H    GLU   3           HN       GLU   3   6.995   4.449  -2.786
   22    HA   GLU   3           HA       GLU   3   4.229   4.830  -2.582
   23   1HB   GLU   3          HB2       GLU   3   5.824   4.035  -5.019
   24   2HB   GLU   3          HB1       GLU   3   4.204   4.719  -5.034
   25   1HG   GLU   3          HG2       GLU   3   5.038   6.779  -4.062
   26   2HG   GLU   3          HG1       GLU   3   6.659   6.095  -3.967
   27    H    SER   4           HN       SER   4   6.073   1.977  -3.452
   28    HA   SER   4           HA       SER   4   5.578  -0.216  -3.746
   29   1HB   SER   4          HB2       SER   4   4.087  -1.227  -2.063
   30   2HB   SER   4          HB1       SER   4   5.206  -0.073  -1.345
   31    HG   SER   4           HG       SER   4   3.297   1.455  -1.692
   32    H    SER   5           HN       SER   5   2.214   0.484  -2.977
   33    HA   SER   5           HA       SER   5   1.135  -1.061  -5.019
   34   1HB   SER   5          HB2       SER   5  -0.133   1.343  -3.697
   35   2HB   SER   5          HB1       SER   5  -0.986   0.052  -4.541
   36    HG   SER   5           HG       SER   5  -0.031   0.124  -1.991
   37    H    GLU   6           HN       GLU   6   1.667   2.464  -4.963
   38    HA   GLU   6           HA       GLU   6   0.554   3.055  -7.463
   39   1HB   GLU   6          HB2       GLU   6   2.836   4.423  -6.027
   40   2HB   GLU   6          HB1       GLU   6   1.973   5.092  -7.404
   41   1HG   GLU   6          HG2       GLU   6   0.757   4.430  -4.731
   42   2HG   GLU   6          HG1       GLU   6   1.216   6.039  -5.282
   43    H    LEU   7           HN       LEU   7   3.863   2.146  -6.592
   44    HA   LEU   7           HA       LEU   7   4.990   2.393  -9.169
   45   1HB   LEU   7          HB2       LEU   7   5.798   0.642  -6.845
   46   2HB   LEU   7          HB1       LEU   7   6.777   0.910  -8.274
   47    HG   LEU   7           HG       LEU   7   5.942   3.059  -6.324
   48   1HD1  LEU   7          HD11      LEU   7   7.500   1.543  -5.279
   49   2HD1  LEU   7          HD12      LEU   7   8.325   3.050  -5.679
   50   3HD1  LEU   7          HD13      LEU   7   8.566   1.620  -6.683
   51   1HD2  LEU   7          HD21      LEU   7   7.695   4.371  -7.539
   52   2HD2  LEU   7          HD22      LEU   7   6.251   4.016  -8.487
   53   3HD2  LEU   7          HD23      LEU   7   7.729   3.089  -8.750
   54    H    THR   8           HN       THR   8   3.567  -0.376  -7.451
   55    HA   THR   8           HA       THR   8   4.064  -2.294  -9.486
   56    HB   THR   8           HB       THR   8   1.691  -2.456  -7.653
   57    HG1  THR   8           HG1      THR   8   3.471  -1.892  -6.314
   58   1HG2  THR   8          HG21      THR   8   1.725  -4.677  -8.073
   59   2HG2  THR   8          HG22      THR   8   3.486  -4.747  -8.126
   60   3HG2  THR   8          HG23      THR   8   2.583  -4.172  -9.528
   61    H    LEU   9           HN       LEU   9   1.240  -0.281  -8.726
   62    HA   LEU   9           HA       LEU   9  -0.536  -1.208 -10.670
   63   1HB   LEU   9          HB2       LEU   9  -1.226   0.270  -8.887
   64   2HB   LEU   9          HB1       LEU   9  -0.185   1.546  -9.487
   65    HG   LEU   9           HG       LEU   9  -1.605   1.531 -11.593
   66   1HD1  LEU   9          HD11      LEU   9  -2.813  -0.427 -11.590
   67   2HD1  LEU   9          HD12      LEU   9  -4.004   0.722 -10.981
   68   3HD1  LEU   9          HD13      LEU   9  -3.153  -0.343  -9.862
   69   1HD2  LEU   9          HD21      LEU   9  -1.866   2.858  -9.174
   70   2HD2  LEU   9          HD22      LEU   9  -3.506   2.340  -9.565
   71   3HD2  LEU   9          HD23      LEU   9  -2.594   3.319 -10.713
   72    H    GLN  10           HN       GLN  10   1.881   1.379 -10.856
   73    HA   GLN  10           HA       GLN  10   1.342   2.287 -13.447
   74   1HB   GLN  10          HB2       GLN  10   2.772   3.514 -11.918
   75   2HB   GLN  10          HB1       GLN  10   3.945   2.206 -11.915
   76   1HG   GLN  10          HG2       GLN  10   4.331   2.604 -14.325
   77   2HG   GLN  10          HG1       GLN  10   3.234   3.981 -14.238
   78   1HE2  GLN  10          HE21      GLN  10   4.212   5.853 -14.034
   79   2HE2  GLN  10          HE22      GLN  10   5.727   6.132 -13.257
   80    H    GLU  11           HN       GLU  11   3.466  -0.326 -12.328
   81    HA   GLU  11           HA       GLU  11   4.467  -0.918 -14.945
   82   1HB   GLU  11          HB2       GLU  11   5.755  -1.468 -12.930
   83   2HB   GLU  11          HB1       GLU  11   4.505  -2.600 -12.431
   84   1HG   GLU  11          HG2       GLU  11   4.952  -3.996 -14.354
   85   2HG   GLU  11          HG1       GLU  11   6.135  -2.835 -14.952
   86    H    LEU  12           HN       LEU  12   2.065  -2.498 -12.809
   87    HA   LEU  12           HA       LEU  12   1.373  -4.579 -14.572
   88   1HB   LEU  12          HB2       LEU  12  -0.372  -3.181 -12.545
   89   2HB   LEU  12          HB1       LEU  12  -0.731  -4.723 -13.297
   90    HG   LEU  12           HG       LEU  12   1.590  -4.155 -11.457
   91   1HD1  LEU  12          HD11      LEU  12  -0.333  -4.207 -10.124
   92   2HD1  LEU  12          HD12      LEU  12   0.312  -5.846 -10.033
   93   3HD1  LEU  12          HD13      LEU  12  -1.066  -5.497 -11.077
   94   1HD2  LEU  12          HD21      LEU  12   1.174  -6.232 -13.380
   95   2HD2  LEU  12          HD22      LEU  12   1.126  -6.916 -11.755
   96   3HD2  LEU  12          HD23      LEU  12   2.532  -5.990 -12.281
   97    H    LEU  13           HN       LEU  13  -0.109  -1.363 -14.164
   98    HA   LEU  13           HA       LEU  13  -1.762  -1.853 -16.529
   99   1HB   LEU  13          HB2       LEU  13  -1.829   0.176 -14.339
  100   2HB   LEU  13          HB1       LEU  13  -2.612   0.532 -15.868
  101    HG   LEU  13           HG       LEU  13  -3.883  -1.637 -15.583
  102   1HD1  LEU  13          HD11      LEU  13  -3.413  -1.470 -12.667
  103   2HD1  LEU  13          HD12      LEU  13  -2.170  -2.248 -13.646
  104   3HD1  LEU  13          HD13      LEU  13  -3.825  -2.856 -13.676
  105   1HD2  LEU  13          HD21      LEU  13  -4.505   0.261 -13.357
  106   2HD2  LEU  13          HD22      LEU  13  -5.604  -0.577 -14.454
  107   3HD2  LEU  13          HD23      LEU  13  -4.638   0.779 -15.038
  108    H    GLY  14           HN       GLY  14   0.899  -1.702 -17.070
  109   1HA   GLY  14          HA2       GLY  14   0.944   0.528 -18.929
  110   2HA   GLY  14          HA1       GLY  14   2.207   0.555 -17.708
  111    H    GLU  15           HN       GLU  15   3.907  -0.890 -17.828
  112    HA   GLU  15           HA       GLU  15   4.562  -1.861 -20.411
  113   1HB   GLU  15          HB2       GLU  15   5.862  -2.356 -17.729
  114   2HB   GLU  15          HB1       GLU  15   6.537  -2.895 -19.262
  115   1HG   GLU  15          HG2       GLU  15   6.568  -0.530 -20.016
  116   2HG   GLU  15          HG1       GLU  15   6.040  -0.053 -18.405
  117    H    GLU  16           HN       GLU  16   3.110  -3.395 -17.608
  118    HA   GLU  16           HA       GLU  16   3.364  -6.026 -18.818
  119   1HB   GLU  16          HB2       GLU  16   2.303  -5.021 -16.211
  120   2HB   GLU  16          HB1       GLU  16   1.817  -6.615 -16.784
  121   1HG   GLU  16          HG2       GLU  16   4.633  -5.660 -16.313
  122   2HG   GLU  16          HG1       GLU  16   3.728  -6.813 -15.329
  123    H    ARG  17           HN       ARG  17   0.990  -3.507 -18.504
  124    HA   ARG  17           HA       ARG  17  -1.291  -5.013 -19.293
  125   1HB   ARG  17          HB2       ARG  17  -1.324  -2.784 -18.124
  126   2HB   ARG  17          HB1       ARG  17  -0.823  -2.047 -19.638
  127   1HG   ARG  17          HG2       ARG  17  -2.993  -3.437 -20.455
  128   2HG   ARG  17          HG1       ARG  17  -3.452  -3.041 -18.796
  129   1HD   ARG  17          HD2       ARG  17  -4.225  -1.263 -20.174
  130   2HD   ARG  17          HD1       ARG  17  -2.814  -0.662 -19.299
  131    HE   ARG  17           HE       ARG  17  -2.122  -1.759 -21.851
  132   1HH1  ARG  17          HH11      ARG  17  -3.325   1.096 -20.284
  133   2HH1  ARG  17          HH12      ARG  17  -2.847   2.131 -21.581
  134   1HH2  ARG  17          HH21      ARG  17  -1.530  -0.470 -23.488
  135   2HH2  ARG  17          HH22      ARG  17  -1.813   1.249 -23.403
  136    H    ARG  18           HN       ARG  18   0.849  -2.760 -21.037
  137    HA   ARG  18           HA       ARG  18   1.348  -2.468 -23.234
  138   1HB   ARG  18          HB2       ARG  18   0.628  -5.388 -23.509
  139   2HB   ARG  18          HB1       ARG  18   1.730  -4.462 -24.527
  140   1HG   ARG  18          HG2       ARG  18   3.354  -4.325 -22.854
  141   2HG   ARG  18          HG1       ARG  18   2.205  -4.753 -21.588
  142   1HD   ARG  18          HD2       ARG  18   2.015  -7.010 -22.790
  143   2HD   ARG  18          HD1       ARG  18   3.490  -6.530 -23.631
  144    HE   ARG  18           HE       ARG  18   3.958  -6.147 -20.924
  145   1HH1  ARG  18          HH11      ARG  18   3.261  -8.781 -23.052
  146   2HH1  ARG  18          HH12      ARG  18   4.050  -9.953 -22.059
  147   1HH2  ARG  18          HH21      ARG  18   4.970  -7.683 -19.597
  148   2HH2  ARG  18          HH22      ARG  18   5.006  -9.333 -20.122
  Start of MODEL   23
    1   1H    ILE   1          HT1       ILE   1   7.330   4.860   2.054
    2   2H    ILE   1          HT2       ILE   1   7.683   3.553   3.073
    3   3H    ILE   1          HT3       ILE   1   6.985   4.957   3.710
    4    HA   ILE   1           HA       ILE   1   5.258   3.367   3.558
    5    HB   ILE   1           HB       ILE   1   5.070   5.215   1.168
    6   1HG1  ILE   1          HG12      ILE   1   5.696   6.463   3.172
    7   2HG1  ILE   1          HG11      ILE   1   4.039   6.834   2.710
    8   1HG2  ILE   1          HG21      ILE   1   3.315   3.426   1.378
    9   2HG2  ILE   1          HG22      ILE   1   2.717   5.085   1.340
   10   3HG2  ILE   1          HG23      ILE   1   2.807   4.215   2.871
   11   1HD1  ILE   1          HD11      ILE   1   3.290   5.184   4.437
   12   2HD1  ILE   1          HD12      ILE   1   4.097   6.619   5.067
   13   3HD1  ILE   1          HD13      ILE   1   4.968   5.089   4.972
   14    HA   PRO   2           HA       PRO   2   5.939   0.023   0.676
   15   1HB   PRO   2          HB2       PRO   2   3.493  -1.174   0.771
   16   2HB   PRO   2          HB1       PRO   2   4.700  -1.322   2.052
   17   1HG   PRO   2          HG2       PRO   2   2.298   0.450   1.906
   18   2HG   PRO   2          HG1       PRO   2   2.936  -0.463   3.285
   19   1HD   PRO   2          HD2       PRO   2   3.335   2.201   2.969
   20   2HD   PRO   2          HD1       PRO   2   4.507   1.147   3.779
   21    H    GLU   3           HN       GLU   3   5.651   2.295  -0.696
   22    HA   GLU   3           HA       GLU   3   3.426   2.482  -2.440
   23   1HB   GLU   3          HB2       GLU   3   6.238   3.539  -2.771
   24   2HB   GLU   3          HB1       GLU   3   4.821   4.082  -3.662
   25   1HG   GLU   3          HG2       GLU   3   4.014   5.287  -1.927
   26   2HG   GLU   3          HG1       GLU   3   4.656   4.181  -0.714
   27    H    SER   4           HN       SER   4   5.759   0.131  -2.345
   28    HA   SER   4           HA       SER   4   6.555  -0.296  -4.975
   29   1HB   SER   4          HB2       SER   4   6.760  -2.708  -4.300
   30   2HB   SER   4          HB1       SER   4   7.542  -1.579  -3.194
   31    HG   SER   4           HG       SER   4   6.042  -3.358  -2.370
   32    H    SER   5           HN       SER   5   3.530  -1.122  -3.375
   33    HA   SER   5           HA       SER   5   2.462  -2.781  -5.402
   34   1HB   SER   5          HB2       SER   5   0.969  -1.002  -3.466
   35   2HB   SER   5          HB1       SER   5   0.296  -2.356  -4.371
   36    HG   SER   5           HG       SER   5   1.698  -2.357  -2.045
   37    H    GLU   6           HN       GLU   6   2.236   0.704  -4.799
   38    HA   GLU   6           HA       GLU   6   0.547   1.300  -7.002
   39   1HB   GLU   6          HB2       GLU   6   0.972   2.802  -5.029
   40   2HB   GLU   6          HB1       GLU   6   2.572   3.115  -5.676
   41   1HG   GLU   6          HG2       GLU   6   1.575   4.073  -7.690
   42   2HG   GLU   6          HG1       GLU   6  -0.033   3.765  -7.037
   43    H    LEU   7           HN       LEU   7   4.040   1.373  -6.485
   44    HA   LEU   7           HA       LEU   7   4.814   2.299  -9.020
   45   1HB   LEU   7          HB2       LEU   7   6.288   0.503  -7.097
   46   2HB   LEU   7          HB1       LEU   7   7.015   1.270  -8.495
   47    HG   LEU   7           HG       LEU   7   5.833   2.706  -6.116
   48   1HD1  LEU   7          HD11      LEU   7   8.520   1.728  -6.778
   49   2HD1  LEU   7          HD12      LEU   7   7.803   2.118  -5.215
   50   3HD1  LEU   7          HD13      LEU   7   8.446   3.404  -6.236
   51   1HD2  LEU   7          HD21      LEU   7   7.373   3.862  -8.435
   52   2HD2  LEU   7          HD22      LEU   7   6.596   4.735  -7.114
   53   3HD2  LEU   7          HD23      LEU   7   5.613   3.891  -8.311
   54    H    THR   8           HN       THR   8   4.369  -1.067  -7.850
   55    HA   THR   8           HA       THR   8   5.227  -2.259 -10.283
   56    HB   THR   8           HB       THR   8   3.885  -4.276  -9.485
   57    HG1  THR   8           HG1      THR   8   3.721  -2.812  -7.054
   58   1HG2  THR   8          HG21      THR   8   5.969  -3.106  -7.643
   59   2HG2  THR   8          HG22      THR   8   6.286  -4.036  -9.107
   60   3HG2  THR   8          HG23      THR   8   5.504  -4.805  -7.725
   61    H    LEU   9           HN       LEU   9   2.024  -1.300  -9.092
   62    HA   LEU   9           HA       LEU   9   0.555  -2.284 -11.309
   63   1HB   LEU   9          HB2       LEU   9  -0.602  -1.701  -9.288
   64   2HB   LEU   9          HB1       LEU   9   0.006  -0.057  -9.347
   65    HG   LEU   9           HG       LEU   9  -1.311   0.269 -11.456
   66   1HD1  LEU   9          HD11      LEU   9  -3.080  -1.981 -10.799
   67   2HD1  LEU   9          HD12      LEU   9  -1.525  -2.429 -11.498
   68   3HD1  LEU   9          HD13      LEU   9  -2.598  -1.331 -12.366
   69   1HD2  LEU   9          HD21      LEU   9  -3.465   0.504 -10.290
   70   2HD2  LEU   9          HD22      LEU   9  -2.114   1.117  -9.335
   71   3HD2  LEU   9          HD23      LEU   9  -2.828  -0.450  -8.951
   72    H    GLN  10           HN       GLN  10   1.960   0.871 -10.555
   73    HA   GLN  10           HA       GLN  10   1.155   2.322 -12.804
   74   1HB   GLN  10          HB2       GLN  10   2.157   3.250 -10.743
   75   2HB   GLN  10          HB1       GLN  10   3.702   2.554 -11.193
   76   1HG   GLN  10          HG2       GLN  10   3.756   3.996 -13.176
   77   2HG   GLN  10          HG1       GLN  10   2.221   4.712 -12.675
   78   1HE2  GLN  10          HE21      GLN  10   2.365   6.508 -11.531
   79   2HE2  GLN  10          HE22      GLN  10   3.723   7.009 -10.592
   80    H    GLU  11           HN       GLU  11   4.099   0.400 -12.263
   81    HA   GLU  11           HA       GLU  11   5.321   0.915 -14.765
   82   1HB   GLU  11          HB2       GLU  11   6.461  -0.015 -12.742
   83   2HB   GLU  11          HB1       GLU  11   5.626  -1.536 -13.017
   84   1HG   GLU  11          HG2       GLU  11   6.756  -1.793 -15.152
   85   2HG   GLU  11          HG1       GLU  11   7.564  -0.242 -14.922
   86    H    LEU  12           HN       LEU  12   3.243  -1.712 -13.627
   87    HA   LEU  12           HA       LEU  12   3.212  -3.289 -15.944
   88   1HB   LEU  12          HB2       LEU  12   2.366  -4.308 -14.038
   89   2HB   LEU  12          HB1       LEU  12   1.400  -2.917 -13.595
   90    HG   LEU  12           HG       LEU  12  -0.109  -3.471 -15.545
   91   1HD1  LEU  12          HD11      LEU  12   1.625  -4.931 -16.665
   92   2HD1  LEU  12          HD12      LEU  12  -0.013  -5.579 -16.583
   93   3HD1  LEU  12          HD13      LEU  12   1.222  -6.161 -15.466
   94   1HD2  LEU  12          HD21      LEU  12  -0.590  -4.011 -13.170
   95   2HD2  LEU  12          HD22      LEU  12   0.119  -5.604 -13.432
   96   3HD2  LEU  12          HD23      LEU  12  -1.330  -5.127 -14.317
   97    H    LEU  13           HN       LEU  13   0.961  -0.733 -14.896
   98    HA   LEU  13           HA       LEU  13  -0.717  -0.898 -17.163
   99   1HB   LEU  13          HB2       LEU  13  -1.390   0.106 -15.036
  100   2HB   LEU  13          HB1       LEU  13  -0.239   1.405 -15.275
  101    HG   LEU  13           HG       LEU  13  -1.526   2.083 -17.314
  102   1HD1  LEU  13          HD11      LEU  13  -3.637   1.187 -17.798
  103   2HD1  LEU  13          HD12      LEU  13  -3.705   0.302 -16.274
  104   3HD1  LEU  13          HD13      LEU  13  -2.595  -0.214 -17.545
  105   1HD2  LEU  13          HD21      LEU  13  -2.232   3.550 -15.795
  106   2HD2  LEU  13          HD22      LEU  13  -2.301   2.324 -14.529
  107   3HD2  LEU  13          HD23      LEU  13  -3.665   2.536 -15.626
  108    H    GLY  14           HN       GLY  14   2.033   1.248 -16.449
  109   1HA   GLY  14          HA2       GLY  14   1.699   2.789 -18.831
  110   2HA   GLY  14          HA1       GLY  14   3.055   2.860 -17.733
  111    H    GLU  15           HN       GLU  15   4.453   0.633 -17.969
  112    HA   GLU  15           HA       GLU  15   5.257   0.714 -20.767
  113   1HB   GLU  15          HB2       GLU  15   6.921   1.082 -18.992
  114   2HB   GLU  15          HB1       GLU  15   6.647  -0.553 -18.407
  115   1HG   GLU  15          HG2       GLU  15   7.476  -1.468 -20.493
  116   2HG   GLU  15          HG1       GLU  15   7.685   0.157 -21.143
  117    H    GLU  16           HN       GLU  16   4.515  -1.841 -18.381
  118    HA   GLU  16           HA       GLU  16   4.924  -3.983 -20.156
  119   1HB   GLU  16          HB2       GLU  16   4.831  -4.184 -17.690
  120   2HB   GLU  16          HB1       GLU  16   3.097  -3.903 -17.752
  121   1HG   GLU  16          HG2       GLU  16   2.728  -5.946 -18.909
  122   2HG   GLU  16          HG1       GLU  16   4.456  -6.187 -19.155
  123    H    ARG  17           HN       ARG  17   1.908  -2.308 -19.269
  124    HA   ARG  17           HA       ARG  17   0.394  -3.869 -21.191
  125   1HB   ARG  17          HB2       ARG  17  -0.570  -3.284 -19.016
  126   2HB   ARG  17          HB1       ARG  17  -0.437  -1.576 -19.409
  127   1HG   ARG  17          HG2       ARG  17  -1.952  -2.051 -21.376
  128   2HG   ARG  17          HG1       ARG  17  -2.245  -3.628 -20.638
  129   1HD   ARG  17          HD2       ARG  17  -3.523  -2.764 -18.991
  130   2HD   ARG  17          HD1       ARG  17  -2.514  -1.326 -18.825
  131    HE   ARG  17           HE       ARG  17  -4.923  -1.507 -20.265
  132   1HH1  ARG  17          HH11      ARG  17  -1.799  -0.063 -20.362
  133   2HH1  ARG  17          HH12      ARG  17  -2.215   1.114 -21.576
  134   1HH2  ARG  17          HH21      ARG  17  -5.525   0.082 -21.767
  135   2HH2  ARG  17          HH22      ARG  17  -4.346   1.222 -22.310
  136    H    ARG  18           HN       ARG  18   1.036  -0.364 -20.748
  137    HA   ARG  18           HA       ARG  18   1.218   1.372 -22.201
  138   1HB   ARG  18          HB2       ARG  18   1.476  -0.769 -24.315
  139   2HB   ARG  18          HB1       ARG  18   1.754   0.946 -24.581
  140   1HG   ARG  18          HG2       ARG  18   3.597   0.908 -22.998
  141   2HG   ARG  18          HG1       ARG  18   3.303  -0.803 -22.684
  142   1HD   ARG  18          HD2       ARG  18   4.235   0.471 -25.251
  143   2HD   ARG  18          HD1       ARG  18   5.123  -0.648 -24.220
  144    HE   ARG  18           HE       ARG  18   3.372  -1.340 -26.306
  145   1HH1  ARG  18          HH11      ARG  18   4.216  -2.328 -23.092
  146   2HH1  ARG  18          HH12      ARG  18   3.675  -3.956 -23.328
  147   1HH2  ARG  18          HH21      ARG  18   2.707  -3.461 -26.620
  148   2HH2  ARG  18          HH22      ARG  18   2.845  -4.596 -25.324
  Start of MODEL   24
    1   1H    ILE   1          HT1       ILE   1   6.314   7.169   0.179
    2   2H    ILE   1          HT2       ILE   1   6.327   7.875   1.730
    3   3H    ILE   1          HT3       ILE   1   5.575   8.676   0.442
    4    HA   ILE   1           HA       ILE   1   4.516   6.746   2.226
    5    HB   ILE   1           HB       ILE   1   2.365   7.424   1.203
    6   1HG1  ILE   1          HG12      ILE   1   3.995   9.274  -0.532
    7   2HG1  ILE   1          HG11      ILE   1   3.378   7.725  -1.106
    8   1HG2  ILE   1          HG21      ILE   1   4.143   8.998   2.689
    9   2HG2  ILE   1          HG22      ILE   1   2.390   9.174   2.584
   10   3HG2  ILE   1          HG23      ILE   1   3.438  10.078   1.489
   11   1HD1  ILE   1          HD11      ILE   1   1.485   9.660   0.120
   12   2HD1  ILE   1          HD12      ILE   1   1.213   8.445  -1.129
   13   3HD1  ILE   1          HD13      ILE   1   2.061   9.940  -1.523
   14    HA   PRO   2           HA       PRO   2   4.098   2.708   0.558
   15   1HB   PRO   2          HB2       PRO   2   1.307   3.571  -0.054
   16   2HB   PRO   2          HB1       PRO   2   1.888   2.109   0.748
   17   1HG   PRO   2          HG2       PRO   2   1.029   4.491   2.003
   18   2HG   PRO   2          HG1       PRO   2   1.810   3.106   2.781
   19   1HD   PRO   2          HD2       PRO   2   2.910   5.664   2.579
   20   2HD   PRO   2          HD1       PRO   2   3.838   4.180   2.880
   21    H    GLU   3           HN       GLU   3   5.536   3.512  -1.214
   22    HA   GLU   3           HA       GLU   3   4.476   4.325  -3.711
   23   1HB   GLU   3          HB2       GLU   3   7.132   3.076  -2.987
   24   2HB   GLU   3          HB1       GLU   3   6.747   3.715  -4.577
   25   1HG   GLU   3          HG2       GLU   3   7.890   5.469  -3.676
   26   2HG   GLU   3          HG1       GLU   3   6.238   5.907  -3.255
   27    H    SER   4           HN       SER   4   4.613   1.331  -2.140
   28    HA   SER   4           HA       SER   4   5.013  -0.583  -4.058
   29   1HB   SER   4          HB2       SER   4   3.411  -2.012  -2.734
   30   2HB   SER   4          HB1       SER   4   4.675  -1.238  -1.779
   31    HG   SER   4           HG       SER   4   2.284  -1.140  -1.115
   32    H    SER   5           HN       SER   5   1.895   1.052  -3.407
   33    HA   SER   5           HA       SER   5   0.435  -0.380  -5.365
   34   1HB   SER   5          HB2       SER   5  -0.081   2.351  -4.196
   35   2HB   SER   5          HB1       SER   5  -1.225   1.447  -5.186
   36    HG   SER   5           HG       SER   5  -1.763   0.370  -3.472
   37    H    GLU   6           HN       GLU   6   2.077   2.776  -5.503
   38    HA   GLU   6           HA       GLU   6   1.297   3.366  -8.164
   39   1HB   GLU   6          HB2       GLU   6   3.488   4.386  -6.380
   40   2HB   GLU   6          HB1       GLU   6   3.377   4.900  -8.059
   41   1HG   GLU   6          HG2       GLU   6   1.063   5.671  -7.608
   42   2HG   GLU   6          HG1       GLU   6   1.312   5.280  -5.905
   43    H    LEU   7           HN       LEU   7   4.200   1.879  -6.776
   44    HA   LEU   7           HA       LEU   7   5.600   1.574  -9.199
   45   1HB   LEU   7          HB2       LEU   7   5.736   0.031  -6.618
   46   2HB   LEU   7          HB1       LEU   7   6.838  -0.230  -7.954
   47    HG   LEU   7           HG       LEU   7   6.522   2.332  -6.395
   48   1HD1  LEU   7          HD11      LEU   7   8.707   0.263  -6.495
   49   2HD1  LEU   7          HD12      LEU   7   7.682   0.661  -5.115
   50   3HD1  LEU   7          HD13      LEU   7   8.856   1.834  -5.715
   51   1HD2  LEU   7          HD21      LEU   7   7.253   3.257  -8.303
   52   2HD2  LEU   7          HD22      LEU   7   7.767   1.709  -8.975
   53   3HD2  LEU   7          HD23      LEU   7   8.811   2.569  -7.842
   54    H    THR   8           HN       THR   8   3.299  -0.593  -7.527
   55    HA   THR   8           HA       THR   8   3.614  -2.706  -9.432
   56    HB   THR   8           HB       THR   8   1.347  -3.480  -8.543
   57    HG1  THR   8           HG1      THR   8   1.827  -1.580  -6.488
   58   1HG2  THR   8          HG21      THR   8   2.306  -4.344  -6.521
   59   2HG2  THR   8          HG22      THR   8   3.514  -3.060  -6.492
   60   3HG2  THR   8          HG23      THR   8   3.566  -4.292  -7.753
   61    H    LEU   9           HN       LEU   9   1.263  -0.070  -9.071
   62    HA   LEU   9           HA       LEU   9  -0.374  -0.727 -11.258
   63   1HB   LEU   9          HB2       LEU   9  -1.033   0.910  -9.586
   64   2HB   LEU   9          HB1       LEU   9   0.285   1.964 -10.064
   65    HG   LEU   9           HG       LEU   9  -0.798   2.129 -12.333
   66   1HD1  LEU   9          HD11      LEU   9  -3.389   1.688 -12.021
   67   2HD1  LEU   9          HD12      LEU   9  -2.789   0.434 -10.935
   68   3HD1  LEU   9          HD13      LEU   9  -2.295   0.446 -12.628
   69   1HD2  LEU   9          HD21      LEU   9  -0.960   3.892 -10.647
   70   2HD2  LEU   9          HD22      LEU   9  -2.396   3.116  -9.977
   71   3HD2  LEU   9          HD23      LEU   9  -2.431   3.775 -11.613
   72    H    GLN  10           HN       GLN  10   2.427   1.499 -11.072
   73    HA   GLN  10           HA       GLN  10   2.423   2.262 -13.780
   74   1HB   GLN  10          HB2       GLN  10   3.702   3.432 -12.026
   75   2HB   GLN  10          HB1       GLN  10   4.778   2.049 -11.893
   76   1HG   GLN  10          HG2       GLN  10   5.551   2.394 -14.163
   77   2HG   GLN  10          HG1       GLN  10   4.419   3.732 -14.363
   78   1HE2  GLN  10          HE21      GLN  10   5.265   5.649 -14.126
   79   2HE2  GLN  10          HE22      GLN  10   6.639   6.053 -13.162
   80    H    GLU  11           HN       GLU  11   3.966  -0.451 -12.121
   81    HA   GLU  11           HA       GLU  11   5.476  -1.393 -14.322
   82   1HB   GLU  11          HB2       GLU  11   5.901  -2.064 -11.985
   83   2HB   GLU  11          HB1       GLU  11   4.382  -2.946 -11.967
   84   1HG   GLU  11          HG2       GLU  11   5.211  -4.468 -13.656
   85   2HG   GLU  11          HG1       GLU  11   6.711  -3.550 -13.775
   86    H    LEU  12           HN       LEU  12   2.237  -2.319 -13.139
   87    HA   LEU  12           HA       LEU  12   1.761  -4.310 -15.073
   88   1HB   LEU  12          HB2       LEU  12  -0.228  -2.487 -13.709
   89   2HB   LEU  12          HB1       LEU  12  -0.632  -3.952 -14.583
   90    HG   LEU  12           HG       LEU  12   1.062  -3.846 -12.091
   91   1HD1  LEU  12          HD11      LEU  12  -0.967  -3.464 -11.166
   92   2HD1  LEU  12          HD12      LEU  12  -1.125  -5.209 -11.370
   93   3HD1  LEU  12          HD13      LEU  12  -1.844  -4.114 -12.551
   94   1HD2  LEU  12          HD21      LEU  12  -0.200  -6.321 -13.155
   95   2HD2  LEU  12          HD22      LEU  12   1.274  -6.122 -12.209
   96   3HD2  LEU  12          HD23      LEU  12   1.269  -5.728 -13.928
   97    H    LEU  13           HN       LEU  13   0.959  -0.835 -15.081
   98    HA   LEU  13           HA       LEU  13   0.054  -1.002 -17.832
   99   1HB   LEU  13          HB2       LEU  13   0.172   1.208 -15.819
  100   2HB   LEU  13          HB1       LEU  13  -0.098   1.569 -17.515
  101    HG   LEU  13           HG       LEU  13  -2.034  -0.097 -17.389
  102   1HD1  LEU  13          HD11      LEU  13  -1.065  -0.718 -14.961
  103   2HD1  LEU  13          HD12      LEU  13  -2.747  -0.951 -15.434
  104   3HD1  LEU  13          HD13      LEU  13  -2.280   0.479 -14.515
  105   1HD2  LEU  13          HD21      LEU  13  -1.894   2.623 -16.982
  106   2HD2  LEU  13          HD22      LEU  13  -2.857   2.059 -15.617
  107   3HD2  LEU  13          HD23      LEU  13  -3.366   1.690 -17.265
  108    H    GLY  14           HN       GLY  14   2.661  -1.806 -17.597
  109   1HA   GLY  14          HA2       GLY  14   3.930  -0.027 -19.495
  110   2HA   GLY  14          HA1       GLY  14   4.777  -0.155 -17.959
  111    H    GLU  15           HN       GLU  15   4.582  -2.758 -17.287
  112    HA   GLU  15           HA       GLU  15   6.399  -4.030 -19.113
  113   1HB   GLU  15          HB2       GLU  15   6.548  -4.237 -16.639
  114   2HB   GLU  15          HB1       GLU  15   5.034  -5.126 -16.641
  115   1HG   GLU  15          HG2       GLU  15   7.026  -6.555 -16.416
  116   2HG   GLU  15          HG1       GLU  15   6.037  -6.951 -17.821
  117    H    GLU  16           HN       GLU  16   3.091  -4.772 -18.013
  118    HA   GLU  16           HA       GLU  16   2.791  -6.939 -19.864
  119   1HB   GLU  16          HB2       GLU  16   1.577  -6.636 -17.628
  120   2HB   GLU  16          HB1       GLU  16   0.552  -5.478 -18.465
  121   1HG   GLU  16          HG2       GLU  16  -0.241  -7.163 -19.965
  122   2HG   GLU  16          HG1       GLU  16   0.911  -8.334 -19.331
  123    H    ARG  17           HN       ARG  17   1.784  -3.552 -19.747
  124    HA   ARG  17           HA       ARG  17   0.435  -3.687 -22.308
  125   1HB   ARG  17          HB2       ARG  17   0.868  -1.534 -20.269
  126   2HB   ARG  17          HB1       ARG  17   0.360  -1.100 -21.890
  127   1HG   ARG  17          HG2       ARG  17  -1.658  -2.391 -21.665
  128   2HG   ARG  17          HG1       ARG  17  -1.132  -3.012 -20.101
  129   1HD   ARG  17          HD2       ARG  17  -1.324  -0.863 -19.093
  130   2HD   ARG  17          HD1       ARG  17  -1.535  -0.075 -20.652
  131    HE   ARG  17           HE       ARG  17  -3.547  -1.565 -19.157
  132   1HH1  ARG  17          HH11      ARG  17  -2.711   0.145 -22.052
  133   2HH1  ARG  17          HH12      ARG  17  -4.356   0.325 -22.559
  134   1HH2  ARG  17          HH21      ARG  17  -5.686  -1.315 -19.820
  135   2HH2  ARG  17          HH22      ARG  17  -6.022  -0.487 -21.296
  136    H    ARG  18           HN       ARG  18   3.113  -4.432 -22.723
  137    HA   ARG  18           HA       ARG  18   4.621  -2.134 -23.636
  138   1HB   ARG  18          HB2       ARG  18   5.113  -5.099 -23.880
  139   2HB   ARG  18          HB1       ARG  18   6.146  -3.911 -24.657
  140   1HG   ARG  18          HG2       ARG  18   6.489  -2.904 -22.361
  141   2HG   ARG  18          HG1       ARG  18   5.716  -4.353 -21.721
  142   1HD   ARG  18          HD2       ARG  18   7.418  -5.720 -22.913
  143   2HD   ARG  18          HD1       ARG  18   8.225  -4.229 -23.395
  144    HE   ARG  18           HE       ARG  18   7.830  -4.671 -20.540
  145   1HH1  ARG  18          HH11      ARG  18   9.959  -4.748 -23.252
  146   2HH1  ARG  18          HH12      ARG  18  11.383  -4.835 -22.283
  147   1HH2  ARG  18          HH21      ARG  18   9.664  -4.810 -19.258
  148   2HH2  ARG  18          HH22      ARG  18  11.224  -4.858 -20.037