*HEADER    TRANSCRIPTION                           02-SEP-13   2MD7              
*TITLE     NMR STRUCTURE OF HUMAN SP140 PHD FINGER TRANS CONFORMER               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NUCLEAR BODY PROTEIN SP140;                                
*COMPND   3 CHAIN: B;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 687-738;                                      
*COMPND   5 SYNONYM: LYMPHOID-RESTRICTED HOMOLOG OF SP100, LYSP100, NUCLEAR      
*COMPND   6 AUTOANTIGEN SP-140, SPECKLED 140 KDA;                                
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: SP140, LYSP100;                                                
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PETM11                                    
*KEYWDS    PHD FINGER, TRANSCRIPTION                                             
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.ZUCCHELLI, G.QUILICI, G.MUSCO                                       
*REVDAT   1   13-NOV-13 2MD7    0                                                


! using 1.5 times the talos error! 

!    9 D  TALOS PSI = -19.20 +/- 20.20  
ASSIGN (resid    9 and name N ) (resid    9 and name CA )
       (resid    9 and name C) (resid   10 and name N )  1.00  -19.20   30.30   2

!   11 C  TALOS PSI = 127.67 +/- 21.82  
ASSIGN (resid   11 and name N ) (resid   11 and name CA )
       (resid   11 and name C) (resid   12 and name N )  1.00   127.67   32.72   2

!   12 E  TALOS PSI = -38.57 +/-  9.62  
ASSIGN (resid   12 and name N ) (resid   12 and name CA )
       (resid   12 and name C) (resid   13 and name N )  1.00  -38.57   14.43   2

!   13 V  TALOS PSI = -41.13 +/-  9.14  
ASSIGN (resid   13 and name N ) (resid   13 and name CA )
       (resid   13 and name C) (resid   14 and name N )  1.00  -41.13   13.71   2

!   14 C  TALOS PSI = -41.73 +/-  8.92  
ASSIGN (resid   14 and name N ) (resid   14 and name CA )
       (resid   14 and name C) (resid   15 and name N )  1.00  -41.73   13.37   2

!   15 R  TALOS PSI = -22.34 +/-  9.01  
ASSIGN (resid   15 and name N ) (resid   15 and name CA )
       (resid   15 and name C) (resid   16 and name N )  1.00  -22.34   13.52   2

!   16 D  TALOS PSI = -0.63 +/-  9.44  
ASSIGN (resid   16 and name N ) (resid   16 and name CA )
       (resid   16 and name C) (resid   17 and name N )  1.00  -0.63   14.15   2

!   20 L  TALOS PSI = 143.06 +/- 15.51  
ASSIGN (resid   20 and name N ) (resid   20 and name CA )
       (resid   20 and name C) (resid   21 and name N )  1.00   143.06   23.27   2

!   22 C  TALOS PSI = 161.00 +/- 12.98  
ASSIGN (resid   22 and name N ) (resid   22 and name CA )
       (resid   22 and name C) (resid   23 and name N )  1.00   161.00   19.48   2

!   23 C  TALOS PSI = 165.69 +/- 11.88  
ASSIGN (resid   23 and name N ) (resid   23 and name CA )
       (resid   23 and name C) (resid   24 and name N )  1.00   165.69   17.81   2

!   25 T  TALOS PSI = -38.37 +/-  9.72  
ASSIGN (resid   25 and name N ) (resid   25 and name CA )
       (resid   25 and name C) (resid   26 and name N )  1.00  -38.37   14.58   2

!   26 C  TALOS PSI = -40.19 +/-  5.81  
ASSIGN (resid   26 and name N ) (resid   26 and name CA )
       (resid   26 and name C) (resid   27 and name N )  1.00  -40.19   8.71   2

!   27 S  TALOS PSI = -33.33 +/- 13.13  
ASSIGN (resid   27 and name N ) (resid   27 and name CA )
       (resid   27 and name C) (resid   28 and name N )  1.00  -33.33   19.70   2

!   28 R  TALOS PSI = -35.56 +/- 10.20  
ASSIGN (resid   28 and name N ) (resid   28 and name CA )
       (resid   28 and name C) (resid   29 and name N )  1.00  -35.56   15.30   2

!   31 H  TALOS PSI = -41.88 +/-  4.59  
ASSIGN (resid   31 and name N ) (resid   31 and name CA )
       (resid   31 and name C) (resid   32 and name N )  1.00  -41.88   6.89   2

!   32 E  TALOS PSI = -41.06 +/-  7.71  
ASSIGN (resid   32 and name N ) (resid   32 and name CA )
       (resid   32 and name C) (resid   33 and name N )  1.00  -41.06   11.57   2

!   33 D  TALOS PSI = -38.72 +/-  9.03  
ASSIGN (resid   33 and name N ) (resid   33 and name CA )
       (resid   33 and name C) (resid   34 and name N )  1.00  -38.72   13.54   2

!   38 P  TALOS PSI = 146.44 +/-  9.29  
ASSIGN (resid   38 and name N ) (resid   38 and name CA )
       (resid   38 and name C) (resid   39 and name N )  1.00   146.44   13.93   2

!   48 C  TALOS PSI = 153.50 +/- 19.22  
ASSIGN (resid   48 and name N ) (resid   48 and name CA )
       (resid   48 and name C) (resid   49 and name N )  1.00   153.50   28.83   2

!   49 I  TALOS PSI = -30.53 +/- 12.64  
ASSIGN (resid   49 and name N ) (resid   49 and name CA )
       (resid   49 and name C) (resid   50 and name N )  1.00  -30.53   18.97   2

!   50 F  TALOS PSI = -43.32 +/-  7.01  
ASSIGN (resid   50 and name N ) (resid   50 and name CA )
       (resid   50 and name C) (resid   51 and name N )  1.00  -43.32   10.51   2

!   51 C  TALOS PSI = -40.60 +/- 10.45  
ASSIGN (resid   51 and name N ) (resid   51 and name CA )
       (resid   51 and name C) (resid   52 and name N )  1.00  -40.60   15.67   2

!   52 R  TALOS PSI = -9.24 +/- 20.01  
ASSIGN (resid   52 and name N ) (resid   52 and name CA )
       (resid   52 and name C) (resid   53 and name N )  1.00  -9.24   30.01   2

! using 1.5 times the talos error! 

!    9 D  TALOS PHI = -78.91 +/- 26.01  
ASSIGN (resid    8 and name C ) (resid    9 and name N )
       (resid    9 and name CA) (resid    9 and name C )  1.00  -78.91   39.01   2

!   11 C  TALOS PHI = -82.49 +/- 13.62  
ASSIGN (resid   10 and name C ) (resid   11 and name N )
       (resid   11 and name CA) (resid   11 and name C )  1.00  -82.49   20.42   2

!   12 E  TALOS PHI = -56.87 +/-  5.44  
ASSIGN (resid   11 and name C ) (resid   12 and name N )
       (resid   12 and name CA) (resid   12 and name C )  1.00  -56.87   8.16   2

!   13 V  TALOS PHI = -63.96 +/-  4.74  
ASSIGN (resid   12 and name C ) (resid   13 and name N )
       (resid   13 and name CA) (resid   13 and name C )  1.00  -63.96   7.10   2

!   14 C  TALOS PHI = -63.07 +/-  3.54  
ASSIGN (resid   13 and name C ) (resid   14 and name N )
       (resid   14 and name CA) (resid   14 and name C )  1.00  -63.07   5.30   2

!   15 R  TALOS PHI = -67.45 +/-  4.78  
ASSIGN (resid   14 and name C ) (resid   15 and name N )
       (resid   15 and name CA) (resid   15 and name C )  1.00  -67.45   7.17   2

!   16 D  TALOS PHI = -87.50 +/- 10.83  
ASSIGN (resid   15 and name C ) (resid   16 and name N )
       (resid   16 and name CA) (resid   16 and name C )  1.00  -87.50   16.24   2

!   20 L  TALOS PHI = -121.78 +/- 25.07  
ASSIGN (resid   19 and name C ) (resid   20 and name N )
       (resid   20 and name CA) (resid   20 and name C )  1.00  -121.78   37.61   2

!   21 F  TALOS PHI = -102.11 +/- 12.72  
ASSIGN (resid   20 and name C ) (resid   21 and name N )
       (resid   21 and name CA) (resid   21 and name C )  1.00  -102.11   37.01   2

!   22 C  TALOS PHI = -139.23 +/- 12.83  
ASSIGN (resid   21 and name C ) (resid   22 and name N )
       (resid   22 and name CA) (resid   22 and name C )  1.00  -139.23   19.25   2

!   23 C  TALOS PHI = -76.40 +/-  7.20  
ASSIGN (resid   22 and name C ) (resid   23 and name N )
       (resid   23 and name CA) (resid   23 and name C )  1.00  -76.40   10.80   2

!   25 T  TALOS PHI = -65.79 +/-  4.98  
ASSIGN (resid   24 and name C ) (resid   25 and name N )
       (resid   25 and name CA) (resid   25 and name C )  1.00  -65.79   7.46   2

!   26 C  TALOS PHI = -65.06 +/-  6.91  
ASSIGN (resid   25 and name C ) (resid   26 and name N )
       (resid   26 and name CA) (resid   26 and name C )  1.00  -65.06   10.36   2

!   27 S  TALOS PHI = -59.69 +/-  8.85  
ASSIGN (resid   26 and name C ) (resid   27 and name N )
       (resid   27 and name CA) (resid   27 and name C )  1.00  -59.69   13.27   2

!   28 R  TALOS PHI = -72.84 +/-  9.12  
ASSIGN (resid   27 and name C ) (resid   28 and name N )
       (resid   28 and name CA) (resid   28 and name C )  1.00  -72.84   13.69   2

!   31 H  TALOS PHI = -58.67 +/-  7.46  
ASSIGN (resid   30 and name C ) (resid   31 and name N )
       (resid   31 and name CA) (resid   31 and name C )  1.00  -58.67   11.18   2

!   32 E  TALOS PHI = -64.31 +/-  6.75  
ASSIGN (resid   31 and name C ) (resid   32 and name N )
       (resid   32 and name CA) (resid   32 and name C )  1.00  -64.31   10.13   2

!   33 D  TALOS PHI = -70.27 +/-  5.40  
ASSIGN (resid   32 and name C ) (resid   33 and name N )
       (resid   33 and name CA) (resid   33 and name C )  1.00  -70.27   8.10   2

!   38 P  TALOS PHI = -64.07 +/-  6.79  
ASSIGN (resid   37 and name C ) (resid   38 and name N )
       (resid   38 and name CA) (resid   38 and name C )  1.00  -64.07   10.18   2

!   39 V  TALOS PHI = -63.00 +/- 10.00  
ASSIGN (resid   38 and name C ) (resid   39 and name N )
       (resid   39 and name CA) (resid   39 and name C )  1.00  -63.00   15.00   2

!   48 C  TALOS PHI = -88.11 +/- 17.23  
ASSIGN (resid   47 and name C ) (resid   48 and name N )
       (resid   48 and name CA) (resid   48 and name C )  1.00  -88.11   25.84   2

!   49 I  TALOS PHI = -59.20 +/- 10.37  
ASSIGN (resid   48 and name C ) (resid   49 and name N )
       (resid   49 and name CA) (resid   49 and name C )  1.00  -59.20   15.55   2

!   50 F  TALOS PHI = -63.74 +/-  7.71  
ASSIGN (resid   49 and name C ) (resid   50 and name N )
       (resid   50 and name CA) (resid   50 and name C )  1.00  -63.74   11.56   2

!   51 C  TALOS PHI = -64.82 +/-  5.43  
ASSIGN (resid   50 and name C ) (resid   51 and name N )
       (resid   51 and name CA) (resid   51 and name C )  1.00  -64.82   8.15   2

!   52 R  TALOS PHI = -75.60 +/- 17.77  
ASSIGN (resid   51 and name C ) (resid   52 and name N )
       (resid   52 and name CA) (resid   52 and name C )  1.00  -75.60   26.66   2

!   53 M  TALOS PHI = -80.00 +/- 17.00  
ASSIGN (resid   52 and name C ) (resid   53 and name N )
       (resid   53 and name CA) (resid   53 and name C )  1.00  -58.00   108.00   2assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  9  and name HN   )
       ( resid  9  and name N  ) -1.82432 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  10  and name HN   )
       ( resid  10  and name N  ) 2.37161 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  11  and name HN   )
       ( resid  11  and name N  ) -3.34458 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  12  and name HN   )
       ( resid  12  and name N  ) -4.86485 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  13  and name HN   )
       ( resid  13  and name N  ) -1.09459 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  14  and name HN   )
       ( resid  14  and name N  ) -4.74323 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  15  and name HN   )
       ( resid  15  and name N  ) -4.19594 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  16  and name HN   )
       ( resid  16  and name N  ) -2.24999 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  17  and name HN   )
       ( resid  17  and name N  ) -5.29053 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  18  and name HN   )
       ( resid  18  and name N  ) 0.97297 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  19  and name HN   )
       ( resid  19  and name N  ) -5.65539 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  21  and name HN   )
       ( resid  21  and name N  ) -4.25675 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  22  and name HN   )
       ( resid  22  and name N  ) 8.51349 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  23  and name HN   )
       ( resid  23  and name N  ) 2.79729 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  24  and name HN   )
       ( resid  24  and name N  ) -2.18919 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  25  and name HN   )
       ( resid  25  and name N  ) 2.12838 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  26  and name HN   )
       ( resid  26  and name N  ) -2.61486 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  27  and name HN   )
       ( resid  27  and name N  ) -3.16215 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  28  and name HN   )
       ( resid  28  and name N  ) 5.22971 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  29  and name HN   )
       ( resid  29  and name N  ) 0.30405 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  30  and name HN   )
       ( resid  30  and name N  ) -3.9527 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  31  and name HN   )
       ( resid  31  and name N  ) -5.95945 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  32  and name HN   )
       ( resid  32  and name N  ) -4.62161 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  33  and name HN   )
       ( resid  33  and name N  ) -5.53377 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  48  and name HN   )
       ( resid  48  and name N  ) 5.1689 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  49  and name HN   )
       ( resid  49  and name N  ) 11.91889 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  50  and name HN   )
       ( resid  50  and name N  ) 2.06757 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  52  and name HN   )
       ( resid  52  and name N  ) 6.08107 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  53  and name HN   )
       ( resid  53  and name N  ) 2.8581 0.5
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  54  and name HN   )
       ( resid  54  and name N  ) -1.88513 0.5assign (segid "   B" and resid   30 and name  HB2) (segid "   B" and resid   30 and name  HD1) 3.184 1.267 1.267 weight 1.000 ! spec=13C_...P_FI, no=4, id=453, vol=1.815325e+08
    or (segid "   B" and resid   30 and name  HB2) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   30 and name  HE1) (segid "   B" and resid   30 and name  HD1) 2.982 1.111 1.111 weight 1.000 ! spec=13C_...P_FI, no=8, id=454, vol=5.549114e+08
    or (segid "   B" and resid   30 and name  HE1) (segid "   B" and resid   30 and name  HD2)
    or (segid "   B" and resid   30 and name  HE2) (segid "   B" and resid   30 and name  HD1)
    or (segid "   B" and resid   30 and name  HE2) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   21 and name  HD1) 3.189 1.271 1.271 weight 1.000 ! spec=13C_...P_FI, no=16, id=455, vol=1.986788e+08
    or (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   21 and name  HD2)
assign (segid "   B" and resid   50 and name  HB2) (segid "   B" and resid   50 and name  HD1) 3.232 1.306 1.306 weight 1.000 ! spec=13C_...P_FI, no=22, id=456, vol=1.783553e+08
    or (segid "   B" and resid   50 and name  HB2) (segid "   B" and resid   50 and name  HD2)
assign (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   30 and name  HE1) 3.832 1.835 1.835 weight 1.000 ! spec=13C_...P_FI, no=35, id=457, vol=5.772635e+07
    or (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   30 and name  HE2)
assign (segid "   B" and resid   46 and name  HH2) (segid "   B" and resid   46 and name  HZ2) 2.755 0.949 0.949 weight 1.000 ! spec=13C_...P_FI, no=38, id=460, vol=2.563547e+08
assign (segid "   B" and resid   46 and name  HZ3) (segid "   B" and resid   46 and name  HE3) 2.899 1.051 1.051 weight 1.000 ! spec=13C_...P_FI, no=40, id=461, vol=1.658779e+08
assign (segid "   B" and resid   35 and name  HB1) (segid "   B" and resid   35 and name  HD2) 2.850 1.015 1.015 weight 1.000 ! spec=13C_...P_FI, no=152, id=464, vol=1.460270e+08
assign (segid "   B" and resid   46 and name   HA) (segid "   B" and resid   46 and name  HE3) 4.106 2.107 2.107 weight 1.000 ! spec=13C_...P_FI, no=197, id=465, vol=6.039527e+07
assign (segid "   B" and resid   20 and name HD22) (segid "   B" and resid   31 and name  HE1) 3.057 1.168 1.168 weight 1.000 ! spec=13C_...P_FI, no=247, id=469, vol=1.487157e+08
    or (segid "   B" and resid   20 and name HD21) (segid "   B" and resid   31 and name  HE1)
    or (segid "   B" and resid   20 and name HD23) (segid "   B" and resid   31 and name  HE1)
assign (segid "   B" and resid   13 and name HG22) (segid "   B" and resid   35 and name  HE1) 3.454 1.491 1.491 weight 1.000 ! spec=13C_...P_FI, no=256, id=471, vol=1.158022e+08
    or (segid "   B" and resid   13 and name HG21) (segid "   B" and resid   35 and name  HE1)
    or (segid "   B" and resid   13 and name HG23) (segid "   B" and resid   35 and name  HE1)
assign (segid "   B" and resid   20 and name HD22) (segid "   B" and resid   35 and name  HE1) 3.288 1.351 1.351 weight 1.000 ! spec=13C_...P_FI, no=257, id=472, vol=9.650038e+07
    or (segid "   B" and resid   20 and name HD21) (segid "   B" and resid   35 and name  HE1)
    or (segid "   B" and resid   20 and name HD23) (segid "   B" and resid   35 and name  HE1)
assign (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   30 and name  HD1) 3.794 1.799 1.799 weight 1.000 ! spec=13C_...P_FI, no=287, id=475, vol=5.957147e+07
    or (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   31 and name  HE1) 2.641 0.872 0.872 weight 1.000 ! spec=13C_...P_FI, no=360, id=481, vol=3.010204e+08
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   31 and name  HE1)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   31 and name  HE1)
assign (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   21 and name   HZ) 3.234 1.308 1.308 weight 1.000 ! spec=13C_...P_FI, no=459, id=489, vol=9.284986e+07
assign (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   21 and name   HZ) 3.148 1.239 1.239 weight 1.000 ! spec=13C_...P_FI, no=461, id=490, vol=8.150420e+07
assign (segid "   B" and resid   31 and name  HD2) (segid "   B" and resid   35 and name  HD2) 2.998 1.123 1.123 weight 1.000 ! spec=13C_...P_FI, no=484, id=493, vol=1.652287e+08
assign (segid "   B" and resid    8 and name  HB2) (segid "   B" and resid   31 and name  HE1) 3.454 1.491 1.491 weight 1.000 ! spec=13C_...P_FI, no=493, id=495, vol=5.231824e+07
assign (segid "   B" and resid   32 and name  HB2) (segid "   B" and resid   31 and name  HD2) 4.653 2.706 2.706 weight 1.000 ! spec=13C_...P_FI, no=496, id=496, vol=3.380230e+07
assign (segid "   B" and resid   31 and name  HB1) (segid "   B" and resid   31 and name  HD2) 4.335 2.349 2.349 weight 1.000 ! spec=13C_...P_FI, no=497, id=497, vol=4.651210e+07
assign (segid "   B" and resid   31 and name  HB2) (segid "   B" and resid   31 and name  HD2) 3.010 1.132 1.132 weight 1.000 ! spec=13C_...P_FI, no=499, id=498, vol=1.238651e+08
assign (segid "   B" and resid   30 and name  HB1) (segid "   B" and resid   30 and name  HD1) 3.261 1.329 1.329 weight 1.000 ! spec=13C_...P_FI, no=503, id=500, vol=1.598658e+08
    or (segid "   B" and resid   30 and name  HB1) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   26 and name  HB2) (segid "   B" and resid   30 and name  HD1) 3.148 1.239 1.239 weight 1.000 ! spec=13C_...P_FI, no=504, id=501, vol=1.945197e+08
    or (segid "   B" and resid   26 and name  HB2) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   20 and name   HG) (segid "   B" and resid   35 and name  HE1) 2.650 0.878 0.878 weight 1.000 ! spec=13C_...P_FI, no=510, id=502, vol=2.313571e+08
assign (segid "   B" and resid   30 and name  HB2) (segid "   B" and resid   30 and name  HE1) 3.937 1.937 1.937 weight 1.000 ! spec=13C_...P_FI, no=512, id=503, vol=6.500321e+07
    or (segid "   B" and resid   30 and name  HB2) (segid "   B" and resid   30 and name  HE2)
assign (segid "   B" and resid   26 and name  HB2) (segid "   B" and resid   30 and name  HE1) 3.613 1.632 1.632 weight 1.000 ! spec=13C_...P_FI, no=513, id=504, vol=7.552838e+07
    or (segid "   B" and resid   26 and name  HB2) (segid "   B" and resid   30 and name  HE2)
assign (segid "   B" and resid   18 and name  HA1) (segid "   B" and resid   35 and name  HE1) 3.577 1.599 1.599 weight 1.000 ! spec=13C_...P_FI, no=516, id=505, vol=4.778269e+07
assign (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   36 and name HD12) 2.618 0.857 0.857 weight 1.000 ! spec=13C_...woLP, no=28, id=506, vol=3.575546e+08
    or (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   36 and name HD11)
    or (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   36 and name HD13)
assign (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name HD12) 2.356 0.694 0.694 weight 1.000 ! spec=13C_...woLP, no=29, id=507, vol=5.213421e+08
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name HD11)
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name HD13)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name HD12) 2.300 0.661 0.661 weight 1.000 ! spec=13C_...woLP, no=30, id=508, vol=6.235435e+08
    or (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name HD11)
    or (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name HD13)
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   21 and name  HB2) 2.943 1.083 1.083 weight 1.000 ! spec=13C_...woLP, no=46, id=510, vol=1.717096e+08
assign (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   21 and name  HB1) 1.992 0.496 0.496 weight 1.000 ! spec=13C_...woLP, no=56, id=511, vol=9.296947e+08
assign (segid "   B" and resid   21 and name  HB1) (segid "   B" and resid   21 and name  HD1) 3.069 1.177 1.177 weight 1.000 ! spec=13C_...woLP, no=57, id=512, vol=3.195869e+08
    or (segid "   B" and resid   21 and name  HB1) (segid "   B" and resid   21 and name  HD2)
assign (segid "   B" and resid   50 and name   HA) (segid "   B" and resid   50 and name  HB2) 2.817 0.992 0.992 weight 1.000 ! spec=13C_...woLP, no=60, id=515, vol=2.293593e+08
assign (segid "   B" and resid   50 and name   HA) (segid "   B" and resid   50 and name  HB1) 3.247 1.318 1.318 weight 1.000 ! spec=13C_...woLP, no=61, id=516, vol=1.636026e+08
assign (segid "   B" and resid   30 and name  HB1) (segid "   B" and resid   30 and name  HB2) 2.008 0.504 0.504 weight 1.000 ! spec=13C_...woLP, no=70, id=521, vol=7.681759e+08
assign (segid "   B" and resid   38 and name  HB1) (segid "   B" and resid   38 and name   HA) 2.221 0.617 0.617 weight 1.000 ! spec=13C_...woLP, no=73, id=523, vol=9.317364e+08
assign (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   37 and name  HB1) 3.227 1.302 1.302 weight 1.000 ! spec=13C_...woLP, no=80, id=525, vol=8.202376e+07
assign (segid "   B" and resid   37 and name  HD1) (segid "   B" and resid   37 and name  HB1) 4.469 2.496 2.496 weight 1.000 ! spec=13C_...woLP, no=81, id=526, vol=4.489872e+07
assign (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   37 and name  HB2) 2.877 1.034 1.034 weight 1.000 ! spec=13C_...woLP, no=84, id=528, vol=1.323808e+08
assign (segid "   B" and resid   37 and name  HD1) (segid "   B" and resid   37 and name  HB2) 4.580 2.623 2.623 weight 1.000 ! spec=13C_...woLP, no=85, id=529, vol=3.812404e+07
assign (segid "   B" and resid   37 and name  HB2) (segid "   B" and resid   37 and name  HB1) 2.177 0.592 0.592 weight 1.000 ! spec=13C_...woLP, no=86, id=530, vol=4.502432e+08
assign (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   37 and name  HG1) 4.323 2.336 2.336 weight 1.000 ! spec=13C_...woLP, no=88, id=531, vol=4.143525e+07
assign (segid "   B" and resid   37 and name  HD2) (segid "   B" and resid   37 and name  HG2) 3.800 1.805 1.805 weight 1.000 ! spec=13C_...woLP, no=90, id=533, vol=9.282319e+07
assign (segid "   B" and resid   37 and name  HB2) (segid "   B" and resid   37 and name  HG1) 2.966 1.100 1.100 weight 1.000 ! spec=13C_...woLP, no=91, id=534, vol=1.413766e+08
assign (segid "   B" and resid   37 and name  HB2) (segid "   B" and resid   37 and name  HG2) 3.811 1.815 1.815 weight 1.000 ! spec=13C_...woLP, no=92, id=535, vol=4.808688e+07
assign (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   45 and name  HD1) 1.874 0.439 0.439 weight 1.000 ! spec=13C_...woLP, no=115, id=536, vol=1.298601e+09
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   34 and name   HA) 2.651 0.878 0.878 weight 1.000 ! spec=13C_...woLP, no=149, id=539, vol=3.386010e+08
assign (segid "   B" and resid   35 and name  HE1) (segid "   B" and resid   20 and name   HA) 4.061 2.062 2.062 weight 1.000 ! spec=13C_...woLP, no=153, id=540, vol=5.358378e+07
assign (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   20 and name   HA) 2.867 1.027 1.027 weight 1.000 ! spec=13C_...woLP, no=155, id=541, vol=2.264185e+08
assign (segid "   B" and resid   20 and name  HB1) (segid "   B" and resid   20 and name   HA) 2.791 0.974 0.974 weight 1.000 ! spec=13C_...woLP, no=158, id=542, vol=3.675623e+08
assign (segid "   B" and resid   20 and name  HB2) (segid "   B" and resid   20 and name   HA) 2.274 0.647 0.647 weight 1.000 ! spec=13C_...woLP, no=159, id=543, vol=6.748894e+08
assign (segid "   B" and resid   20 and name HD22) (segid "   B" and resid   20 and name   HA) 2.406 0.724 0.724 weight 1.000 ! spec=13C_...woLP, no=161, id=545, vol=5.332122e+08
    or (segid "   B" and resid   20 and name HD21) (segid "   B" and resid   20 and name   HA)
    or (segid "   B" and resid   20 and name HD23) (segid "   B" and resid   20 and name   HA)
assign (segid "   B" and resid   35 and name  HE1) (segid "   B" and resid   20 and name  HB1) 4.750 2.821 2.821 weight 1.000 ! spec=13C_...woLP, no=178, id=546, vol=4.604099e+07
assign (segid "   B" and resid   20 and name  HB1) (segid "   B" and resid   20 and name  HB2) 1.793 0.402 0.402 weight 1.000 ! spec=13C_...woLP, no=187, id=550, vol=1.499211e+09
assign (segid "   B" and resid   20 and name HD22) (segid "   B" and resid   20 and name  HB2) 2.662 0.886 0.886 weight 1.000 ! spec=13C_...woLP, no=191, id=554, vol=2.293988e+08
    or (segid "   B" and resid   20 and name HD21) (segid "   B" and resid   20 and name  HB2)
    or (segid "   B" and resid   20 and name HD23) (segid "   B" and resid   20 and name  HB2)
assign (segid "   B" and resid   20 and name HD22) (segid "   B" and resid   20 and name   HG) 2.555 0.816 0.816 weight 1.000 ! spec=13C_...woLP, no=195, id=555, vol=2.608377e+08
    or (segid "   B" and resid   20 and name HD21) (segid "   B" and resid   20 and name   HG)
    or (segid "   B" and resid   20 and name HD23) (segid "   B" and resid   20 and name   HG)
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   20 and name   HG) 2.492 0.776 0.776 weight 1.000 ! spec=13C_...woLP, no=196, id=556, vol=3.092914e+08
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   20 and name   HG)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   20 and name   HG)
assign (segid "   B" and resid   20 and name   HG) (segid "   B" and resid   20 and name  HB1) 2.669 0.891 0.891 weight 1.000 ! spec=13C_...woLP, no=197, id=557, vol=2.236381e+08
assign (segid "   B" and resid   31 and name  HD2) (segid "   B" and resid   20 and name HD22) 4.236 2.243 2.243 weight 1.000 ! spec=13C_...woLP, no=205, id=559, vol=3.172457e+07
    or (segid "   B" and resid   31 and name  HD2) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   31 and name  HD2) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   27 and name  HB1) (segid "   B" and resid   20 and name HD22) 3.124 1.220 1.220 weight 1.000 ! spec=13C_...woLP, no=208, id=562, vol=1.862334e+08
    or (segid "   B" and resid   27 and name  HB1) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   27 and name  HB1) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   20 and name HD22) 3.716 1.726 1.726 weight 1.000 ! spec=13C_...woLP, no=209, id=563, vol=5.046808e+07
    or (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   20 and name HD22) (segid "   B" and resid   20 and name  HB1) 3.460 1.496 1.496 weight 1.000 ! spec=13C_...woLP, no=212, id=564, vol=1.870773e+08
    or (segid "   B" and resid   20 and name HD21) (segid "   B" and resid   20 and name  HB1)
    or (segid "   B" and resid   20 and name HD23) (segid "   B" and resid   20 and name  HB1)
assign (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   20 and name HD12) 4.730 2.797 2.797 weight 1.000 ! spec=13C_...woLP, no=220, id=567, vol=2.622621e+07
    or (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   20 and name HD11)
    or (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   20 and name HD13)
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   20 and name   HA) 3.239 1.312 1.312 weight 1.000 ! spec=13C_...woLP, no=222, id=568, vol=3.193393e+08
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   20 and name   HA)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   20 and name   HA)
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   20 and name  HB1) 2.282 0.651 0.651 weight 1.000 ! spec=13C_...woLP, no=227, id=569, vol=6.691498e+08
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   20 and name  HB1)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   20 and name  HB1)
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   20 and name HD22) 1.996 0.498 0.498 weight 1.000 ! spec=13C_...woLP, no=229, id=571, vol=1.005818e+09
    or (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   20 and name HD23)
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   20 and name HD22)
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   20 and name HD23)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   20 and name HD22)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   14 and name   HA) (segid "   B" and resid   35 and name  HE1) 2.912 1.060 1.060 weight 1.000 ! spec=13C_...woLP, no=232, id=572, vol=2.345395e+08
assign (segid "   B" and resid   14 and name  HB1) (segid "   B" and resid   14 and name   HA) 2.650 0.878 0.878 weight 1.000 ! spec=13C_...woLP, no=234, id=573, vol=4.271461e+08
assign (segid "   B" and resid   14 and name  HB2) (segid "   B" and resid   14 and name   HA) 2.463 0.759 0.759 weight 1.000 ! spec=13C_...woLP, no=235, id=574, vol=5.929222e+08
assign (segid "   B" and resid   13 and name HG22) (segid "   B" and resid   14 and name   HA) 3.516 1.545 1.545 weight 1.000 ! spec=13C_...woLP, no=236, id=575, vol=9.791115e+07
    or (segid "   B" and resid   13 and name HG21) (segid "   B" and resid   14 and name   HA)
    or (segid "   B" and resid   13 and name HG23) (segid "   B" and resid   14 and name   HA)
assign (segid "   B" and resid   31 and name  HB2) (segid "   B" and resid   31 and name  HB1) 1.881 0.442 0.442 weight 1.000 ! spec=13C_...woLP, no=255, id=581, vol=1.201795e+09
assign (segid "   B" and resid   11 and name  HB1) (segid "   B" and resid   11 and name   HA) 2.457 0.755 0.755 weight 1.000 ! spec=13C_...woLP, no=260, id=584, vol=4.791132e+08
assign (segid "   B" and resid   22 and name   HA) (segid "   B" and resid   22 and name  HB1) 3.000 1.125 1.125 weight 1.000 ! spec=13C_...woLP, no=269, id=585, vol=1.279790e+08
assign (segid "   B" and resid   22 and name  HB2) (segid "   B" and resid   22 and name  HB1) 2.029 0.515 0.515 weight 1.000 ! spec=13C_...woLP, no=271, id=587, vol=6.399268e+08
assign (segid "   B" and resid   23 and name  HB1) (segid "   B" and resid   23 and name   HA) 2.701 0.912 0.912 weight 1.000 ! spec=13C_...woLP, no=278, id=592, vol=2.835033e+08
assign (segid "   B" and resid   23 and name   HA) (segid "   B" and resid   23 and name  HB2) 3.070 1.178 1.178 weight 1.000 ! spec=13C_...woLP, no=283, id=594, vol=2.127472e+08
assign (segid "   B" and resid   30 and name   HA) (segid "   B" and resid   30 and name  HB1) 2.965 1.099 1.099 weight 1.000 ! spec=13C_...woLP, no=287, id=595, vol=3.649486e+08
assign (segid "   B" and resid   30 and name   HA) (segid "   B" and resid   30 and name  HB2) 2.787 0.971 0.971 weight 1.000 ! spec=13C_...woLP, no=289, id=596, vol=1.978112e+08
assign (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   29 and name   HA) 2.636 0.869 0.869 weight 1.000 ! spec=13C_...woLP, no=291, id=597, vol=3.854056e+08
assign (segid "   B" and resid   16 and name  HB1) (segid "   B" and resid   13 and name   HA) 4.207 2.212 2.212 weight 1.000 ! spec=13C_...woLP, no=322, id=604, vol=1.315825e+08
assign (segid "   B" and resid   13 and name HG22) (segid "   B" and resid   13 and name   HA) 2.250 0.633 0.633 weight 1.000 ! spec=13C_...woLP, no=327, id=606, vol=9.213990e+08
    or (segid "   B" and resid   13 and name HG21) (segid "   B" and resid   13 and name   HA)
    or (segid "   B" and resid   13 and name HG23) (segid "   B" and resid   13 and name   HA)
assign (segid "   B" and resid   13 and name   HB) (segid "   B" and resid   13 and name   HA) 2.575 0.829 0.829 weight 1.000 ! spec=13C_...woLP, no=328, id=607, vol=3.534656e+08
assign (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   13 and name   HA) 3.333 1.389 1.389 weight 1.000 ! spec=13C_...woLP, no=329, id=608, vol=1.081031e+08
assign (segid "   B" and resid   16 and name  HB2) (segid "   B" and resid   13 and name   HA) 2.609 0.851 0.851 weight 1.000 ! spec=13C_...woLP, no=331, id=609, vol=2.954927e+08
assign (segid "   B" and resid   18 and name  HA2) (segid "   B" and resid   13 and name HG22) 3.173 1.258 1.258 weight 1.000 ! spec=13C_...woLP, no=338, id=611, vol=3.251428e+08
    or (segid "   B" and resid   18 and name  HA2) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   18 and name  HA2) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   18 and name  HA1) (segid "   B" and resid   13 and name HG22) 2.137 0.571 0.571 weight 1.000 ! spec=13C_...woLP, no=340, id=613, vol=6.891555e+08
    or (segid "   B" and resid   18 and name  HA1) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   18 and name  HA1) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   13 and name HG22) (segid "   B" and resid   13 and name   HB) 2.121 0.562 0.562 weight 1.000 ! spec=13C_...woLP, no=343, id=614, vol=8.599133e+08
    or (segid "   B" and resid   13 and name HG21) (segid "   B" and resid   13 and name   HB)
    or (segid "   B" and resid   13 and name HG23) (segid "   B" and resid   13 and name   HB)
assign (segid "   B" and resid   13 and name HG12) (segid "   B" and resid   13 and name   HA) 2.357 0.694 3.643 weight 1.000 ! spec=13C_...woLP, no=347, id=616, vol=9.493787e+08
    or (segid "   B" and resid   13 and name HG11) (segid "   B" and resid   13 and name   HA)
    or (segid "   B" and resid   13 and name HG13) (segid "   B" and resid   13 and name   HA)
assign (segid "   B" and resid   16 and name  HB2) (segid "   B" and resid   13 and name HG12) 3.978 1.978 1.978 weight 1.000 ! spec=13C_...woLP, no=350, id=617, vol=7.934839e+07
    or (segid "   B" and resid   16 and name  HB2) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   16 and name  HB2) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   13 and name HG12) 3.189 1.271 1.271 weight 1.000 ! spec=13C_...woLP, no=352, id=618, vol=2.566264e+08
    or (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   13 and name   HB) (segid "   B" and resid   13 and name HG12) 1.922 0.462 0.462 weight 1.000 ! spec=13C_...woLP, no=354, id=619, vol=1.598377e+09
    or (segid "   B" and resid   13 and name   HB) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   13 and name   HB) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   13 and name HG12) (segid "   B" and resid   13 and name HG22) 1.779 0.396 0.396 weight 1.000 ! spec=13C_...woLP, no=355, id=620, vol=1.983643e+09
    or (segid "   B" and resid   13 and name HG12) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   13 and name HG12) (segid "   B" and resid   13 and name HG23)
    or (segid "   B" and resid   13 and name HG11) (segid "   B" and resid   13 and name HG22)
    or (segid "   B" and resid   13 and name HG11) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   13 and name HG11) (segid "   B" and resid   13 and name HG23)
    or (segid "   B" and resid   13 and name HG13) (segid "   B" and resid   13 and name HG22)
    or (segid "   B" and resid   13 and name HG13) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   13 and name HG13) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid    2 and name  HB2) (segid "   B" and resid    2 and name   HA) 2.451 0.751 0.751 weight 1.000 ! spec=13C_...woLP, no=359, id=621, vol=4.932114e+08
    or (segid "   B" and resid    2 and name  HB1) (segid "   B" and resid    2 and name   HA)
    or (segid "   B" and resid    2 and name  HB3) (segid "   B" and resid    2 and name   HA)
assign (segid "   B" and resid    5 and name  HB1) (segid "   B" and resid    5 and name   HA) 2.854 1.018 1.018 weight 1.000 ! spec=13C_...woLP, no=367, id=627, vol=4.166434e+08
assign (segid "   B" and resid    5 and name  HB1) (segid "   B" and resid    5 and name  HG2) 2.611 0.852 0.852 weight 1.000 ! spec=13C_...woLP, no=368, id=628, vol=3.369649e+08
assign (segid "   B" and resid    7 and name   HA) (segid "   B" and resid    7 and name  HB2) 2.677 0.896 0.896 weight 1.000 ! spec=13C_...woLP, no=382, id=631, vol=3.553877e+08
assign (segid "   B" and resid    7 and name   HA) (segid "   B" and resid    7 and name  HB1) 2.667 0.889 0.889 weight 1.000 ! spec=13C_...woLP, no=383, id=632, vol=3.731280e+08
assign (segid "   B" and resid    7 and name  HB1) (segid "   B" and resid    7 and name  HB2) 1.800 0.405 0.405 weight 1.000 ! spec=13C_...woLP, no=384, id=633, vol=1.975714e+09
assign (segid "   B" and resid    8 and name HD12) (segid "   B" and resid    8 and name  HB2) 2.309 0.666 0.666 weight 1.000 ! spec=13C_...woLP, no=388, id=634, vol=6.013198e+08
    or (segid "   B" and resid    8 and name HD11) (segid "   B" and resid    8 and name  HB2)
    or (segid "   B" and resid    8 and name HD13) (segid "   B" and resid    8 and name  HB2)
assign (segid "   B" and resid    8 and name HD12) (segid "   B" and resid    8 and name  HB1) 2.665 0.888 0.888 weight 1.000 ! spec=13C_...woLP, no=389, id=635, vol=3.689100e+08
    or (segid "   B" and resid    8 and name HD11) (segid "   B" and resid    8 and name  HB1)
    or (segid "   B" and resid    8 and name HD13) (segid "   B" and resid    8 and name  HB1)
assign (segid "   B" and resid    8 and name   HA) (segid "   B" and resid    8 and name  HB1) 2.758 0.951 0.951 weight 1.000 ! spec=13C_...woLP, no=390, id=636, vol=2.824628e+08
assign (segid "   B" and resid    9 and name  HB2) (segid "   B" and resid    9 and name   HA) 2.587 0.837 0.837 weight 1.000 ! spec=13C_...woLP, no=415, id=639, vol=4.237343e+08
assign (segid "   B" and resid    9 and name  HB1) (segid "   B" and resid    9 and name   HA) 2.732 0.933 0.933 weight 1.000 ! spec=13C_...woLP, no=416, id=640, vol=4.105901e+08
assign (segid "   B" and resid   15 and name  HG2) (segid "   B" and resid   12 and name   HA) 3.578 1.600 1.600 weight 1.000 ! spec=13C_...woLP, no=425, id=644, vol=8.465688e+07
assign (segid "   B" and resid   12 and name  HB1) (segid "   B" and resid   12 and name   HA) 2.479 0.768 0.768 weight 1.000 ! spec=13C_...woLP, no=426, id=645, vol=4.445151e+08
assign (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   12 and name   HA) 2.871 1.030 1.030 weight 1.000 ! spec=13C_...woLP, no=427, id=646, vol=4.334965e+08
assign (segid "   B" and resid   15 and name  HG2) (segid "   B" and resid   15 and name   HA) 2.790 0.973 0.973 weight 1.000 ! spec=13C_...woLP, no=432, id=649, vol=3.944215e+08
assign (segid "   B" and resid   16 and name  HB1) (segid "   B" and resid   15 and name   HA) 4.740 2.808 2.808 weight 1.000 ! spec=13C_...woLP, no=433, id=650, vol=4.645481e+07
assign (segid "   B" and resid   16 and name   HA) (segid "   B" and resid   15 and name   HA) 4.064 2.065 2.065 weight 1.000 ! spec=13C_...woLP, no=434, id=651, vol=4.749173e+07
assign (segid "   B" and resid   15 and name   HA) (segid "   B" and resid   15 and name  HG1) 2.733 0.933 0.933 weight 1.000 ! spec=13C_...woLP, no=438, id=655, vol=2.721461e+08
assign (segid "   B" and resid   16 and name   HA) (segid "   B" and resid   16 and name  HB1) 2.628 0.863 0.863 weight 1.000 ! spec=13C_...woLP, no=444, id=657, vol=3.922266e+08
assign (segid "   B" and resid   16 and name   HA) (segid "   B" and resid   16 and name  HB2) 3.132 1.226 1.226 weight 1.000 ! spec=13C_...woLP, no=448, id=660, vol=2.541978e+08
assign (segid "   B" and resid   17 and name  HA1) (segid "   B" and resid   17 and name  HA2) 1.897 0.450 0.450 weight 1.000 ! spec=13C_...woLP, no=449, id=661, vol=1.482048e+09
assign (segid "   B" and resid   18 and name  HA1) (segid "   B" and resid   18 and name  HA2) 1.725 0.372 0.372 weight 1.000 ! spec=13C_...woLP, no=454, id=663, vol=1.965816e+09
assign (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   19 and name  HB2) 2.724 0.927 0.927 weight 1.000 ! spec=13C_...woLP, no=463, id=664, vol=2.635599e+08
assign (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   19 and name  HB2) 1.888 0.445 0.445 weight 1.000 ! spec=13C_...woLP, no=464, id=665, vol=1.142578e+09
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   34 and name  HB2) 1.911 0.456 0.456 weight 1.000 ! spec=13C_...woLP, no=487, id=668, vol=1.051582e+09
assign (segid "   B" and resid   35 and name  HB2) (segid "   B" and resid   35 and name  HD2) 4.064 2.064 2.064 weight 1.000 ! spec=13C_...woLP, no=503, id=671, vol=9.633803e+07
assign (segid "   B" and resid   35 and name  HB2) (segid "   B" and resid   35 and name  HB1) 1.853 0.429 0.429 weight 1.000 ! spec=13C_...woLP, no=510, id=674, vol=1.346950e+09
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name   HA) 2.760 0.952 0.952 weight 1.000 ! spec=13C_...woLP, no=518, id=676, vol=1.921508e+08
assign (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   36 and name   HB) 2.998 1.124 1.124 weight 1.000 ! spec=13C_...woLP, no=519, id=677, vol=1.600393e+08
assign (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name   HB) 2.514 0.790 0.790 weight 1.000 ! spec=13C_...woLP, no=521, id=678, vol=3.534821e+08
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name   HB) 2.854 1.018 1.018 weight 1.000 ! spec=13C_...woLP, no=522, id=679, vol=2.561565e+08
assign (segid "   B" and resid   36 and name HG22) (segid "   B" and resid   36 and name   HB) 2.175 0.591 0.591 weight 1.000 ! spec=13C_...woLP, no=523, id=680, vol=8.086767e+08
    or (segid "   B" and resid   36 and name HG21) (segid "   B" and resid   36 and name   HB)
    or (segid "   B" and resid   36 and name HG23) (segid "   B" and resid   36 and name   HB)
assign (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   36 and name HG11) 3.138 1.231 1.231 weight 1.000 ! spec=13C_...woLP, no=528, id=685, vol=1.459630e+08
assign (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name HG12) 1.814 0.411 0.411 weight 1.000 ! spec=13C_...woLP, no=530, id=686, vol=1.202441e+09
assign (segid "   B" and resid   33 and name  HB1) (segid "   B" and resid   33 and name   HA) 2.982 1.111 1.111 weight 1.000 ! spec=13C_...woLP, no=533, id=688, vol=1.493082e+08
assign (segid "   B" and resid   33 and name   HA) (segid "   B" and resid   33 and name  HB2) 3.052 1.165 1.165 weight 1.000 ! spec=13C_...woLP, no=537, id=689, vol=2.556061e+08
assign (segid "   B" and resid   32 and name  HB1) (segid "   B" and resid   32 and name   HA) 3.016 1.137 1.137 weight 1.000 ! spec=13C_...woLP, no=544, id=691, vol=2.824590e+08
assign (segid "   B" and resid   32 and name  HB2) (segid "   B" and resid   32 and name   HA) 2.628 0.863 0.863 weight 1.000 ! spec=13C_...woLP, no=545, id=692, vol=3.320123e+08
assign (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name HG22) 2.802 0.981 0.981 weight 1.000 ! spec=13C_...woLP, no=557, id=696, vol=4.765014e+08
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name HG21)
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name HG23)
assign (segid "   B" and resid   38 and name  HB1) (segid "   B" and resid   38 and name  HD1) 4.049 2.049 2.049 weight 1.000 ! spec=13C_...woLP, no=573, id=697, vol=9.670894e+07
assign (segid "   B" and resid   38 and name  HB1) (segid "   B" and resid   38 and name  HD2) 4.207 2.212 2.212 weight 1.000 ! spec=13C_...woLP, no=574, id=698, vol=7.903036e+07
assign (segid "   B" and resid   38 and name  HG2) (segid "   B" and resid   38 and name  HD1) 2.543 0.809 0.809 weight 1.000 ! spec=13C_...woLP, no=576, id=699, vol=3.893057e+08
assign (segid "   B" and resid   39 and name   HB) (segid "   B" and resid   39 and name   HA) 2.337 0.683 0.683 weight 1.000 ! spec=13C_...woLP, no=582, id=700, vol=5.452220e+08
assign (segid "   B" and resid   25 and name   HB) (segid "   B" and resid   25 and name   HA) 2.694 0.907 0.907 weight 1.000 ! spec=13C_...woLP, no=584, id=702, vol=3.643979e+08
assign (segid "   B" and resid   25 and name HG21) (segid "   B" and resid   25 and name   HB) 2.031 0.516 0.516 weight 1.000 ! spec=13C_...woLP, no=591, id=708, vol=1.253034e+09
    or (segid "   B" and resid   25 and name HG22) (segid "   B" and resid   25 and name   HB)
    or (segid "   B" and resid   25 and name HG23) (segid "   B" and resid   25 and name   HB)
assign (segid "   B" and resid   25 and name HG21) (segid "   B" and resid   25 and name   HA) 2.326 0.676 0.676 weight 1.000 ! spec=13C_...woLP, no=592, id=709, vol=7.768036e+08
    or (segid "   B" and resid   25 and name HG22) (segid "   B" and resid   25 and name   HA)
    or (segid "   B" and resid   25 and name HG23) (segid "   B" and resid   25 and name   HA)
assign (segid "   B" and resid   26 and name   HA) (segid "   B" and resid   26 and name  HB1) 2.929 1.072 1.072 weight 1.000 ! spec=13C_...woLP, no=600, id=710, vol=3.246054e+08
assign (segid "   B" and resid   26 and name   HA) (segid "   B" and resid   26 and name  HB2) 2.747 0.944 0.944 weight 1.000 ! spec=13C_...woLP, no=601, id=711, vol=2.473607e+08
assign (segid "   B" and resid   26 and name  HB1) (segid "   B" and resid   22 and name  HB1) 2.404 0.722 0.722 weight 1.000 ! spec=13C_...woLP, no=602, id=712, vol=2.814326e+08
assign (segid "   B" and resid   26 and name  HB2) (segid "   B" and resid   22 and name  HB1) 3.074 1.182 1.182 weight 1.000 ! spec=13C_...woLP, no=603, id=713, vol=2.373451e+08
assign (segid "   B" and resid   39 and name HG12) (segid "   B" and resid   39 and name   HA) 2.459 0.756 0.756 weight 1.000 ! spec=13C_...woLP, no=636, id=721, vol=5.664575e+08
    or (segid "   B" and resid   39 and name HG11) (segid "   B" and resid   39 and name   HA)
    or (segid "   B" and resid   39 and name HG13) (segid "   B" and resid   39 and name   HA)
assign (segid "   B" and resid   39 and name HG12) (segid "   B" and resid   39 and name   HB) 1.940 0.470 0.470 weight 1.000 ! spec=13C_...woLP, no=637, id=722, vol=1.295047e+09
    or (segid "   B" and resid   39 and name HG11) (segid "   B" and resid   39 and name   HB)
    or (segid "   B" and resid   39 and name HG13) (segid "   B" and resid   39 and name   HB)
assign (segid "   B" and resid   41 and name  HB2) (segid "   B" and resid   41 and name   HA) 2.173 0.590 0.590 weight 1.000 ! spec=13C_...woLP, no=653, id=724, vol=1.043169e+09
    or (segid "   B" and resid   41 and name  HB1) (segid "   B" and resid   41 and name   HA)
    or (segid "   B" and resid   41 and name  HB3) (segid "   B" and resid   41 and name   HA)
assign (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   43 and name  HG1) 3.591 1.612 1.612 weight 1.000 ! spec=13C_...woLP, no=667, id=726, vol=1.250094e+08
assign (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name   HB) 2.679 0.897 0.897 weight 1.000 ! spec=13C_...woLP, no=672, id=728, vol=2.251752e+08
assign (segid "   B" and resid   45 and name  HD2) (segid "   B" and resid   44 and name   HB) 3.005 1.128 1.128 weight 1.000 ! spec=13C_...woLP, no=673, id=729, vol=1.800302e+08
assign (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name HG21) 2.478 0.767 0.767 weight 1.000 ! spec=13C_...woLP, no=678, id=731, vol=4.384619e+08
    or (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name HG23)
assign (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   44 and name HG21) 3.763 1.770 1.770 weight 1.000 ! spec=13C_...woLP, no=680, id=732, vol=1.131174e+08
    or (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   44 and name HG23)
assign (segid "   B" and resid   45 and name  HD2) (segid "   B" and resid   44 and name HG21) 3.833 1.837 1.837 weight 1.000 ! spec=13C_...woLP, no=681, id=733, vol=1.554000e+08
    or (segid "   B" and resid   45 and name  HD2) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   45 and name  HD2) (segid "   B" and resid   44 and name HG23)
assign (segid "   B" and resid   49 and name   HB) (segid "   B" and resid   49 and name   HA) 2.635 0.868 0.868 weight 1.000 ! spec=13C_...woLP, no=726, id=734, vol=3.346320e+08
assign (segid "   B" and resid   49 and name HG11) (segid "   B" and resid   49 and name   HA) 3.104 1.204 1.204 weight 1.000 ! spec=13C_...woLP, no=728, id=735, vol=2.393965e+08
assign (segid "   B" and resid   49 and name HG11) (segid "   B" and resid   49 and name   HB) 2.723 0.927 0.927 weight 1.000 ! spec=13C_...woLP, no=737, id=738, vol=3.691748e+08
assign (segid "   B" and resid   38 and name  HD1) (segid "   B" and resid   38 and name  HD2) 1.874 0.439 0.439 weight 1.000 ! spec=13C_...woLP, no=770, id=744, vol=9.089894e+08
assign (segid "   B" and resid   49 and name HG22) (segid "   B" and resid   49 and name   HB) 2.356 0.694 0.694 weight 1.000 ! spec=13C_...woLP, no=779, id=746, vol=5.272712e+08
    or (segid "   B" and resid   49 and name HG21) (segid "   B" and resid   49 and name   HB)
    or (segid "   B" and resid   49 and name HG23) (segid "   B" and resid   49 and name   HB)
assign (segid "   B" and resid   49 and name HG22) (segid "   B" and resid   49 and name HG11) 2.291 0.656 0.656 weight 1.000 ! spec=13C_...woLP, no=780, id=747, vol=4.663194e+08
    or (segid "   B" and resid   49 and name HG21) (segid "   B" and resid   49 and name HG11)
    or (segid "   B" and resid   49 and name HG23) (segid "   B" and resid   49 and name HG11)
assign (segid "   B" and resid   50 and name  HB1) (segid "   B" and resid   50 and name  HB2) 1.968 0.484 0.484 weight 1.000 ! spec=13C_...woLP, no=788, id=751, vol=9.840219e+08
assign (segid "   B" and resid   51 and name  HB2) (segid "   B" and resid   51 and name   HA) 3.063 1.173 1.173 weight 1.000 ! spec=13C_...woLP, no=804, id=753, vol=1.998816e+08
assign (segid "   B" and resid   51 and name  HB1) (segid "   B" and resid   51 and name   HA) 2.936 1.078 1.078 weight 1.000 ! spec=13C_...woLP, no=805, id=754, vol=1.967989e+08
assign (segid "   B" and resid   54 and name  HB2) (segid "   B" and resid   52 and name   HA) 2.289 0.655 3.711 weight 1.000 ! spec=13C_...woLP, no=809, id=755, vol=9.880021e+08
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   54 and name  HB1) 2.810 0.987 0.987 weight 1.000 ! spec=13C_...woLP, no=823, id=762, vol=2.299135e+08
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   54 and name  HB2) 3.063 1.173 1.173 weight 1.000 ! spec=13C_...woLP, no=824, id=763, vol=1.773634e+08
assign (segid "   B" and resid   54 and name  HE2) (segid "   B" and resid   54 and name  HB1) 4.828 2.913 2.913 weight 1.000 ! spec=13C_...woLP, no=825, id=764, vol=6.166212e+07
assign (segid "   B" and resid   54 and name  HG1) (segid "   B" and resid   54 and name  HB2) 2.727 0.930 0.930 weight 1.000 ! spec=13C_...woLP, no=826, id=765, vol=2.327707e+08
assign (segid "   B" and resid   54 and name  HG1) (segid "   B" and resid   54 and name  HB1) 3.138 1.231 1.231 weight 1.000 ! spec=13C_...woLP, no=827, id=766, vol=2.022259e+08
assign (segid "   B" and resid   54 and name  HE2) (segid "   B" and resid   54 and name  HG2) 3.620 1.638 1.638 weight 1.000 ! spec=13C_...woLP, no=830, id=768, vol=1.045396e+08
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   54 and name  HG1) 3.225 1.300 1.300 weight 1.000 ! spec=13C_...woLP, no=831, id=769, vol=1.340080e+08
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   54 and name  HG2) 3.266 1.334 1.334 weight 1.000 ! spec=13C_...woLP, no=832, id=770, vol=1.154422e+08
assign (segid "   B" and resid   54 and name  HD1) (segid "   B" and resid   54 and name  HE2) 2.364 0.699 0.699 weight 1.000 ! spec=13C_...woLP, no=835, id=771, vol=4.398270e+08
assign (segid "   B" and resid   54 and name  HE2) (segid "   B" and resid   54 and name  HG1) 2.454 0.753 0.753 weight 1.000 ! spec=13C_...woLP, no=836, id=772, vol=3.273296e+08
assign (segid "   B" and resid   55 and name  HB1) (segid "   B" and resid   55 and name   HA) 2.169 0.588 0.588 weight 1.000 ! spec=13C_...woLP, no=837, id=773, vol=1.035272e+09
assign (segid "   B" and resid   55 and name   HA) (segid "   B" and resid   55 and name  HB2) 2.707 0.916 0.916 weight 1.000 ! spec=13C_...woLP, no=839, id=775, vol=4.163288e+08
assign (segid "   B" and resid   55 and name   HA) (segid "   B" and resid   55 and name  HG2) 3.366 1.417 1.417 weight 1.000 ! spec=13C_...woLP, no=841, id=776, vol=1.940850e+08
assign (segid "   B" and resid   35 and name  HB1) (segid "   B" and resid   13 and name HG12) 3.453 1.490 1.490 weight 1.000 ! spec=13C_...woLP, no=896, id=777, vol=1.274114e+08
    or (segid "   B" and resid   35 and name  HB1) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   35 and name  HB1) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid    8 and name   HG) (segid "   B" and resid    8 and name HD12) 2.282 0.651 0.651 weight 1.000 ! spec=13C_...woLP, no=907, id=778, vol=4.932033e+08
    or (segid "   B" and resid    8 and name   HG) (segid "   B" and resid    8 and name HD11)
    or (segid "   B" and resid    8 and name   HG) (segid "   B" and resid    8 and name HD13)
assign (segid "   B" and resid   10 and name   HA) (segid "   B" and resid   10 and name  HB2) 2.404 0.722 0.722 weight 1.000 ! spec=13C_...woLP, no=929, id=779, vol=6.205161e+08
assign (segid "   B" and resid   28 and name   HA) (segid "   B" and resid   28 and name  HG2) 2.599 0.844 0.844 weight 1.000 ! spec=13C_...woLP, no=944, id=782, vol=3.406157e+08
assign (segid "   B" and resid   35 and name  HD2) (segid "   B" and resid   13 and name HG22) 4.055 2.056 2.056 weight 1.000 ! spec=13C_...woLP, no=1055, id=785, vol=6.440322e+07
    or (segid "   B" and resid   35 and name  HD2) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   35 and name  HD2) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   13 and name HG22) (segid "   B" and resid   35 and name  HB2) 2.839 1.007 1.007 weight 1.000 ! spec=13C_...woLP, no=1060, id=787, vol=1.776788e+08
    or (segid "   B" and resid   13 and name HG21) (segid "   B" and resid   35 and name  HB2)
    or (segid "   B" and resid   13 and name HG23) (segid "   B" and resid   35 and name  HB2)
assign (segid "   B" and resid   44 and name HG21) (segid "   B" and resid   44 and name   HB) 2.219 0.615 0.615 weight 1.000 ! spec=13C_...woLP, no=1085, id=789, vol=6.991356e+08
    or (segid "   B" and resid   44 and name HG22) (segid "   B" and resid   44 and name   HB)
    or (segid "   B" and resid   44 and name HG23) (segid "   B" and resid   44 and name   HB)
assign (segid "   B" and resid   11 and name  HB1) (segid "   B" and resid   13 and name HG12) 3.985 1.985 1.985 weight 1.000 ! spec=13C_...woLP, no=1091, id=790, vol=6.364455e+07
    or (segid "   B" and resid   11 and name  HB1) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   11 and name  HB1) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   22 and name  HB2) (segid "   B" and resid   27 and name   HA) 2.979 1.110 1.110 weight 1.000 ! spec=13C_...woLP, no=1094, id=791, vol=1.837520e+08
assign (segid "   B" and resid   34 and name  HB2) (segid "   B" and resid   27 and name   HA) 2.911 1.059 1.059 weight 1.000 ! spec=13C_...woLP, no=1096, id=792, vol=1.879914e+08
assign (segid "   B" and resid   39 and name HG12) (segid "   B" and resid   38 and name   HA) 3.999 1.999 1.999 weight 1.000 ! spec=13C_...woLP, no=1116, id=793, vol=1.209342e+08
    or (segid "   B" and resid   39 and name HG11) (segid "   B" and resid   38 and name   HA)
    or (segid "   B" and resid   39 and name HG13) (segid "   B" and resid   38 and name   HA)
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   20 and name HD22) 2.649 0.877 0.877 weight 1.000 ! spec=13C_...woLP, no=1148, id=797, vol=2.460164e+08
    or (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   29 and name   HB) 2.207 0.609 0.609 weight 1.000 ! spec=13C_...woLP, no=1153, id=798, vol=6.864411e+08
    or (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   29 and name   HB)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   29 and name   HB)
assign (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   30 and name  HD1) 3.746 1.754 1.754 weight 1.000 ! spec=13C_...woLP, no=1160, id=799, vol=9.606391e+07
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   30 and name  HD2)
    or (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   30 and name  HD1)
    or (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   30 and name  HD2)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   30 and name  HD1)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   30 and name  HE1) 3.328 1.385 1.385 weight 1.000 ! spec=13C_...woLP, no=1161, id=800, vol=1.894761e+08
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   30 and name  HE2)
    or (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   30 and name  HE1)
    or (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   30 and name  HE2)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   30 and name  HE1)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   30 and name  HE2)
assign (segid "   B" and resid   46 and name  HB1) (segid "   B" and resid   46 and name  HE3) 4.537 2.573 2.573 weight 1.000 ! spec=13C_...woLP, no=1172, id=802, vol=9.739982e+07
assign (segid "   B" and resid   45 and name  HB1) (segid "   B" and resid   45 and name   HA) 2.327 0.677 0.677 weight 1.000 ! spec=13C_...woLP, no=1174, id=803, vol=6.227962e+08
assign (segid "   B" and resid   45 and name  HB2) (segid "   B" and resid   45 and name   HA) 3.060 1.171 1.171 weight 1.000 ! spec=13C_...woLP, no=1176, id=804, vol=3.280071e+08
assign (segid "   B" and resid   45 and name  HB2) (segid "   B" and resid   45 and name  HB1) 1.928 0.465 0.465 weight 1.000 ! spec=13C_...woLP, no=1178, id=806, vol=1.028220e+09
assign (segid "   B" and resid   45 and name  HD1) (segid "   B" and resid   45 and name  HB1) 4.511 2.543 2.543 weight 1.000 ! spec=13C_...woLP, no=1179, id=807, vol=5.281893e+07
assign (segid "   B" and resid   45 and name  HD2) (segid "   B" and resid   45 and name  HB1) 4.261 2.269 2.269 weight 1.000 ! spec=13C_...woLP, no=1180, id=808, vol=7.717435e+07
assign (segid "   B" and resid   46 and name   HA) (segid "   B" and resid   46 and name  HB1) 2.943 1.083 1.083 weight 1.000 ! spec=13C_...woLP, no=1183, id=811, vol=2.491174e+08
assign (segid "   B" and resid   46 and name   HA) (segid "   B" and resid   46 and name  HB2) 2.842 1.010 1.010 weight 1.000 ! spec=13C_...woLP, no=1184, id=812, vol=2.279370e+08
assign (segid "   B" and resid   46 and name  HB2) (segid "   B" and resid   46 and name  HD1) 4.167 2.170 2.170 weight 1.000 ! spec=13C_...woLP, no=1186, id=814, vol=8.538674e+07
assign (segid "   B" and resid   45 and name  HD1) (segid "   B" and resid   45 and name  HB2) 4.230 2.236 2.236 weight 1.000 ! spec=13C_...woLP, no=1188, id=815, vol=7.790435e+07
assign (segid "   B" and resid   45 and name  HG2) (segid "   B" and resid   45 and name  HB2) 2.445 0.747 0.747 weight 1.000 ! spec=13C_...woLP, no=1189, id=816, vol=5.829195e+08
assign (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   45 and name  HD2) 3.103 1.204 1.204 weight 1.000 ! spec=13C_...woLP, no=1193, id=818, vol=2.795403e+08
assign (segid "   B" and resid   45 and name  HG1) (segid "   B" and resid   45 and name  HD2) 3.220 1.296 1.296 weight 1.000 ! spec=13C_...woLP, no=1198, id=821, vol=2.636511e+08
assign (segid "   B" and resid   47 and name  HB1) (segid "   B" and resid   47 and name   HA) 2.631 0.865 0.865 weight 1.000 ! spec=13C_...woLP, no=1209, id=825, vol=2.686155e+08
assign (segid "   B" and resid   47 and name  HB2) (segid "   B" and resid   47 and name   HA) 2.904 1.054 1.054 weight 1.000 ! spec=13C_...woLP, no=1211, id=826, vol=2.428527e+08
assign (segid "   B" and resid   48 and name   HA) (segid "   B" and resid   48 and name  HB1) 3.376 1.425 1.425 weight 1.000 ! spec=13C_...woLP, no=1217, id=828, vol=1.214757e+08
assign (segid "   B" and resid   35 and name  HD2) (segid "   B" and resid   20 and name HD22) 3.922 1.923 1.923 weight 1.000 ! spec=13C_...woLP, no=1242, id=832, vol=3.284883e+07
    or (segid "   B" and resid   35 and name  HD2) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   35 and name  HD2) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   26 and name  HB1) (segid "   B" and resid   30 and name  HD1) 4.086 2.087 2.087 weight 1.000 ! spec=13C_...woLP, no=1247, id=834, vol=9.316317e+07
    or (segid "   B" and resid   26 and name  HB1) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   50 and name  HD1) (segid "   B" and resid   26 and name  HB2) 3.803 1.807 1.807 weight 1.000 ! spec=13C_...woLP, no=1251, id=836, vol=1.076132e+08
    or (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   26 and name  HB2)
assign (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   29 and name   HA) 2.487 0.773 0.773 weight 1.000 ! spec=13C_...woLP, no=1266, id=838, vol=5.188024e+08
    or (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   29 and name   HA)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   29 and name   HA)
assign (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   35 and name  HB2) 2.400 0.720 0.720 weight 1.000 ! spec=13C_...woLP, no=1276, id=839, vol=5.924002e+08
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name  HB1) 2.423 0.734 0.734 weight 1.000 ! spec=13C_...woLP, no=1319, id=840, vol=4.856243e+08
assign (segid "   B" and resid   34 and name  HB2) (segid "   B" and resid   31 and name   HA) 2.452 0.752 0.752 weight 1.000 ! spec=13C_...woLP, no=1320, id=841, vol=3.802144e+08
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name  HB2) 2.956 1.092 1.092 weight 1.000 ! spec=13C_...woLP, no=1321, id=842, vol=3.373983e+08
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   31 and name   HA) 3.916 1.917 1.917 weight 1.000 ! spec=13C_...woLP, no=1322, id=843, vol=1.715065e+08
assign (segid "   B" and resid   13 and name HG22) (segid "   B" and resid   35 and name  HB1) 4.067 2.067 2.067 weight 1.000 ! spec=13C_...woLP, no=1333, id=844, vol=1.068171e+08
    or (segid "   B" and resid   13 and name HG21) (segid "   B" and resid   35 and name  HB1)
    or (segid "   B" and resid   13 and name HG23) (segid "   B" and resid   35 and name  HB1)
assign (segid "   B" and resid   13 and name HG12) (segid "   B" and resid   35 and name  HB2) 3.117 1.214 1.214 weight 1.000 ! spec=13C_...woLP, no=1334, id=845, vol=9.689649e+07
    or (segid "   B" and resid   13 and name HG11) (segid "   B" and resid   35 and name  HB2)
    or (segid "   B" and resid   13 and name HG13) (segid "   B" and resid   35 and name  HB2)
assign (segid "   B" and resid   20 and name  HB2) (segid "   B" and resid   35 and name  HE1) 4.217 2.223 2.223 weight 1.000 ! spec=13C_...woLP, no=1347, id=848, vol=2.883113e+07
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   35 and name  HE1) 3.531 1.558 1.558 weight 1.000 ! spec=13C_...woLP, no=1351, id=849, vol=1.360337e+08
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   35 and name  HE1)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   35 and name  HE1)
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   34 and name  HB2) 3.493 1.525 1.525 weight 1.000 ! spec=13C_...woLP, no=1357, id=852, vol=1.560725e+08
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   34 and name  HB2)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   34 and name  HB2)
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   34 and name  HB1) 3.278 1.343 1.343 weight 1.000 ! spec=13C_...woLP, no=1359, id=853, vol=1.911319e+08
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   34 and name  HB1)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   34 and name  HB1)
assign (segid "   B" and resid    8 and name   HA) (segid "   B" and resid    8 and name  HB2) 2.736 0.936 0.936 weight 1.000 ! spec=13C_...woLP, no=1458, id=854, vol=2.436924e+08
assign (segid "   B" and resid   45 and name  HD1) (segid "   B" and resid   45 and name  HD2) 1.834 0.421 0.421 weight 1.000 ! spec=13C_...woLP, no=1478, id=857, vol=1.135942e+09
assign (segid "   B" and resid   20 and name HD22) (segid "   B" and resid   34 and name  HB2) 2.997 1.123 1.123 weight 1.000 ! spec=13C_...woLP, no=1484, id=858, vol=2.002900e+08
    or (segid "   B" and resid   20 and name HD21) (segid "   B" and resid   34 and name  HB2)
    or (segid "   B" and resid   20 and name HD23) (segid "   B" and resid   34 and name  HB2)
assign (segid "   B" and resid   30 and name  HD1) (segid "   B" and resid   50 and name  HB1) 3.219 1.295 1.295 weight 1.000 ! spec=13C_...woLP, no=1550, id=860, vol=4.124703e+07
    or (segid "   B" and resid   30 and name  HD2) (segid "   B" and resid   50 and name  HB1)
assign (segid "   B" and resid   30 and name  HD1) (segid "   B" and resid   50 and name  HB2) 2.917 1.064 1.064 weight 1.000 ! spec=13C_...woLP, no=1551, id=861, vol=4.451072e+07
    or (segid "   B" and resid   30 and name  HD2) (segid "   B" and resid   50 and name  HB2)
assign (segid "   B" and resid   49 and name HG11) (segid "   B" and resid   21 and name  HB1) 3.116 1.214 1.214 weight 1.000 ! spec=13C_...woLP, no=1558, id=864, vol=8.003067e+07
assign (segid "   B" and resid   23 and name  HB1) (segid "   B" and resid   23 and name  HB2) 1.995 0.497 0.497 weight 1.000 ! spec=13C_...woLP, no=1601, id=866, vol=7.484407e+08
assign (segid "   B" and resid   31 and name  HD2) (segid "   B" and resid   31 and name   HA) 4.155 2.158 2.158 weight 1.000 ! spec=13C_...woLP, no=1685, id=871, vol=5.340281e+07
assign (segid "   B" and resid   26 and name  HB1) (segid "   B" and resid   22 and name  HB2) 4.309 2.321 2.321 weight 1.000 ! spec=13C_...woLP, no=1691, id=873, vol=1.200326e+08
assign (segid "   B" and resid   50 and name  HE1) (segid "   B" and resid   33 and name  HB2) 3.622 1.640 1.640 weight 1.000 ! spec=13C_...woLP, no=1693, id=874, vol=2.483739e+08
    or (segid "   B" and resid   50 and name  HE2) (segid "   B" and resid   33 and name  HB2)
assign (segid "   B" and resid   39 and name HG22) (segid "   B" and resid   39 and name   HB) 2.000 0.500 0.500 weight 1.000 ! spec=13C_...woLP, no=1710, id=876, vol=1.048770e+09
    or (segid "   B" and resid   39 and name HG21) (segid "   B" and resid   39 and name   HB)
    or (segid "   B" and resid   39 and name HG23) (segid "   B" and resid   39 and name   HB)
assign (segid "   B" and resid   45 and name   HA) (segid "   B" and resid   45 and name  HD2) 3.886 1.888 1.888 weight 1.000 ! spec=13C_...woLP, no=1733, id=877, vol=6.466351e+07
assign (segid "   B" and resid   39 and name HG22) (segid "   B" and resid   39 and name   HA) 2.468 0.761 0.761 weight 1.000 ! spec=13C_...woLP, no=1741, id=878, vol=4.858288e+08
    or (segid "   B" and resid   39 and name HG21) (segid "   B" and resid   39 and name   HA)
    or (segid "   B" and resid   39 and name HG23) (segid "   B" and resid   39 and name   HA)
assign (segid "   B" and resid   28 and name   HA) (segid "   B" and resid   31 and name  HB1) 3.535 1.562 1.562 weight 1.000 ! spec=13C_...woLP, no=1746, id=879, vol=5.016070e+07
assign (segid "   B" and resid   27 and name  HB2) (segid "   B" and resid   24 and name   HA) 2.846 1.013 1.013 weight 1.000 ! spec=13C_...woLP, no=1751, id=881, vol=2.457744e+08
assign (segid "   B" and resid   24 and name  HB1) (segid "   B" and resid   24 and name   HA) 2.886 1.041 1.041 weight 1.000 ! spec=13C_...woLP, no=1753, id=882, vol=4.049395e+08
assign (segid "   B" and resid   24 and name  HB2) (segid "   B" and resid   24 and name   HA) 2.577 0.830 0.830 weight 1.000 ! spec=13C_...woLP, no=1754, id=883, vol=4.107650e+08
assign (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   35 and name  HD2) 2.767 0.957 0.957 weight 1.000 ! spec=13C_...woLP, no=1759, id=884, vol=2.947784e+08
assign (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   31 and name  HD2) 3.266 1.333 1.333 weight 1.000 ! spec=13C_...woLP, no=1760, id=885, vol=1.296783e+08
assign (segid "   B" and resid   49 and name HG22) (segid "   B" and resid   49 and name   HA) 2.625 0.861 0.861 weight 1.000 ! spec=13C_...woLP, no=1771, id=886, vol=3.418200e+08
    or (segid "   B" and resid   49 and name HG21) (segid "   B" and resid   49 and name   HA)
    or (segid "   B" and resid   49 and name HG23) (segid "   B" and resid   49 and name   HA)
assign (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   49 and name HG22) 3.065 1.175 1.175 weight 1.000 ! spec=13C_...woLP, no=1773, id=887, vol=1.488945e+08
    or (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   49 and name HG21)
    or (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   49 and name HG23)
assign (segid "   B" and resid   36 and name HD12) (segid "   B" and resid   33 and name   HA) 2.979 1.109 1.109 weight 1.000 ! spec=13C_...woLP, no=1806, id=889, vol=2.204249e+08
    or (segid "   B" and resid   36 and name HD11) (segid "   B" and resid   33 and name   HA)
    or (segid "   B" and resid   36 and name HD13) (segid "   B" and resid   33 and name   HA)
assign (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   36 and name HD12) 3.650 1.666 1.666 weight 1.000 ! spec=13C_...woLP, no=1807, id=890, vol=1.761610e+08
    or (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   36 and name HD11)
    or (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   36 and name HD13)
assign (segid "   B" and resid   21 and name  HE1) (segid "   B" and resid   19 and name   HA) 4.658 2.712 2.712 weight 1.000 ! spec=13C_...woLP, no=1820, id=891, vol=5.627087e+07
    or (segid "   B" and resid   21 and name  HE2) (segid "   B" and resid   19 and name   HA)
assign (segid "   B" and resid   33 and name   HA) (segid "   B" and resid   32 and name  HB2) 4.143 2.146 2.146 weight 1.000 ! spec=13C_...woLP, no=1828, id=893, vol=3.373459e+07
assign (segid "   B" and resid   33 and name   HA) (segid "   B" and resid   32 and name  HB1) 4.415 2.436 2.436 weight 1.000 ! spec=13C_...woLP, no=1829, id=894, vol=3.669905e+07
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   27 and name   HA) 3.424 1.466 1.466 weight 1.000 ! spec=13C_...woLP, no=1841, id=895, vol=1.174772e+08
assign (segid "   B" and resid   30 and name   HA) (segid "   B" and resid   30 and name  HD1) 3.225 1.300 1.300 weight 1.000 ! spec=13C_...woLP, no=1844, id=896, vol=2.916665e+08
    or (segid "   B" and resid   30 and name   HA) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   53 and name  HG2) (segid "   B" and resid   50 and name   HA) 4.170 2.174 2.174 weight 1.000 ! spec=13C_...woLP, no=1846, id=897, vol=3.162845e+07
assign (segid "   B" and resid   33 and name  HB2) (segid "   B" and resid   30 and name  HB1) 3.823 1.826 1.826 weight 1.000 ! spec=13C_...woLP, no=1850, id=898, vol=2.225687e+08
assign (segid "   B" and resid   44 and name HG21) (segid "   B" and resid   45 and name  HD1) 4.333 2.347 2.347 weight 1.000 ! spec=13C_...woLP, no=1921, id=903, vol=8.806478e+07
    or (segid "   B" and resid   44 and name HG22) (segid "   B" and resid   45 and name  HD1)
    or (segid "   B" and resid   44 and name HG23) (segid "   B" and resid   45 and name  HD1)
assign (segid "   B" and resid   37 and name  HD1) (segid "   B" and resid   37 and name  HG1) 3.043 1.157 1.157 weight 1.000 ! spec=13C_...woLP, no=1926, id=904, vol=3.142547e+08
assign (segid "   B" and resid   20 and name  HB2) (segid "   B" and resid   34 and name  HB1) 3.319 1.377 1.377 weight 1.000 ! spec=13C_...woLP, no=1955, id=907, vol=7.746964e+07
assign (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   35 and name  HB1) 2.819 0.993 0.993 weight 1.000 ! spec=13C_...woLP, no=1963, id=910, vol=4.199792e+08
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   35 and name  HB2) 4.485 2.515 2.515 weight 1.000 ! spec=13C_...woLP, no=1978, id=911, vol=3.929462e+07
assign (segid "   B" and resid   49 and name HG22) (segid "   B" and resid   21 and name  HB1) 3.471 1.506 1.506 weight 1.000 ! spec=13C_...woLP, no=2029, id=914, vol=1.170268e+08
    or (segid "   B" and resid   49 and name HG21) (segid "   B" and resid   21 and name  HB1)
    or (segid "   B" and resid   49 and name HG23) (segid "   B" and resid   21 and name  HB1)
assign (segid "   B" and resid   38 and name  HG1) (segid "   B" and resid   38 and name  HB1) 2.350 0.690 0.690 weight 1.000 ! spec=13C_...woLP, no=2036, id=916, vol=5.180151e+08
assign (segid "   B" and resid   38 and name  HG2) (segid "   B" and resid   38 and name  HB1) 2.764 0.955 0.955 weight 1.000 ! spec=13C_...woLP, no=2037, id=917, vol=3.291890e+08
assign (segid "   B" and resid   38 and name  HG2) (segid "   B" and resid   38 and name  HD2) 3.101 1.202 1.202 weight 1.000 ! spec=13C_...woLP, no=2039, id=919, vol=1.926852e+08
assign (segid "   B" and resid   38 and name  HG1) (segid "   B" and resid   38 and name  HD2) 2.540 0.806 0.806 weight 1.000 ! spec=13C_...woLP, no=2040, id=920, vol=2.571484e+08
assign (segid "   B" and resid   38 and name  HG1) (segid "   B" and resid   38 and name  HD1) 3.432 1.473 1.473 weight 1.000 ! spec=13C_...woLP, no=2041, id=921, vol=1.497021e+08
assign (segid "   B" and resid   38 and name  HG2) (segid "   B" and resid   38 and name   HA) 3.935 1.935 1.935 weight 1.000 ! spec=13C_...woLP, no=2042, id=922, vol=8.881644e+07
assign (segid "   B" and resid   45 and name  HB2) (segid "   B" and resid   45 and name  HD2) 3.078 1.184 1.184 weight 1.000 ! spec=13C_...woLP, no=2067, id=924, vol=1.718959e+08
assign (segid "   B" and resid   46 and name  HH2) (segid "   B" and resid   45 and name  HD1) 4.080 2.081 2.081 weight 1.000 ! spec=13C_...woLP, no=2076, id=925, vol=5.882801e+07
assign (segid "   B" and resid   45 and name  HD1) (segid "   B" and resid   45 and name  HG2) 3.129 1.224 1.224 weight 1.000 ! spec=13C_...woLP, no=2078, id=926, vol=1.773925e+08
assign (segid "   B" and resid   45 and name  HG2) (segid "   B" and resid   45 and name   HA) 4.249 2.257 2.257 weight 1.000 ! spec=13C_...woLP, no=2080, id=927, vol=9.349942e+07
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   43 and name   HA) 3.688 1.700 2.312 weight 1.000 ! spec=13C_...woLP, no=2086, id=928, vol=2.137007e+08
assign (segid "   B" and resid   35 and name  HB1) (segid "   B" and resid   32 and name   HA) 3.322 1.380 1.380 weight 1.000 ! spec=13C_...woLP, no=2126, id=933, vol=9.103899e+07
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   31 and name  HD2) 3.596 1.616 1.616 weight 1.000 ! spec=13C_...woLP, no=2129, id=934, vol=6.213567e+07
assign (segid "   B" and resid   49 and name HG22) (segid "   B" and resid   50 and name  HD1) 4.192 2.196 2.196 weight 1.000 ! spec=13C_...woLP, no=2141, id=936, vol=1.106778e+08
    or (segid "   B" and resid   49 and name HG22) (segid "   B" and resid   50 and name  HD2)
    or (segid "   B" and resid   49 and name HG21) (segid "   B" and resid   50 and name  HD1)
    or (segid "   B" and resid   49 and name HG21) (segid "   B" and resid   50 and name  HD2)
    or (segid "   B" and resid   49 and name HG23) (segid "   B" and resid   50 and name  HD1)
    or (segid "   B" and resid   49 and name HG23) (segid "   B" and resid   50 and name  HD2)
assign (segid "   B" and resid   38 and name  HD2) (segid "   B" and resid   38 and name   HA) 3.575 1.597 1.597 weight 1.000 ! spec=13C_...woLP, no=2145, id=937, vol=9.138800e+07
assign (segid "   B" and resid   35 and name  HD2) (segid "   B" and resid   32 and name  HG2) 4.779 2.854 2.854 weight 1.000 ! spec=13C_...woLP, no=2159, id=938, vol=3.058564e+07
assign (segid "   B" and resid   31 and name  HD2) (segid "   B" and resid   11 and name  HB1) 3.350 1.403 1.403 weight 1.000 ! spec=13C_...woLP, no=2164, id=939, vol=7.624638e+07
assign (segid "   B" and resid   11 and name  HB2) (segid "   B" and resid   11 and name   HA) 3.022 1.142 1.142 weight 1.000 ! spec=13C_...woLP, no=2167, id=940, vol=2.230030e+08
assign (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   13 and name HG12) 3.474 1.509 1.509 weight 1.000 ! spec=13C_...woLP, no=2179, id=941, vol=9.340209e+07
    or (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   36 and name HD12) 3.899 1.900 1.900 weight 1.000 ! spec=13C_...woLP, no=2206, id=947, vol=4.835962e+07
    or (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   36 and name HD11)
    or (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   36 and name HD13)
assign (segid "   B" and resid    8 and name HD22) (segid "   B" and resid   14 and name  HB1) 3.967 1.967 1.967 weight 1.000 ! spec=13C_...woLP, no=2228, id=952, vol=5.356600e+07
    or (segid "   B" and resid    8 and name HD21) (segid "   B" and resid   14 and name  HB1)
    or (segid "   B" and resid    8 and name HD23) (segid "   B" and resid   14 and name  HB1)
assign (segid "   B" and resid    8 and name  HB2) (segid "   B" and resid   11 and name  HB2) 3.644 1.660 1.660 weight 1.000 ! spec=13C_...woLP, no=2230, id=953, vol=6.561321e+07
assign (segid "   B" and resid    8 and name  HB2) (segid "   B" and resid   11 and name  HB1) 3.720 1.730 1.730 weight 1.000 ! spec=13C_...woLP, no=2232, id=954, vol=9.830041e+07
assign (segid "   B" and resid    8 and name HD22) (segid "   B" and resid   14 and name  HB2) 3.276 1.341 1.341 weight 1.000 ! spec=13C_...woLP, no=2233, id=955, vol=9.171807e+07
    or (segid "   B" and resid    8 and name HD21) (segid "   B" and resid   14 and name  HB2)
    or (segid "   B" and resid    8 and name HD23) (segid "   B" and resid   14 and name  HB2)
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   21 and name  HB1) 3.471 1.506 1.506 weight 1.000 ! spec=13C_...woLP, no=2268, id=957, vol=1.385016e+08
assign (segid "   B" and resid   26 and name  HB2) (segid "   B" and resid   22 and name  HB2) 4.522 2.556 2.556 weight 1.000 ! spec=13C_...woLP, no=2272, id=958, vol=1.358008e+08
assign (segid "   B" and resid   26 and name   HA) (segid "   B" and resid   29 and name   HB) 2.826 0.998 0.998 weight 1.000 ! spec=13C_...woLP, no=2282, id=959, vol=2.230449e+08
assign (segid "   B" and resid   25 and name HG21) (segid "   B" and resid   26 and name   HA) 3.437 1.476 1.476 weight 1.000 ! spec=13C_...woLP, no=2285, id=960, vol=8.799034e+07
    or (segid "   B" and resid   25 and name HG22) (segid "   B" and resid   26 and name   HA)
    or (segid "   B" and resid   25 and name HG23) (segid "   B" and resid   26 and name   HA)
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   27 and name   HA) 2.893 1.046 1.046 weight 1.000 ! spec=13C_...woLP, no=2288, id=961, vol=2.061664e+08
assign (segid "   B" and resid   20 and name HD22) (segid "   B" and resid   27 and name   HA) 3.873 1.875 1.875 weight 1.000 ! spec=13C_...woLP, no=2289, id=962, vol=5.613268e+07
    or (segid "   B" and resid   20 and name HD21) (segid "   B" and resid   27 and name   HA)
    or (segid "   B" and resid   20 and name HD23) (segid "   B" and resid   27 and name   HA)
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   27 and name   HA) 4.514 2.547 2.547 weight 1.000 ! spec=13C_...woLP, no=2290, id=963, vol=4.375934e+07
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   27 and name   HA)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   27 and name   HA)
assign (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   29 and name   HB) 2.172 0.590 0.590 weight 1.000 ! spec=13C_...woLP, no=2312, id=969, vol=7.642622e+08
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   29 and name   HB)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   29 and name   HB)
assign (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   30 and name  HE1) 3.922 1.923 1.923 weight 1.000 ! spec=13C_...woLP, no=2313, id=970, vol=1.124102e+08
    or (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   30 and name  HE2)
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   30 and name  HE1)
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   30 and name  HE2)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   30 and name  HE1)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   30 and name  HE2)
assign (segid "   B" and resid   38 and name  HD1) (segid "   B" and resid   38 and name   HA) 3.588 1.609 1.609 weight 1.000 ! spec=13C_...woLP, no=2331, id=972, vol=7.484896e+07
assign (segid "   B" and resid   40 and name   HA) (segid "   B" and resid   40 and name  HG1) 2.951 1.089 1.089 weight 1.000 ! spec=13C_...woLP, no=2368, id=977, vol=2.671180e+08
assign (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   20 and name HD22) 3.105 1.205 1.205 weight 1.000 ! spec=13C_...woLP, no=2373, id=978, vol=1.503726e+08
    or (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   35 and name  HD2) (segid "   B" and resid   35 and name   HA) 4.057 2.057 2.057 weight 1.000 ! spec=13C_...woLP, no=2376, id=979, vol=5.198612e+07
assign (segid "   B" and resid   22 and name  HB2) (segid "   B" and resid   22 and name   HA) 3.346 1.400 1.400 weight 1.000 ! spec=13C_...woLP, no=2399, id=983, vol=1.319672e+08
assign (segid "   B" and resid   48 and name  HB2) (segid "   B" and resid   22 and name   HA) 3.275 1.341 1.341 weight 1.000 ! spec=13C_...woLP, no=2400, id=984, vol=9.952496e+07
assign (segid "   B" and resid   48 and name   HA) (segid "   B" and resid   22 and name   HA) 2.580 0.832 0.832 weight 1.000 ! spec=13C_...woLP, no=2401, id=985, vol=3.597487e+08
assign (segid "   B" and resid   36 and name HG22) (segid "   B" and resid   36 and name   HA) 2.393 0.716 0.716 weight 1.000 ! spec=13C_...woLP, no=2408, id=986, vol=6.217858e+08
    or (segid "   B" and resid   36 and name HG21) (segid "   B" and resid   36 and name   HA)
    or (segid "   B" and resid   36 and name HG23) (segid "   B" and resid   36 and name   HA)
assign (segid "   B" and resid   49 and name   HA) (segid "   B" and resid   49 and name HD12) 4.064 2.065 2.065 weight 1.000 ! spec=13C_...woLP, no=2413, id=987, vol=9.863591e+07
    or (segid "   B" and resid   49 and name   HA) (segid "   B" and resid   49 and name HD11)
    or (segid "   B" and resid   49 and name   HA) (segid "   B" and resid   49 and name HD13)
assign (segid "   B" and resid   49 and name HD12) (segid "   B" and resid   49 and name   HB) 2.412 0.727 0.727 weight 1.000 ! spec=13C_...woLP, no=2414, id=988, vol=5.754078e+08
    or (segid "   B" and resid   49 and name HD11) (segid "   B" and resid   49 and name   HB)
    or (segid "   B" and resid   49 and name HD13) (segid "   B" and resid   49 and name   HB)
assign (segid "   B" and resid   49 and name HD12) (segid "   B" and resid   49 and name HG11) 1.924 0.463 0.463 weight 1.000 ! spec=13C_...woLP, no=2415, id=989, vol=1.351592e+09
    or (segid "   B" and resid   49 and name HD11) (segid "   B" and resid   49 and name HG11)
    or (segid "   B" and resid   49 and name HD13) (segid "   B" and resid   49 and name HG11)
assign (segid "   B" and resid   49 and name HD12) (segid "   B" and resid   21 and name  HB1) 2.672 0.892 0.892 weight 1.000 ! spec=13C_...woLP, no=2417, id=990, vol=2.996805e+08
    or (segid "   B" and resid   49 and name HD11) (segid "   B" and resid   21 and name  HB1)
    or (segid "   B" and resid   49 and name HD13) (segid "   B" and resid   21 and name  HB1)
assign (segid "   B" and resid   49 and name HD12) (segid "   B" and resid   21 and name  HB2) 3.505 1.535 1.535 weight 1.000 ! spec=13C_...woLP, no=2419, id=992, vol=1.546618e+08
    or (segid "   B" and resid   49 and name HD11) (segid "   B" and resid   21 and name  HB2)
    or (segid "   B" and resid   49 and name HD13) (segid "   B" and resid   21 and name  HB2)
assign (segid "   B" and resid   49 and name HD12) (segid "   B" and resid   34 and name   HA) 2.553 0.815 0.815 weight 1.000 ! spec=13C_...woLP, no=2420, id=993, vol=4.296424e+08
    or (segid "   B" and resid   49 and name HD11) (segid "   B" and resid   34 and name   HA)
    or (segid "   B" and resid   49 and name HD13) (segid "   B" and resid   34 and name   HA)
assign (segid "   B" and resid    8 and name HD12) (segid "   B" and resid    8 and name   HA) 3.634 1.651 1.651 weight 1.000 ! spec=13C_...woLP, no=2430, id=997, vol=1.955632e+08
    or (segid "   B" and resid    8 and name HD11) (segid "   B" and resid    8 and name   HA)
    or (segid "   B" and resid    8 and name HD13) (segid "   B" and resid    8 and name   HA)
assign (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   30 and name  HD1) 4.283 2.293 2.293 weight 1.000 ! spec=13C_...woLP, no=2452, id=1002, vol=8.043273e+07
    or (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   30 and name  HD2)
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   30 and name  HD1)
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   30 and name  HD2)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   30 and name  HD1)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   20 and name   HA) (segid "   B" and resid   20 and name   HG) 2.893 1.046 1.046 weight 1.000 ! spec=13C_...woLP, no=2455, id=1004, vol=1.667921e+08
assign (segid "   B" and resid   13 and name HG12) (segid "   B" and resid   18 and name  HA1) 3.687 1.699 1.699 weight 1.000 ! spec=13C_...woLP, no=2456, id=1005, vol=5.609374e+07
    or (segid "   B" and resid   13 and name HG11) (segid "   B" and resid   18 and name  HA1)
    or (segid "   B" and resid   13 and name HG13) (segid "   B" and resid   18 and name  HA1)
assign (segid "   B" and resid   50 and name  HE1) (segid "   B" and resid   33 and name  HB1) 3.722 1.732 1.732 weight 1.000 ! spec=13C_...woLP, no=2463, id=1009, vol=2.995904e+08
    or (segid "   B" and resid   50 and name  HE2) (segid "   B" and resid   33 and name  HB1)
assign (segid "   B" and resid   21 and name  HD1) (segid "   B" and resid   20 and name   HA) 3.990 1.990 1.990 weight 1.000 ! spec=13C_...woLP, no=2472, id=1011, vol=1.004904e+08
    or (segid "   B" and resid   21 and name  HD2) (segid "   B" and resid   20 and name   HA)
assign (segid "   B" and resid   48 and name   HA) (segid "   B" and resid   48 and name  HB2) 2.874 1.032 1.032 weight 1.000 ! spec=13C_...woLP, no=2480, id=1013, vol=1.557668e+08
assign (segid "   B" and resid   22 and name   HA) (segid "   B" and resid   48 and name  HB1) 4.715 2.779 2.779 weight 1.000 ! spec=13C_...woLP, no=2482, id=1015, vol=3.740107e+07
assign (segid "   B" and resid   26 and name   HA) (segid "   B" and resid   30 and name  HD1) 3.826 1.830 1.830 weight 1.000 ! spec=13C_...woLP, no=2493, id=1017, vol=1.071660e+08
    or (segid "   B" and resid   26 and name   HA) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   26 and name  HB2) (segid "   B" and resid   29 and name   HB) 3.921 1.922 1.922 weight 1.000 ! spec=13C_...woLP, no=2495, id=1018, vol=4.841232e+07
assign (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   29 and name   HA) 2.248 0.631 0.631 weight 1.000 ! spec=13C_...woLP, no=2498, id=1020, vol=9.832234e+08
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   29 and name   HA)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   29 and name   HA)
assign (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   29 and name HG22) 1.929 0.465 0.465 weight 1.000 ! spec=13C_...woLP, no=2501, id=1021, vol=1.260896e+09
    or (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   29 and name HG21)
    or (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   29 and name HG23)
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   29 and name HG22)
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   29 and name HG21)
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   29 and name HG23)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   29 and name HG22)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   29 and name HG21)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   29 and name HG23)
assign (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   25 and name   HA) 4.020 2.020 2.020 weight 1.000 ! spec=13C_...woLP, no=2504, id=1024, vol=3.481337e+07
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   25 and name   HA)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   25 and name   HA)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   33 and name   HA) 4.342 2.356 2.356 weight 1.000 ! spec=13C_...woLP, no=2506, id=1025, vol=3.776259e+07
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   30 and name   HA) 3.321 1.379 1.379 weight 1.000 ! spec=15N_...Y_FI, no=6, id=1, vol=1.899553e+07
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   30 and name  HB1) 3.101 1.202 1.202 weight 1.000 ! spec=15N_...Y_FI, no=12, id=2, vol=2.092131e+07
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   30 and name  HB2) 3.559 1.583 1.583 weight 1.000 ! spec=15N_...Y_FI, no=17, id=3, vol=3.345618e+07
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   29 and name   HB) 2.861 1.023 1.023 weight 1.000 ! spec=15N_...Y_FI, no=18, id=4, vol=3.906800e+07
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   29 and name HG12) 3.969 1.969 1.969 weight 1.000 ! spec=15N_...Y_FI, no=19, id=5, vol=2.155928e+07
    or (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   29 and name HG11)
    or (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   29 and name HG13)
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   29 and name HG22) 3.971 1.971 1.971 weight 1.000 ! spec=15N_...Y_FI, no=20, id=6, vol=1.355917e+07
    or (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   29 and name HG21)
    or (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   29 and name HG23)
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   21 and name  HD1) 3.403 1.447 1.447 weight 1.000 ! spec=15N_...Y_FI, no=22, id=7, vol=3.910884e+07
    or (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   21 and name  HD2)
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   35 and name   HA) 3.825 1.828 1.828 weight 1.000 ! spec=15N_...Y_FI, no=24, id=9, vol=1.020424e+07
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   21 and name   HA) 3.227 1.302 1.302 weight 1.000 ! spec=15N_...Y_FI, no=25, id=10, vol=2.329396e+07
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   20 and name   HA) 2.301 0.662 0.662 weight 1.000 ! spec=15N_...Y_FI, no=26, id=11, vol=1.276728e+08
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   21 and name  HB2) 4.039 2.039 2.039 weight 1.000 ! spec=15N_...Y_FI, no=28, id=12, vol=2.059631e+07
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   21 and name  HB1) 2.652 0.879 0.879 weight 1.000 ! spec=15N_...Y_FI, no=30, id=13, vol=4.981138e+07
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   20 and name  HB1) 4.525 2.560 2.560 weight 1.000 ! spec=15N_...Y_FI, no=31, id=14, vol=1.013954e+07
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   20 and name  HB2) 3.219 1.295 1.295 weight 1.000 ! spec=15N_...Y_FI, no=32, id=15, vol=2.629220e+07
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   20 and name HD12) 4.592 2.635 2.635 weight 1.000 ! spec=15N_...Y_FI, no=33, id=16, vol=1.133463e+07
    or (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   20 and name HD11)
    or (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   20 and name HD13)
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   51 and name   HN) 2.581 0.832 0.832 weight 1.000 ! spec=15N_...Y_FI, no=35, id=17, vol=6.147992e+07
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name   HN) 2.804 0.983 0.983 weight 1.000 ! spec=15N_...Y_FI, no=36, id=18, vol=3.262142e+07
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   50 and name  HD1) 3.960 1.960 1.960 weight 1.000 ! spec=15N_...Y_FI, no=37, id=19, vol=1.673268e+07
    or (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   50 and name  HD2)
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   48 and name   HA) 4.224 2.231 2.231 weight 1.000 ! spec=15N_...Y_FI, no=38, id=20, vol=8.801678e+06
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   50 and name   HA) 3.213 1.291 1.291 weight 1.000 ! spec=15N_...Y_FI, no=39, id=21, vol=2.119820e+07
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name   HA) 3.643 1.659 1.659 weight 1.000 ! spec=15N_...Y_FI, no=40, id=22, vol=1.118603e+07
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   50 and name  HB1) 2.757 0.950 0.950 weight 1.000 ! spec=15N_...Y_FI, no=42, id=23, vol=3.378666e+07
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   50 and name  HB2) 4.076 2.077 2.077 weight 1.000 ! spec=15N_...Y_FI, no=43, id=24, vol=2.401387e+07
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name   HB) 3.588 1.609 1.609 weight 1.000 ! spec=15N_...Y_FI, no=45, id=25, vol=1.648494e+07
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name HG11) 3.880 1.882 1.882 weight 1.000 ! spec=15N_...Y_FI, no=46, id=26, vol=2.149668e+07
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name HG22) 4.254 2.262 2.262 weight 1.000 ! spec=15N_...Y_FI, no=47, id=27, vol=1.290636e+07
    or (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name HG21)
    or (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name HG23)
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   35 and name   HA) 2.988 1.116 1.116 weight 1.000 ! spec=15N_...Y_FI, no=54, id=30, vol=3.684887e+07
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   34 and name   HA) 3.329 1.385 1.385 weight 1.000 ! spec=15N_...Y_FI, no=55, id=31, vol=2.030080e+07
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   35 and name  HB2) 3.594 1.614 1.614 weight 1.000 ! spec=15N_...Y_FI, no=57, id=32, vol=4.722778e+07
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   35 and name  HB1) 2.299 0.661 0.661 weight 1.000 ! spec=15N_...Y_FI, no=58, id=33, vol=1.074769e+08
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   34 and name  HB1) 3.837 1.840 1.840 weight 1.000 ! spec=15N_...Y_FI, no=60, id=34, vol=1.349346e+07
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   36 and name   HB) 4.677 2.734 2.734 weight 1.000 ! spec=15N_...Y_FI, no=61, id=35, vol=9.638718e+06
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   36 and name HG11) 3.901 1.903 1.903 weight 1.000 ! spec=15N_...Y_FI, no=62, id=36, vol=1.091913e+07
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   36 and name HG12) 5.107 3.260 3.260 weight 1.000 ! spec=15N_...Y_FI, no=63, id=37, vol=7.647868e+06
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   36 and name HD12) 4.601 2.646 2.646 weight 1.000 ! spec=15N_...Y_FI, no=64, id=38, vol=9.849763e+06
    or (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   36 and name HD11)
    or (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   36 and name HD13)
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   32 and name   HN) 2.966 1.100 1.100 weight 1.000 ! spec=15N_...Y_FI, no=66, id=39, vol=3.556145e+07
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   30 and name   HN) 2.907 1.056 1.056 weight 1.000 ! spec=15N_...Y_FI, no=67, id=40, vol=3.804088e+07
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   30 and name   HA) 2.761 0.953 0.953 weight 1.000 ! spec=15N_...Y_FI, no=70, id=41, vol=5.321526e+07
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   29 and name   HA) 3.706 1.717 1.717 weight 1.000 ! spec=15N_...Y_FI, no=72, id=42, vol=1.144781e+07
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   31 and name   HA) 2.695 0.908 0.908 weight 1.000 ! spec=15N_...Y_FI, no=73, id=43, vol=6.605800e+07
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   31 and name  HB1) 2.293 0.657 0.657 weight 1.000 ! spec=15N_...Y_FI, no=74, id=44, vol=1.530862e+08
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   31 and name  HB2) 2.457 0.755 0.755 weight 1.000 ! spec=15N_...Y_FI, no=76, id=45, vol=1.200304e+08
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   32 and name  HB1) 4.594 2.638 2.638 weight 1.000 ! spec=15N_...Y_FI, no=78, id=47, vol=9.230711e+06
assign (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   30 and name   HN) 2.435 0.741 0.741 weight 1.000 ! spec=15N_...Y_FI, no=86, id=50, vol=9.555704e+07
assign (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   29 and name   HB) 2.507 0.786 0.786 weight 1.000 ! spec=15N_...Y_FI, no=97, id=53, vol=7.636408e+07
assign (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   29 and name HG12) 2.457 0.755 0.755 weight 1.000 ! spec=15N_...Y_FI, no=100, id=55, vol=1.004466e+08
    or (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   29 and name HG11)
    or (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   29 and name HG13)
assign (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   29 and name HG22) 3.634 1.651 1.651 weight 1.000 ! spec=15N_...Y_FI, no=102, id=56, vol=2.980588e+07
    or (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   29 and name HG21)
    or (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   29 and name HG23)
assign (segid "   B" and resid   28 and name   HN) (segid "   B" and resid   27 and name   HN) 2.688 0.903 0.903 weight 1.000 ! spec=15N_...Y_FI, no=103, id=57, vol=5.182013e+07
assign (segid "   B" and resid   28 and name   HN) (segid "   B" and resid   28 and name   HA) 2.609 0.851 0.851 weight 1.000 ! spec=15N_...Y_FI, no=106, id=58, vol=8.198414e+07
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   44 and name   HA) 2.868 1.028 1.028 weight 1.000 ! spec=15N_...Y_FI, no=110, id=60, vol=3.366143e+07
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   43 and name   HA) 2.295 0.658 0.658 weight 1.000 ! spec=15N_...Y_FI, no=111, id=61, vol=1.279608e+08
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   44 and name   HB) 3.495 1.527 1.527 weight 1.000 ! spec=15N_...Y_FI, no=113, id=62, vol=2.426817e+07
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   44 and name HG21) 2.843 1.010 1.010 weight 1.000 ! spec=15N_...Y_FI, no=117, id=63, vol=4.020900e+07
    or (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   44 and name HG23)
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   43 and name  HB1) 3.457 1.494 1.494 weight 1.000 ! spec=15N_...Y_FI, no=118, id=64, vol=2.047892e+07
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   43 and name  HB2) 4.030 2.030 2.030 weight 1.000 ! spec=15N_...Y_FI, no=119, id=65, vol=1.828566e+07
assign (segid "   B" and resid    7 and name HD21) (segid "   B" and resid    7 and name HD22) 1.683 0.354 0.354 weight 1.000 ! spec=15N_...Y_FI, no=123, id=67, vol=4.365159e+08
assign (segid "   B" and resid    7 and name HD21) (segid "   B" and resid    7 and name  HB1) 4.604 2.650 2.650 weight 1.000 ! spec=15N_...Y_FI, no=127, id=69, vol=8.438409e+06
assign (segid "   B" and resid    7 and name HD22) (segid "   B" and resid    7 and name  HB2) 2.987 1.115 1.115 weight 1.000 ! spec=15N_...Y_FI, no=128, id=70, vol=3.442534e+07
assign (segid "   B" and resid   47 and name HD22) (segid "   B" and resid   47 and name HD21) 1.677 0.352 0.352 weight 1.000 ! spec=15N_...Y_FI, no=146, id=77, vol=2.986737e+08
assign (segid "   B" and resid   47 and name HD21) (segid "   B" and resid   47 and name  HB1) 4.264 2.273 2.273 weight 1.000 ! spec=15N_...Y_FI, no=147, id=78, vol=9.811567e+06
assign (segid "   B" and resid   47 and name HD21) (segid "   B" and resid   47 and name  HB2) 4.554 2.593 2.593 weight 1.000 ! spec=15N_...Y_FI, no=148, id=79, vol=8.091745e+06
assign (segid "   B" and resid   47 and name HD21) (segid "   B" and resid   44 and name HG21) 4.450 2.475 2.475 weight 1.000 ! spec=15N_...Y_FI, no=149, id=80, vol=7.254812e+06
    or (segid "   B" and resid   47 and name HD21) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   47 and name HD21) (segid "   B" and resid   44 and name HG23)
assign (segid "   B" and resid    2 and name   HN) (segid "   B" and resid    2 and name  HB2) 4.339 2.353 2.353 weight 1.000 ! spec=15N_...Y_FI, no=153, id=81, vol=3.683938e+06
    or (segid "   B" and resid    2 and name   HN) (segid "   B" and resid    2 and name  HB1)
    or (segid "   B" and resid    2 and name   HN) (segid "   B" and resid    2 and name  HB3)
assign (segid "   B" and resid    3 and name   HN) (segid "   B" and resid    2 and name   HA) 3.044 1.159 1.159 weight 1.000 ! spec=15N_...Y_FI, no=155, id=82, vol=3.200308e+07
assign (segid "   B" and resid    3 and name   HN) (segid "   B" and resid    2 and name  HB2) 4.218 2.224 2.224 weight 1.000 ! spec=15N_...Y_FI, no=159, id=84, vol=8.990001e+06
    or (segid "   B" and resid    3 and name   HN) (segid "   B" and resid    2 and name  HB1)
    or (segid "   B" and resid    3 and name   HN) (segid "   B" and resid    2 and name  HB3)
assign (segid "   B" and resid    4 and name   HN) (segid "   B" and resid    3 and name   HA) 2.766 0.957 0.957 weight 1.000 ! spec=15N_...Y_FI, no=165, id=86, vol=5.410227e+07
assign (segid "   B" and resid    5 and name   HN) (segid "   B" and resid    5 and name   HA) 2.763 0.954 0.954 weight 1.000 ! spec=15N_...Y_FI, no=177, id=91, vol=5.514086e+07
assign (segid "   B" and resid    5 and name   HN) (segid "   B" and resid    5 and name  HB1) 2.661 0.885 0.885 weight 1.000 ! spec=15N_...Y_FI, no=185, id=94, vol=7.264800e+07
assign (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    5 and name   HA) 2.329 0.678 0.678 weight 1.000 ! spec=15N_...Y_FI, no=190, id=95, vol=1.330357e+08
assign (segid "   B" and resid    7 and name   HN) (segid "   B" and resid    6 and name   HN) 3.364 1.414 1.414 weight 1.000 ! spec=15N_...Y_FI, no=198, id=100, vol=2.613320e+07
assign (segid "   B" and resid    7 and name   HN) (segid "   B" and resid    6 and name   HA) 2.347 0.688 0.688 weight 1.000 ! spec=15N_...Y_FI, no=199, id=101, vol=8.331846e+07
assign (segid "   B" and resid    7 and name   HN) (segid "   B" and resid    7 and name  HB1) 2.971 1.103 1.103 weight 1.000 ! spec=15N_...Y_FI, no=201, id=102, vol=2.869477e+07
assign (segid "   B" and resid    7 and name   HN) (segid "   B" and resid    7 and name  HB2) 3.097 1.199 1.199 weight 1.000 ! spec=15N_...Y_FI, no=202, id=103, vol=2.843188e+07
assign (segid "   B" and resid    7 and name   HN) (segid "   B" and resid    6 and name  HB1) 3.508 1.538 1.538 weight 1.000 ! spec=15N_...Y_FI, no=203, id=104, vol=2.730498e+07
assign (segid "   B" and resid    8 and name   HN) (segid "   B" and resid    8 and name   HA) 2.599 0.845 0.845 weight 1.000 ! spec=15N_...Y_FI, no=206, id=106, vol=5.622487e+07
assign (segid "   B" and resid    8 and name   HN) (segid "   B" and resid    7 and name  HB1) 3.640 1.656 1.656 weight 1.000 ! spec=15N_...Y_FI, no=211, id=107, vol=2.499153e+07
assign (segid "   B" and resid    8 and name   HN) (segid "   B" and resid    7 and name  HB2) 3.605 1.625 1.625 weight 1.000 ! spec=15N_...Y_FI, no=212, id=108, vol=2.475922e+07
assign (segid "   B" and resid    8 and name   HN) (segid "   B" and resid    6 and name  HB1) 3.974 1.974 1.974 weight 1.000 ! spec=15N_...Y_FI, no=213, id=109, vol=9.745754e+06
assign (segid "   B" and resid    8 and name   HN) (segid "   B" and resid    8 and name   HG) 1.999 0.499 0.499 weight 1.000 ! spec=15N_...Y_FI, no=214, id=110, vol=1.959320e+08
assign (segid "   B" and resid    8 and name   HN) (segid "   B" and resid    8 and name HD22) 3.791 1.796 1.796 weight 1.000 ! spec=15N_...Y_FI, no=215, id=111, vol=2.664352e+07
    or (segid "   B" and resid    8 and name   HN) (segid "   B" and resid    8 and name HD21)
    or (segid "   B" and resid    8 and name   HN) (segid "   B" and resid    8 and name HD23)
assign (segid "   B" and resid    9 and name   HN) (segid "   B" and resid    8 and name   HA) 2.545 0.810 0.810 weight 1.000 ! spec=15N_...Y_FI, no=228, id=113, vol=9.124281e+07
assign (segid "   B" and resid    9 and name   HN) (segid "   B" and resid    7 and name  HB1) 4.184 2.188 2.188 weight 1.000 ! spec=15N_...Y_FI, no=231, id=114, vol=1.039030e+07
assign (segid "   B" and resid    9 and name   HN) (segid "   B" and resid    9 and name  HB1) 2.267 0.642 0.642 weight 1.000 ! spec=15N_...Y_FI, no=232, id=115, vol=1.344364e+08
assign (segid "   B" and resid    9 and name   HN) (segid "   B" and resid    8 and name HD22) 3.970 1.970 1.970 weight 1.000 ! spec=15N_...Y_FI, no=239, id=117, vol=2.144496e+07
    or (segid "   B" and resid    9 and name   HN) (segid "   B" and resid    8 and name HD21)
    or (segid "   B" and resid    9 and name   HN) (segid "   B" and resid    8 and name HD23)
assign (segid "   B" and resid    9 and name   HN) (segid "   B" and resid   10 and name   HN) 2.471 0.763 0.763 weight 1.000 ! spec=15N_...Y_FI, no=242, id=118, vol=8.240326e+07
assign (segid "   B" and resid   10 and name   HN) (segid "   B" and resid    9 and name   HA) 2.899 1.051 1.051 weight 1.000 ! spec=15N_...Y_FI, no=245, id=119, vol=4.818823e+07
assign (segid "   B" and resid   10 and name   HN) (segid "   B" and resid   10 and name   HA) 2.764 0.955 0.955 weight 1.000 ! spec=15N_...Y_FI, no=247, id=120, vol=5.500663e+07
assign (segid "   B" and resid   10 and name   HN) (segid "   B" and resid   10 and name  HB1) 2.814 0.990 0.990 weight 1.000 ! spec=15N_...Y_FI, no=253, id=122, vol=5.360034e+07
assign (segid "   B" and resid   10 and name   HN) (segid "   B" and resid   11 and name  HB1) 3.995 1.995 1.995 weight 1.000 ! spec=15N_...Y_FI, no=258, id=124, vol=1.375686e+07
assign (segid "   B" and resid   10 and name   HN) (segid "   B" and resid   11 and name  HB2) 4.577 2.619 2.619 weight 1.000 ! spec=15N_...Y_FI, no=259, id=125, vol=9.555960e+06
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   12 and name   HN) 3.830 1.834 1.834 weight 1.000 ! spec=15N_...Y_FI, no=265, id=126, vol=1.232001e+07
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   11 and name   HA) 2.779 0.965 0.965 weight 1.000 ! spec=15N_...Y_FI, no=269, id=127, vol=5.625516e+07
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   10 and name   HA) 2.530 0.800 0.800 weight 1.000 ! spec=15N_...Y_FI, no=270, id=128, vol=1.090378e+08
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid    8 and name   HA) 3.556 1.581 1.581 weight 1.000 ! spec=15N_...Y_FI, no=271, id=129, vol=1.590978e+07
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   11 and name  HB2) 2.384 0.710 0.710 weight 1.000 ! spec=15N_...Y_FI, no=273, id=130, vol=1.381401e+08
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   11 and name  HB1) 2.387 0.712 0.712 weight 1.000 ! spec=15N_...Y_FI, no=274, id=131, vol=1.116652e+08
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   11 and name   HA) 2.184 0.596 0.596 weight 1.000 ! spec=15N_...Y_FI, no=284, id=136, vol=1.715654e+08
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   11 and name  HB2) 4.163 2.166 2.166 weight 1.000 ! spec=15N_...Y_FI, no=290, id=138, vol=9.794557e+06
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   11 and name  HB1) 4.265 2.273 2.273 weight 1.000 ! spec=15N_...Y_FI, no=291, id=139, vol=1.639430e+07
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   13 and name   HB) 4.636 2.687 2.687 weight 1.000 ! spec=15N_...Y_FI, no=294, id=142, vol=7.330128e+06
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   13 and name HG12) 4.239 2.246 2.246 weight 1.000 ! spec=15N_...Y_FI, no=295, id=143, vol=9.577043e+06
    or (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   13 and name   HN) 2.449 0.750 0.750 weight 1.000 ! spec=15N_...Y_FI, no=296, id=144, vol=8.541977e+07
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   14 and name   HN) 2.345 0.687 0.687 weight 1.000 ! spec=15N_...Y_FI, no=298, id=145, vol=1.091993e+08
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   11 and name   HA) 3.367 1.417 1.417 weight 1.000 ! spec=15N_...Y_FI, no=302, id=146, vol=2.352526e+07
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   12 and name   HA) 3.172 1.258 1.258 weight 1.000 ! spec=15N_...Y_FI, no=305, id=147, vol=2.876722e+07
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   13 and name   HA) 2.686 0.902 0.902 weight 1.000 ! spec=15N_...Y_FI, no=306, id=148, vol=6.184908e+07
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   11 and name  HB2) 3.575 1.598 1.598 weight 1.000 ! spec=15N_...Y_FI, no=308, id=149, vol=1.908854e+07
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   11 and name  HB1) 4.130 2.132 2.132 weight 1.000 ! spec=15N_...Y_FI, no=309, id=150, vol=1.357435e+07
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   12 and name  HB2) 2.723 0.927 0.927 weight 1.000 ! spec=15N_...Y_FI, no=311, id=152, vol=6.262392e+07
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   13 and name   HB) 2.190 0.600 0.600 weight 1.000 ! spec=15N_...Y_FI, no=312, id=153, vol=1.700889e+08
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   13 and name HG12) 2.195 0.602 0.602 weight 1.000 ! spec=15N_...Y_FI, no=313, id=154, vol=1.777748e+08
    or (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   13 and name HG22) 3.399 1.444 1.444 weight 1.000 ! spec=15N_...Y_FI, no=314, id=155, vol=4.191250e+07
    or (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   16 and name   HN) 4.112 2.114 2.114 weight 1.000 ! spec=15N_...Y_FI, no=320, id=157, vol=8.400325e+06
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   18 and name   HN) 3.161 1.249 1.249 weight 1.000 ! spec=15N_...Y_FI, no=322, id=159, vol=3.381417e+07
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   15 and name   HN) 2.524 0.797 0.797 weight 1.000 ! spec=15N_...Y_FI, no=323, id=160, vol=6.907666e+07
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   14 and name   HA) 2.876 1.034 1.034 weight 1.000 ! spec=15N_...Y_FI, no=325, id=161, vol=4.212866e+07
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   12 and name   HA) 3.911 1.912 1.912 weight 1.000 ! spec=15N_...Y_FI, no=326, id=162, vol=8.583742e+06
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   15 and name   HA) 4.616 2.663 2.663 weight 1.000 ! spec=15N_...Y_FI, no=327, id=163, vol=8.390688e+06
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   13 and name   HA) 3.372 1.421 1.421 weight 1.000 ! spec=15N_...Y_FI, no=328, id=164, vol=1.866970e+07
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   14 and name  HB1) 2.183 0.596 0.596 weight 1.000 ! spec=15N_...Y_FI, no=329, id=165, vol=1.077446e+08
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   14 and name  HB2) 3.526 1.554 1.554 weight 1.000 ! spec=15N_...Y_FI, no=330, id=166, vol=5.950369e+07
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   13 and name   HB) 2.507 0.786 3.493 weight 1.000 ! spec=15N_...Y_FI, no=334, id=168, vol=7.911197e+07
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   13 and name HG12) 2.971 1.103 1.103 weight 1.000 ! spec=15N_...Y_FI, no=335, id=169, vol=2.496819e+07
    or (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   13 and name HG22) 3.290 1.353 1.353 weight 1.000 ! spec=15N_...Y_FI, no=336, id=170, vol=2.734984e+07
    or (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   15 and name   HA) 2.581 0.833 0.833 weight 1.000 ! spec=15N_...Y_FI, no=339, id=172, vol=8.632714e+07
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   14 and name   HA) 3.072 1.179 1.179 weight 1.000 ! spec=15N_...Y_FI, no=340, id=173, vol=3.466626e+07
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   13 and name   HA) 3.634 1.651 1.651 weight 1.000 ! spec=15N_...Y_FI, no=341, id=174, vol=1.382815e+07
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   14 and name  HB1) 2.595 0.842 0.842 weight 1.000 ! spec=15N_...Y_FI, no=342, id=175, vol=7.812683e+07
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   14 and name  HB2) 2.907 1.056 1.056 weight 1.000 ! spec=15N_...Y_FI, no=343, id=176, vol=4.918833e+07
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   16 and name  HB2) 4.403 2.423 2.423 weight 1.000 ! spec=15N_...Y_FI, no=344, id=177, vol=1.192154e+07
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   13 and name   HB) 4.014 2.014 2.014 weight 1.000 ! spec=15N_...Y_FI, no=348, id=178, vol=1.542720e+07
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   13 and name HG12) 4.263 2.271 2.271 weight 1.000 ! spec=15N_...Y_FI, no=349, id=179, vol=1.257630e+07
    or (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   13 and name HG22) 4.284 2.295 2.295 weight 1.000 ! spec=15N_...Y_FI, no=351, id=180, vol=7.867965e+06
    or (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   16 and name   HN) 2.495 0.778 0.778 weight 1.000 ! spec=15N_...Y_FI, no=353, id=181, vol=8.192467e+07
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   17 and name   HN) 2.464 0.759 0.759 weight 1.000 ! spec=15N_...Y_FI, no=354, id=182, vol=9.305057e+07
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   16 and name   HA) 2.789 0.972 0.972 weight 1.000 ! spec=15N_...Y_FI, no=358, id=183, vol=5.792242e+07
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   15 and name   HA) 3.170 1.256 1.256 weight 1.000 ! spec=15N_...Y_FI, no=359, id=184, vol=3.223410e+07
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   14 and name   HA) 3.688 1.700 1.700 weight 1.000 ! spec=15N_...Y_FI, no=360, id=185, vol=1.420752e+07
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   13 and name   HA) 3.007 1.130 1.130 weight 1.000 ! spec=15N_...Y_FI, no=362, id=186, vol=3.666270e+07
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   16 and name  HB1) 3.339 1.393 1.393 weight 1.000 ! spec=15N_...Y_FI, no=366, id=187, vol=5.614419e+07
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   16 and name  HB2) 2.217 0.615 0.615 weight 1.000 ! spec=15N_...Y_FI, no=368, id=188, vol=1.396096e+08
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   15 and name  HB2) 2.418 0.731 0.731 weight 1.000 ! spec=15N_...Y_FI, no=373, id=189, vol=1.137207e+08
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   15 and name  HG2) 3.501 1.532 1.532 weight 1.000 ! spec=15N_...Y_FI, no=375, id=190, vol=2.301165e+07
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   13 and name HG22) 4.095 2.096 2.096 weight 1.000 ! spec=15N_...Y_FI, no=378, id=191, vol=1.006138e+07
    or (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   13 and name HG12) 4.328 2.341 2.341 weight 1.000 ! spec=15N_...Y_FI, no=379, id=192, vol=9.128546e+06
    or (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   18 and name   HN) 2.439 0.744 0.744 weight 1.000 ! spec=15N_...Y_FI, no=382, id=194, vol=1.006933e+08
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   34 and name   HN) 2.488 0.774 0.774 weight 1.000 ! spec=15N_...Y_FI, no=385, id=195, vol=8.186798e+07
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   32 and name   HN) 2.889 1.044 1.044 weight 1.000 ! spec=15N_...Y_FI, no=386, id=196, vol=5.109815e+07
assign (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   16 and name   HA) 3.112 1.211 1.211 weight 1.000 ! spec=15N_...Y_FI, no=389, id=198, vol=3.107500e+07
assign (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   17 and name  HA2) 2.908 1.057 1.057 weight 1.000 ! spec=15N_...Y_FI, no=390, id=199, vol=8.034096e+07
assign (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   15 and name   HA) 3.235 1.308 1.308 weight 1.000 ! spec=15N_...Y_FI, no=391, id=200, vol=2.184287e+07
assign (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   17 and name  HA1) 2.305 0.664 0.664 weight 1.000 ! spec=15N_...Y_FI, no=392, id=201, vol=1.312407e+08
assign (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   18 and name  HA1) 4.492 2.522 2.522 weight 1.000 ! spec=15N_...Y_FI, no=394, id=202, vol=1.581241e+07
assign (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   16 and name  HB1) 4.024 2.024 2.024 weight 1.000 ! spec=15N_...Y_FI, no=395, id=203, vol=1.421588e+07
assign (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   16 and name  HB2) 3.616 1.635 1.635 weight 1.000 ! spec=15N_...Y_FI, no=396, id=204, vol=1.588758e+07
assign (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   13 and name HG22) 4.839 2.927 2.927 weight 1.000 ! spec=15N_...Y_FI, no=399, id=206, vol=5.867516e+06
    or (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   14 and name   HA) 2.886 1.041 1.041 weight 1.000 ! spec=15N_...Y_FI, no=407, id=208, vol=4.142420e+07
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   18 and name  HA2) 2.725 0.928 0.928 weight 1.000 ! spec=15N_...Y_FI, no=408, id=209, vol=8.996064e+07
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   17 and name  HA1) 3.247 1.318 1.318 weight 1.000 ! spec=15N_...Y_FI, no=409, id=210, vol=2.235355e+07
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   18 and name  HA1) 2.198 0.604 0.604 weight 1.000 ! spec=15N_...Y_FI, no=410, id=211, vol=1.460386e+08
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   16 and name  HB2) 3.486 1.519 1.519 weight 1.000 ! spec=15N_...Y_FI, no=412, id=212, vol=1.251585e+07
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   13 and name HG22) 3.178 1.262 1.262 weight 1.000 ! spec=15N_...Y_FI, no=413, id=213, vol=4.391630e+07
    or (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   18 and name  HA2) 2.118 0.561 0.561 weight 1.000 ! spec=15N_...Y_FI, no=417, id=215, vol=2.215094e+08
assign (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   18 and name  HA1) 2.598 0.844 0.844 weight 1.000 ! spec=15N_...Y_FI, no=422, id=216, vol=9.690960e+07
assign (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   19 and name  HB1) 2.203 0.607 0.607 weight 1.000 ! spec=15N_...Y_FI, no=425, id=218, vol=1.443846e+08
assign (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   19 and name  HB2) 3.409 1.453 1.453 weight 1.000 ! spec=15N_...Y_FI, no=426, id=219, vol=6.576656e+07
assign (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   13 and name HG22) 3.758 1.765 1.765 weight 1.000 ! spec=15N_...Y_FI, no=429, id=220, vol=1.890010e+07
    or (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   35 and name  HD1) 3.919 1.919 1.919 weight 1.000 ! spec=15N_...Y_FI, no=433, id=221, vol=7.859088e+06
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   20 and name HD22) 4.525 2.559 2.559 weight 1.000 ! spec=15N_...Y_FI, no=434, id=222, vol=1.002253e+07
    or (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   20 and name HD12) 4.063 2.064 2.064 weight 1.000 ! spec=15N_...Y_FI, no=435, id=223, vol=1.762012e+07
    or (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   20 and name HD11)
    or (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   20 and name HD13)
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   20 and name  HB2) 3.343 1.397 1.397 weight 1.000 ! spec=15N_...Y_FI, no=436, id=224, vol=5.261444e+07
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   20 and name  HB1) 2.310 0.667 0.667 weight 1.000 ! spec=15N_...Y_FI, no=437, id=225, vol=1.122054e+08
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   19 and name  HB1) 3.763 1.770 1.770 weight 1.000 ! spec=15N_...Y_FI, no=438, id=226, vol=3.256532e+07
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   19 and name   HA) 2.115 0.559 0.559 weight 1.000 ! spec=15N_...Y_FI, no=440, id=228, vol=2.175125e+08
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   20 and name   HA) 3.004 1.128 1.128 weight 1.000 ! spec=15N_...Y_FI, no=441, id=229, vol=3.068706e+07
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   21 and name   HA) 4.185 2.189 2.189 weight 1.000 ! spec=15N_...Y_FI, no=442, id=230, vol=6.422328e+06
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   22 and name   HN) 3.135 1.229 1.229 weight 1.000 ! spec=15N_...Y_FI, no=448, id=231, vol=2.528731e+07
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   22 and name   HA) 3.149 1.239 1.239 weight 1.000 ! spec=15N_...Y_FI, no=451, id=232, vol=2.460138e+07
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   21 and name   HA) 3.026 1.144 1.144 weight 1.000 ! spec=15N_...Y_FI, no=452, id=233, vol=3.360384e+07
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   20 and name   HA) 4.051 2.051 2.051 weight 1.000 ! spec=15N_...Y_FI, no=453, id=234, vol=1.325678e+07
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   22 and name  HB1) 4.106 2.107 2.107 weight 1.000 ! spec=15N_...Y_FI, no=454, id=235, vol=1.550656e+07
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   22 and name  HB2) 2.719 0.924 0.924 weight 1.000 ! spec=15N_...Y_FI, no=456, id=236, vol=4.392351e+07
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   20 and name  HB1) 4.103 2.104 2.104 weight 1.000 ! spec=15N_...Y_FI, no=457, id=237, vol=1.818462e+07
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   20 and name  HB2) 2.591 0.839 0.839 weight 1.000 ! spec=15N_...Y_FI, no=458, id=238, vol=5.849965e+07
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   20 and name HD12) 4.267 2.276 2.276 weight 1.000 ! spec=15N_...Y_FI, no=461, id=239, vol=1.424450e+07
    or (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   20 and name HD11)
    or (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   20 and name HD13)
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   20 and name HD22) 4.317 2.330 2.330 weight 1.000 ! spec=15N_...Y_FI, no=462, id=240, vol=1.010906e+07
    or (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   23 and name   HN) (segid "   B" and resid   22 and name   HA) 2.736 0.936 0.936 weight 1.000 ! spec=15N_...Y_FI, no=467, id=241, vol=4.644223e+07
assign (segid "   B" and resid   23 and name   HN) (segid "   B" and resid   23 and name   HA) 3.229 1.303 1.303 weight 1.000 ! spec=15N_...Y_FI, no=468, id=242, vol=1.980380e+07
assign (segid "   B" and resid   23 and name   HN) (segid "   B" and resid   48 and name   HA) 4.013 2.013 2.013 weight 1.000 ! spec=15N_...Y_FI, no=469, id=243, vol=1.254376e+07
assign (segid "   B" and resid   23 and name   HN) (segid "   B" and resid   22 and name  HB1) 3.021 1.140 1.140 weight 1.000 ! spec=15N_...Y_FI, no=470, id=244, vol=2.376944e+07
assign (segid "   B" and resid   23 and name   HN) (segid "   B" and resid   23 and name  HB1) 4.006 2.006 2.006 weight 1.000 ! spec=15N_...Y_FI, no=471, id=245, vol=1.576769e+07
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   23 and name  HB1) 2.719 0.924 0.924 weight 1.000 ! spec=15N_...Y_FI, no=482, id=248, vol=4.893381e+07
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   23 and name  HB2) 3.875 1.877 1.877 weight 1.000 ! spec=15N_...Y_FI, no=483, id=249, vol=2.348430e+07
assign (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   26 and name   HN) 2.534 0.803 0.803 weight 1.000 ! spec=15N_...Y_FI, no=485, id=251, vol=7.709949e+07
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   25 and name   HN) 2.788 0.972 0.972 weight 1.000 ! spec=15N_...Y_FI, no=486, id=252, vol=4.945302e+07
assign (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   25 and name   HB) 2.303 0.663 0.663 weight 1.000 ! spec=15N_...Y_FI, no=488, id=253, vol=1.471230e+08
assign (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   25 and name   HA) 2.619 0.857 0.857 weight 1.000 ! spec=15N_...Y_FI, no=490, id=254, vol=7.678130e+07
assign (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   23 and name  HB1) 3.242 1.314 1.314 weight 1.000 ! spec=15N_...Y_FI, no=491, id=255, vol=2.211841e+07
assign (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   24 and name  HB1) 2.643 0.873 0.873 weight 1.000 ! spec=15N_...Y_FI, no=492, id=256, vol=7.756893e+07
assign (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   25 and name HG21) 3.655 1.670 1.670 weight 1.000 ! spec=15N_...Y_FI, no=493, id=257, vol=3.586071e+07
    or (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   25 and name HG22)
    or (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   25 and name HG23)
assign (segid "   B" and resid   26 and name   HN) (segid "   B" and resid   28 and name   HN) 3.877 1.879 1.879 weight 1.000 ! spec=15N_...Y_FI, no=497, id=260, vol=9.509870e+06
assign (segid "   B" and resid   26 and name   HN) (segid "   B" and resid   25 and name   HB) 2.534 0.803 0.803 weight 1.000 ! spec=15N_...Y_FI, no=498, id=261, vol=6.375367e+07
assign (segid "   B" and resid   26 and name   HN) (segid "   B" and resid   26 and name   HA) 2.946 1.085 1.085 weight 1.000 ! spec=15N_...Y_FI, no=500, id=262, vol=3.340679e+07
assign (segid "   B" and resid   26 and name   HN) (segid "   B" and resid   26 and name  HB1) 2.648 0.876 0.876 weight 1.000 ! spec=15N_...Y_FI, no=501, id=263, vol=5.689304e+07
assign (segid "   B" and resid   26 and name   HN) (segid "   B" and resid   25 and name HG21) 3.720 1.730 1.730 weight 1.000 ! spec=15N_...Y_FI, no=502, id=264, vol=1.866058e+07
    or (segid "   B" and resid   26 and name   HN) (segid "   B" and resid   25 and name HG22)
    or (segid "   B" and resid   26 and name   HN) (segid "   B" and resid   25 and name HG23)
assign (segid "   B" and resid   26 and name   HN) (segid "   B" and resid   27 and name   HN) 2.688 0.903 0.903 weight 1.000 ! spec=15N_...Y_FI, no=503, id=265, vol=4.814748e+07
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   27 and name   HA) 2.784 0.969 0.969 weight 1.000 ! spec=15N_...Y_FI, no=507, id=267, vol=5.093609e+07
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   27 and name  HB2) 2.358 0.695 0.695 weight 1.000 ! spec=15N_...Y_FI, no=508, id=268, vol=1.088827e+08
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   26 and name  HB2) 3.465 1.501 1.501 weight 1.000 ! spec=15N_...Y_FI, no=509, id=269, vol=3.847917e+07
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   31 and name  HD2) 3.851 1.854 1.854 weight 1.000 ! spec=15N_...Y_FI, no=593, id=272, vol=1.241055e+07
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   30 and name   HA) 4.055 2.056 2.056 weight 1.000 ! spec=15N_...Y_FI, no=595, id=273, vol=6.346005e+06
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   32 and name   HA) 2.804 0.983 0.983 weight 1.000 ! spec=15N_...Y_FI, no=596, id=274, vol=5.039115e+07
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   31 and name   HA) 3.513 1.542 1.542 weight 1.000 ! spec=15N_...Y_FI, no=598, id=275, vol=1.644001e+07
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   31 and name  HB1) 3.971 1.971 1.971 weight 1.000 ! spec=15N_...Y_FI, no=599, id=276, vol=3.003697e+07
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   31 and name  HB2) 2.414 0.728 0.728 weight 1.000 ! spec=15N_...Y_FI, no=600, id=277, vol=7.922076e+07
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   34 and name  HB2) 3.976 1.976 1.976 weight 1.000 ! spec=15N_...Y_FI, no=601, id=278, vol=8.914544e+06
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   32 and name  HB1) 2.370 0.702 0.702 weight 1.000 ! spec=15N_...Y_FI, no=605, id=280, vol=1.308371e+08
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   33 and name   HN) 2.519 0.793 0.793 weight 1.000 ! spec=15N_...Y_FI, no=612, id=281, vol=8.830758e+07
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   30 and name   HA) 3.948 1.948 1.948 weight 1.000 ! spec=15N_...Y_FI, no=619, id=282, vol=7.866801e+06
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   33 and name   HA) 2.801 0.980 0.980 weight 1.000 ! spec=15N_...Y_FI, no=622, id=283, vol=5.304209e+07
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   32 and name   HA) 3.397 1.442 1.442 weight 1.000 ! spec=15N_...Y_FI, no=625, id=284, vol=2.241687e+07
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   34 and name  HB2) 4.557 2.596 2.596 weight 1.000 ! spec=15N_...Y_FI, no=626, id=285, vol=9.204636e+06
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   33 and name  HB2) 2.312 0.668 0.668 weight 1.000 ! spec=15N_...Y_FI, no=628, id=287, vol=1.026869e+08
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   30 and name  HB2) 3.316 1.374 1.374 weight 1.000 ! spec=15N_...Y_FI, no=629, id=288, vol=2.712075e+07
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   32 and name  HB1) 2.484 0.771 0.771 weight 1.000 ! spec=15N_...Y_FI, no=630, id=289, vol=9.275589e+07
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   50 and name  HE1) 4.389 2.408 2.408 weight 1.000 ! spec=15N_...Y_FI, no=635, id=290, vol=1.071578e+07
    or (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   50 and name  HE2)
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   34 and name   HA) 2.856 1.019 1.019 weight 1.000 ! spec=15N_...Y_FI, no=636, id=291, vol=4.886602e+07
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   33 and name   HA) 3.419 1.461 1.461 weight 1.000 ! spec=15N_...Y_FI, no=637, id=292, vol=1.886150e+07
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   31 and name   HA) 3.432 1.472 1.472 weight 1.000 ! spec=15N_...Y_FI, no=640, id=293, vol=2.494276e+07
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   34 and name  HB2) 2.244 0.630 0.630 weight 1.000 ! spec=15N_...Y_FI, no=641, id=294, vol=1.160782e+08
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   31 and name  HB2) 3.603 1.623 2.397 weight 1.000 ! spec=15N_...Y_FI, no=642, id=295, vol=2.465572e+07
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   33 and name  HB2) 2.727 0.930 0.930 weight 1.000 ! spec=15N_...Y_FI, no=643, id=296, vol=4.580408e+07
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   34 and name  HB1) 3.549 1.575 1.575 weight 1.000 ! spec=15N_...Y_FI, no=644, id=297, vol=5.829427e+07
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   35 and name  HB2) 4.163 2.166 2.166 weight 1.000 ! spec=15N_...Y_FI, no=656, id=299, vol=1.189286e+07
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   35 and name  HB1) 3.490 1.523 1.523 weight 1.000 ! spec=15N_...Y_FI, no=657, id=300, vol=1.902677e+07
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   36 and name   HB) 2.383 0.710 0.710 weight 1.000 ! spec=15N_...Y_FI, no=658, id=301, vol=1.095097e+08
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   36 and name HG11) 2.484 0.771 0.771 weight 1.000 ! spec=15N_...Y_FI, no=660, id=302, vol=6.115870e+07
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   36 and name HG12) 3.510 1.540 1.540 weight 1.000 ! spec=15N_...Y_FI, no=663, id=303, vol=4.048661e+07
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   36 and name HG22) 3.587 1.608 1.608 weight 1.000 ! spec=15N_...Y_FI, no=664, id=304, vol=3.601515e+07
    or (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   36 and name HG21)
    or (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   36 and name HG23)
assign (segid "   B" and resid   39 and name   HN) (segid "   B" and resid   39 and name   HA) 2.685 0.901 0.901 weight 1.000 ! spec=15N_...Y_FI, no=677, id=305, vol=5.590906e+07
assign (segid "   B" and resid   39 and name   HN) (segid "   B" and resid   39 and name   HB) 2.410 0.726 0.726 weight 1.000 ! spec=15N_...Y_FI, no=683, id=306, vol=8.568926e+07
assign (segid "   B" and resid   39 and name   HN) (segid "   B" and resid   39 and name HG12) 2.451 0.751 0.751 weight 1.000 ! spec=15N_...Y_FI, no=685, id=307, vol=1.116206e+08
    or (segid "   B" and resid   39 and name   HN) (segid "   B" and resid   39 and name HG11)
    or (segid "   B" and resid   39 and name   HN) (segid "   B" and resid   39 and name HG13)
assign (segid "   B" and resid   40 and name   HN) (segid "   B" and resid   40 and name   HA) 2.795 0.976 0.976 weight 1.000 ! spec=15N_...Y_FI, no=692, id=308, vol=5.947263e+07
assign (segid "   B" and resid   40 and name   HN) (segid "   B" and resid   39 and name   HA) 2.297 0.659 0.659 weight 1.000 ! spec=15N_...Y_FI, no=693, id=309, vol=1.143725e+08
assign (segid "   B" and resid   40 and name   HN) (segid "   B" and resid   40 and name  HG1) 3.152 1.242 1.242 weight 1.000 ! spec=15N_...Y_FI, no=698, id=310, vol=2.352084e+07
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   40 and name   HA) 2.530 0.800 0.800 weight 1.000 ! spec=15N_...Y_FI, no=707, id=312, vol=7.564997e+07
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   41 and name  HB2) 2.575 0.829 0.829 weight 1.000 ! spec=15N_...Y_FI, no=714, id=314, vol=8.322699e+07
    or (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   41 and name  HB1)
    or (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   41 and name  HB3)
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   39 and name HG22) 3.600 1.620 1.620 weight 1.000 ! spec=15N_...Y_FI, no=716, id=315, vol=1.930827e+07
    or (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   39 and name HG21)
    or (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   39 and name HG23)
assign (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   41 and name  HB2) 2.887 1.042 1.042 weight 1.000 ! spec=15N_...Y_FI, no=732, id=317, vol=3.701756e+07
    or (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   41 and name  HB1)
    or (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   41 and name  HB3)
assign (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   39 and name HG22) 2.669 0.891 0.891 weight 1.000 ! spec=15N_...Y_FI, no=734, id=318, vol=5.592845e+07
    or (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   39 and name HG21)
    or (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   39 and name HG23)
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   47 and name  HB1) 5.188 3.365 3.365 weight 1.000 ! spec=15N_...Y_FI, no=754, id=320, vol=6.315750e+06
assign (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   46 and name   HA) 3.117 1.214 1.214 weight 1.000 ! spec=15N_...Y_FI, no=757, id=321, vol=2.934326e+07
assign (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   45 and name   HA) 3.119 1.216 1.216 weight 1.000 ! spec=15N_...Y_FI, no=758, id=322, vol=3.028948e+07
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   46 and name   HN) 3.258 1.327 1.327 weight 1.000 ! spec=15N_...Y_FI, no=772, id=324, vol=2.357329e+07
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   46 and name   HA) 2.821 0.995 0.995 weight 1.000 ! spec=15N_...Y_FI, no=775, id=325, vol=5.185181e+07
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   47 and name   HA) 2.789 0.973 0.973 weight 1.000 ! spec=15N_...Y_FI, no=776, id=326, vol=4.214327e+07
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   47 and name  HB2) 3.394 1.440 1.440 weight 1.000 ! spec=15N_...Y_FI, no=778, id=328, vol=1.661444e+07
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   47 and name  HB1) 3.273 1.339 1.339 weight 1.000 ! spec=15N_...Y_FI, no=779, id=329, vol=2.337123e+07
assign (segid "   B" and resid   48 and name   HN) (segid "   B" and resid   48 and name   HA) 3.011 1.133 1.133 weight 1.000 ! spec=15N_...Y_FI, no=782, id=330, vol=2.850784e+07
assign (segid "   B" and resid   48 and name   HN) (segid "   B" and resid   47 and name   HA) 2.596 0.843 0.843 weight 1.000 ! spec=15N_...Y_FI, no=783, id=331, vol=5.716227e+07
assign (segid "   B" and resid   48 and name   HN) (segid "   B" and resid   47 and name  HB2) 4.430 2.453 2.453 weight 1.000 ! spec=15N_...Y_FI, no=788, id=332, vol=1.268074e+07
assign (segid "   B" and resid   48 and name   HN) (segid "   B" and resid   47 and name  HB1) 4.373 2.390 2.390 weight 1.000 ! spec=15N_...Y_FI, no=789, id=333, vol=1.387140e+07
assign (segid "   B" and resid   48 and name   HN) (segid "   B" and resid   48 and name  HB1) 2.775 0.963 0.963 weight 1.000 ! spec=15N_...Y_FI, no=791, id=334, vol=3.680877e+07
assign (segid "   B" and resid   48 and name   HN) (segid "   B" and resid   48 and name  HB2) 2.953 1.090 1.090 weight 1.000 ! spec=15N_...Y_FI, no=792, id=335, vol=3.452024e+07
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   48 and name   HA) 2.364 0.698 0.698 weight 1.000 ! spec=15N_...Y_FI, no=801, id=337, vol=7.705373e+07
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   49 and name   HA) 2.931 1.074 1.074 weight 1.000 ! spec=15N_...Y_FI, no=802, id=338, vol=2.799822e+07
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   48 and name  HB2) 4.659 2.713 2.713 weight 1.000 ! spec=15N_...Y_FI, no=803, id=339, vol=7.856155e+06
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   49 and name   HB) 3.567 1.591 1.591 weight 1.000 ! spec=15N_...Y_FI, no=804, id=340, vol=2.262294e+07
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   49 and name HG11) 2.205 0.608 0.608 weight 1.000 ! spec=15N_...Y_FI, no=805, id=341, vol=6.550997e+07
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   49 and name HD12) 4.743 2.812 2.812 weight 1.000 ! spec=15N_...Y_FI, no=806, id=342, vol=1.273391e+07
    or (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   49 and name HD11)
    or (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   49 and name HD13)
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   49 and name HG22) 3.056 1.167 1.167 weight 1.000 ! spec=15N_...Y_FI, no=807, id=343, vol=3.843423e+07
    or (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   49 and name HG21)
    or (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   49 and name HG23)
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   48 and name  HB2) 4.286 2.296 2.296 weight 1.000 ! spec=15N_...Y_FI, no=808, id=344, vol=8.962575e+06
assign (segid "   B" and resid   51 and name   HN) (segid "   B" and resid   52 and name   HN) 2.913 1.061 1.061 weight 1.000 ! spec=15N_...Y_FI, no=812, id=346, vol=3.111923e+07
assign (segid "   B" and resid   51 and name   HN) (segid "   B" and resid   51 and name   HA) 3.306 1.367 1.367 weight 1.000 ! spec=15N_...Y_FI, no=813, id=347, vol=1.911150e+07
assign (segid "   B" and resid   51 and name   HN) (segid "   B" and resid   51 and name  HB2) 2.809 0.986 0.986 weight 1.000 ! spec=15N_...Y_FI, no=815, id=348, vol=4.012003e+07
assign (segid "   B" and resid   51 and name   HN) (segid "   B" and resid   50 and name  HB2) 3.657 1.672 1.672 weight 1.000 ! spec=15N_...Y_FI, no=816, id=349, vol=1.923519e+07
assign (segid "   B" and resid   52 and name   HN) (segid "   B" and resid   51 and name   HA) 3.069 1.177 1.177 weight 1.000 ! spec=15N_...Y_FI, no=828, id=354, vol=3.428184e+07
assign (segid "   B" and resid   52 and name   HN) (segid "   B" and resid   52 and name   HA) 2.720 0.924 0.924 weight 1.000 ! spec=15N_...Y_FI, no=829, id=355, vol=6.186584e+07
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   53 and name   HA) 2.920 1.066 1.066 weight 1.000 ! spec=15N_...Y_FI, no=831, id=356, vol=4.332568e+07
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   52 and name   HA) 2.933 1.075 1.075 weight 1.000 ! spec=15N_...Y_FI, no=832, id=357, vol=4.033005e+07
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   53 and name  HB2) 3.300 1.361 1.361 weight 1.000 ! spec=15N_...Y_FI, no=834, id=358, vol=2.338324e+07
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid   55 and name   HN) 3.293 1.356 1.356 weight 1.000 ! spec=15N_...Y_FI, no=839, id=362, vol=2.263178e+07
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid   53 and name   HN) 2.695 0.908 0.908 weight 1.000 ! spec=15N_...Y_FI, no=840, id=363, vol=5.194246e+07
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid   53 and name   HA) 2.660 0.884 0.884 weight 1.000 ! spec=15N_...Y_FI, no=841, id=364, vol=7.829236e+07
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid   52 and name   HA) 3.820 1.824 1.824 weight 1.000 ! spec=15N_...Y_FI, no=844, id=365, vol=9.428214e+06
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid   53 and name  HG2) 3.733 1.742 1.742 weight 1.000 ! spec=15N_...Y_FI, no=845, id=366, vol=1.837234e+07
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid   54 and name  HB2) 2.658 0.883 0.883 weight 1.000 ! spec=15N_...Y_FI, no=846, id=367, vol=5.317383e+07
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid   54 and name  HG1) 3.354 1.406 1.406 weight 1.000 ! spec=15N_...Y_FI, no=847, id=368, vol=2.438421e+07
assign (segid "   B" and resid   55 and name   HN) (segid "   B" and resid   55 and name  HB1) 3.947 1.948 1.948 weight 1.000 ! spec=15N_...Y_FI, no=854, id=371, vol=1.724011e+07
assign (segid "   B" and resid   55 and name   HN) (segid "   B" and resid   55 and name  HB2) 2.756 0.949 0.949 weight 1.000 ! spec=15N_...Y_FI, no=855, id=372, vol=4.803624e+07
assign (segid "   B" and resid   55 and name   HN) (segid "   B" and resid   54 and name  HB2) 3.316 1.374 1.374 weight 1.000 ! spec=15N_...Y_FI, no=856, id=373, vol=2.311262e+07
assign (segid "   B" and resid   56 and name   HN) (segid "   B" and resid   55 and name   HA) 2.336 0.682 0.682 weight 1.000 ! spec=15N_...Y_FI, no=861, id=374, vol=1.272907e+08
assign (segid "   B" and resid   56 and name   HN) (segid "   B" and resid   56 and name  HB2) 3.135 1.229 1.229 weight 1.000 ! spec=15N_...Y_FI, no=863, id=375, vol=4.184359e+07
assign (segid "   B" and resid   56 and name   HN) (segid "   B" and resid   55 and name  HB1) 3.721 1.730 1.730 weight 1.000 ! spec=15N_...Y_FI, no=866, id=376, vol=2.868491e+07
assign (segid "   B" and resid   56 and name   HN) (segid "   B" and resid   55 and name  HB2) 4.083 2.084 2.084 weight 1.000 ! spec=15N_...Y_FI, no=868, id=377, vol=2.265625e+07
assign (segid "   B" and resid   23 and name   HN) (segid "   B" and resid   22 and name  HB2) 4.200 2.205 2.205 weight 1.000 ! spec=15N_...Y_FI, no=916, id=379, vol=1.688637e+07
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   35 and name  HD2) 4.346 2.361 2.361 weight 1.000 ! spec=15N_...Y_FI, no=936, id=383, vol=6.160798e+06
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   50 and name  HD1) 4.897 2.998 2.998 weight 1.000 ! spec=15N_...Y_FI, no=937, id=384, vol=7.725343e+06
    or (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   50 and name  HD2)
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   35 and name  HD1) 4.797 2.877 2.877 weight 1.000 ! spec=15N_...Y_FI, no=946, id=386, vol=4.810578e+06
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   35 and name  HD1) 4.594 2.638 2.638 weight 1.000 ! spec=15N_...Y_FI, no=948, id=387, vol=3.997443e+06
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   35 and name  HD1) 5.028 3.160 3.160 weight 1.000 ! spec=15N_...Y_FI, no=955, id=388, vol=5.086375e+06
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   13 and name   HA) 4.801 2.881 2.881 weight 1.000 ! spec=15N_...Y_FI, no=999, id=389, vol=6.289218e+06
assign (segid "   B" and resid   26 and name   HN) (segid "   B" and resid   22 and name  HB1) 4.057 2.058 2.058 weight 1.000 ! spec=15N_...Y_FI, no=1011, id=390, vol=1.550878e+07
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   28 and name   HA) 3.812 1.817 1.817 weight 1.000 ! spec=15N_...Y_FI, no=1033, id=391, vol=1.047401e+07
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   33 and name  HB2) 4.448 2.473 2.473 weight 1.000 ! spec=15N_...Y_FI, no=1037, id=392, vol=8.116721e+06
assign (segid "   B" and resid   51 and name   HN) (segid "   B" and resid   50 and name  HB1) 3.697 1.709 1.709 weight 1.000 ! spec=15N_...Y_FI, no=1044, id=393, vol=9.092443e+06
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name HD12) 5.235 3.426 3.426 weight 1.000 ! spec=15N_...Y_FI, no=1050, id=394, vol=5.923992e+06
    or (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name HD11)
    or (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name HD13)
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   22 and name  HB2) 3.758 1.766 1.766 weight 1.000 ! spec=15N_...Y_FI, no=1091, id=395, vol=1.644234e+07
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   43 and name  HG2) 4.770 2.844 2.844 weight 1.000 ! spec=15N_...Y_FI, no=1163, id=398, vol=9.253340e+06
assign (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   44 and name HG21) 4.671 2.727 2.727 weight 1.000 ! spec=15N_...Y_FI, no=1176, id=399, vol=8.775231e+06
    or (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   44 and name HG23)
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   12 and name   HA) 2.722 0.926 0.926 weight 1.000 ! spec=15N_...Y_FI, no=1195, id=400, vol=6.494892e+07
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   34 and name  HB2) 4.949 3.062 3.062 weight 1.000 ! spec=15N_...Y_FI, no=1240, id=402, vol=6.892374e+06
assign (segid "   B" and resid   39 and name   HN) (segid "   B" and resid   38 and name   HA) 2.238 0.626 0.626 weight 1.000 ! spec=15N_...Y_FI, no=1243, id=403, vol=1.529928e+08
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   33 and name   HA) 3.819 1.823 1.823 weight 1.000 ! spec=15N_...Y_FI, no=1250, id=404, vol=9.095856e+06
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   32 and name   HA) 3.493 1.525 1.525 weight 1.000 ! spec=15N_...Y_FI, no=1251, id=405, vol=1.648399e+07
assign (segid "   B" and resid    2 and name   HN) (segid "   B" and resid    1 and name  HA2) 4.869 2.963 2.963 weight 1.000 ! spec=15N_...Y_FI, no=1267, id=406, vol=5.394953e+06
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   45 and name  HD2) 4.957 3.071 3.071 weight 1.000 ! spec=15N_...Y_FI, no=1274, id=407, vol=7.324573e+06
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   47 and name  HB2) 4.803 2.883 2.883 weight 1.000 ! spec=15N_...Y_FI, no=1275, id=408, vol=6.992738e+06
assign (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   44 and name   HB) 2.991 1.118 1.118 weight 1.000 ! spec=15N_...Y_FI, no=1276, id=409, vol=2.989713e+07
assign (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   45 and name  HB2) 3.486 1.519 1.519 weight 1.000 ! spec=15N_...Y_FI, no=1280, id=410, vol=1.339171e+07
assign (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   47 and name   HA) 3.454 1.491 2.546 weight 1.000 ! spec=15N_...Y_FI, no=1286, id=412, vol=2.810204e+07
assign (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   44 and name   HA) 3.562 1.586 1.586 weight 1.000 ! spec=15N_...Y_FI, no=1287, id=413, vol=2.077517e+07
assign (segid "   B" and resid   46 and name  HE1) (segid "   B" and resid   44 and name HG21) 4.047 2.048 2.048 weight 1.000 ! spec=15N_...Y_FI, no=1300, id=414, vol=7.511026e+06
    or (segid "   B" and resid   46 and name  HE1) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   46 and name  HE1) (segid "   B" and resid   44 and name HG23)
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   47 and name HD21) 6.131 4.699 4.699 weight 1.000 ! spec=15N_...Y_FI, no=1305, id=415, vol=4.589692e+06
assign (segid "   B" and resid   48 and name   HN) (segid "   B" and resid   49 and name HG11) 4.923 3.029 3.029 weight 1.000 ! spec=15N_...Y_FI, no=1308, id=416, vol=7.191936e+06
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   42 and name   HA) 4.598 2.643 2.643 weight 1.000 ! spec=15N_...Y_FI, no=1324, id=417, vol=7.027641e+06
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   39 and name   HA) 4.927 3.034 3.034 weight 1.000 ! spec=15N_...Y_FI, no=1328, id=418, vol=9.164220e+06
assign (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   42 and name   HA) 2.809 0.987 0.987 weight 1.000 ! spec=15N_...Y_FI, no=1343, id=420, vol=4.183042e+07
assign (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   41 and name   HA) 2.870 1.030 1.030 weight 1.000 ! spec=15N_...Y_FI, no=1344, id=421, vol=5.449345e+07
assign (segid "   B" and resid   40 and name   HN) (segid "   B" and resid   39 and name   HB) 3.325 1.382 1.382 weight 1.000 ! spec=15N_...Y_FI, no=1354, id=422, vol=4.434649e+07
assign (segid "   B" and resid   40 and name   HN) (segid "   B" and resid   39 and name HG22) 3.026 1.144 1.144 weight 1.000 ! spec=15N_...Y_FI, no=1357, id=423, vol=3.317203e+07
    or (segid "   B" and resid   40 and name   HN) (segid "   B" and resid   39 and name HG21)
    or (segid "   B" and resid   40 and name   HN) (segid "   B" and resid   39 and name HG23)
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   20 and name HD22) 3.794 1.799 1.799 weight 1.000 ! spec=15N_...Y_FI, no=1368, id=424, vol=1.612247e+07
    or (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   48 and name  HB1) 4.351 2.366 2.366 weight 1.000 ! spec=15N_...Y_FI, no=1372, id=425, vol=6.950890e+06
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   35 and name   HN) 3.641 1.657 1.657 weight 1.000 ! spec=15N_...Y_FI, no=1393, id=426, vol=1.830054e+07
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   16 and name  HB1) 4.035 2.035 2.035 weight 1.000 ! spec=15N_...Y_FI, no=1423, id=428, vol=1.353166e+07
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   12 and name   HN) 3.774 1.780 1.780 weight 1.000 ! spec=15N_...Y_FI, no=1435, id=430, vol=1.461734e+07
assign (segid "   B" and resid   23 and name   HN) (segid "   B" and resid   26 and name  HB2) 3.961 1.961 1.961 weight 1.000 ! spec=15N_...Y_FI, no=1459, id=431, vol=3.917471e+07
assign (segid "   B" and resid   23 and name   HN) (segid "   B" and resid   48 and name  HB2) 2.812 0.989 0.989 weight 1.000 ! spec=15N_...Y_FI, no=1460, id=432, vol=3.782395e+07
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   23 and name   HA) 2.699 0.911 0.911 weight 1.000 ! spec=15N_...Y_FI, no=1462, id=433, vol=6.310440e+07
assign (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   42 and name  HG2) 2.767 0.957 0.957 weight 1.000 ! spec=15N_...Y_FI, no=1471, id=434, vol=5.152542e+07
assign (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   43 and name  HG1) 3.768 1.775 1.775 weight 1.000 ! spec=15N_...Y_FI, no=1474, id=435, vol=1.154552e+07
assign (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   43 and name  HB2) 2.666 0.889 0.889 weight 1.000 ! spec=15N_...Y_FI, no=1479, id=437, vol=4.607839e+07
assign (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   43 and name  HG2) 3.518 1.547 1.547 weight 1.000 ! spec=15N_...Y_FI, no=1480, id=438, vol=2.974622e+07
assign (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   41 and name  HB2) 4.097 2.098 2.098 weight 1.000 ! spec=15N_...Y_FI, no=1481, id=439, vol=1.229119e+07
    or (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   41 and name  HB1)
    or (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   41 and name  HB3)
assign (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   44 and name HG21) 3.518 1.547 1.547 weight 1.000 ! spec=15N_...Y_FI, no=1482, id=440, vol=1.307891e+07
    or (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   44 and name HG23)
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   27 and name   HA) 3.671 1.685 1.685 weight 1.000 ! spec=15N_...Y_FI, no=1486, id=443, vol=9.625731e+06
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   34 and name  HB2) 3.975 1.975 1.975 weight 1.000 ! spec=15N_...Y_FI, no=1487, id=444, vol=7.444360e+06
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   29 and name   HA) 3.326 1.383 1.383 weight 1.000 ! spec=15N_...Y_FI, no=1488, id=445, vol=2.568533e+07
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   33 and name   HA) 3.592 1.613 1.613 weight 1.000 ! spec=15N_...Y_FI, no=1499, id=448, vol=1.248789e+07
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   36 and name   HA) 2.827 0.999 0.999 weight 1.000 ! spec=15N_...Y_FI, no=1500, id=449, vol=4.872550e+07
assign (segid "   B" and resid    7 and name HD22) (segid "   B" and resid   10 and name  HB1) 3.952 1.953 1.953 weight 1.000 ! spec=15N_...Y_FI, no=1505, id=450, vol=6.834169e+06
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   43 and name  HB2) 4.311 2.323 2.323 weight 1.000 ! spec=15N_...Y_FI, no=1508, id=451, vol=1.145092e+07
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   43 and name  HG2) 3.801 1.806 1.806 weight 1.000 ! spec=15N_...Y_FI, no=1514, id=452, vol=1.104958e+07
assign (segid "   B" and resid   46 and name  HE1) (segid "   B" and resid   46 and name  HZ2) 2.634 0.867 0.867 weight 1.000 ! spec=NOES..._H2O, no=3, id=1026, vol=1.537400e+06
assign (segid "   B" and resid   46 and name  HE1) (segid "   B" and resid   46 and name  HD1) 2.296 0.659 0.659 weight 1.000 ! spec=NOES..._H2O, no=4, id=1027, vol=3.318360e+06
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   35 and name  HE1) 2.680 0.898 0.898 weight 1.000 ! spec=NOES..._H2O, no=122, id=1028, vol=1.170641e+06
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   20 and name   HA) 3.340 1.394 1.394 weight 1.000 ! spec=NOES..._H2O, no=123, id=1029, vol=3.198402e+05
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   35 and name   HA) 2.789 0.972 0.972 weight 1.000 ! spec=NOES..._H2O, no=124, id=1030, vol=1.009724e+06
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   35 and name  HB2) 3.113 1.211 1.211 weight 1.000 ! spec=NOES..._H2O, no=125, id=1031, vol=3.592242e+05
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   35 and name  HB1) 4.447 2.472 2.472 weight 1.000 ! spec=NOES..._H2O, no=126, id=1032, vol=1.754395e+05
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   20 and name   HG) 3.962 1.963 1.963 weight 1.000 ! spec=NOES..._H2O, no=127, id=1033, vol=1.593278e+05
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   13 and name HG22) 3.029 1.147 1.147 weight 1.000 ! spec=NOES..._H2O, no=128, id=1034, vol=4.275625e+05
    or (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   13 and name HG21)
    or (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   13 and name HG23)
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   20 and name HD22) 3.749 1.757 1.757 weight 1.000 ! spec=NOES..._H2O, no=129, id=1035, vol=1.684845e+05
    or (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   20 and name HD21)
    or (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   20 and name HD23)
assign (segid "   B" and resid   31 and name  HD1) (segid "   B" and resid   27 and name  HB2) 5.109 3.262 3.262 weight 1.000 ! spec=NOES..._H2O, no=136, id=1037, vol=1.031450e+05
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   35 and name   HN) 4.882 2.979 2.979 weight 1.000 ! spec=NOES..._H2O, no=137, id=1038, vol=9.244300e+04
assign (segid "   B" and resid   31 and name  HD1) (segid "   B" and resid   31 and name  HE1) 3.426 1.467 1.467 weight 1.000 ! spec=NOES..._H2O, no=138, id=1039, vol=3.051142e+05
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   20 and name HD12) 4.698 2.759 2.759 weight 1.000 ! spec=NOES..._H2O, no=151, id=1040, vol=1.016875e+05
    or (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   20 and name HD11)
    or (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   20 and name HD13)
assign (segid "   B" and resid   35 and name  HD1) (segid "   B" and resid   35 and name  HD2) 4.602 2.647 2.647 weight 1.000 ! spec=NOES..._H2O, no=157, id=1041, vol=6.190800e+04
assign (segid "   B" and resid   35 and name  HE1) (segid "   B" and resid   35 and name   HA) 4.161 2.165 2.165 weight 1.000 ! spec=NOES..._H2O, no=164, id=1043, vol=2.023035e+05
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   22 and name   HA) 3.487 1.520 1.520 weight 1.000 ! spec=NOES..._H2O, no=181, id=1049, vol=3.037765e+05
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   35 and name   HA) 3.063 1.173 1.173 weight 1.000 ! spec=NOES..._H2O, no=187, id=1052, vol=5.742470e+05
assign (segid "   B" and resid   34 and name  HB2) (segid "   B" and resid   34 and name   HA) 3.501 1.532 1.532 weight 1.000 ! spec=NOES..._H2O, no=215, id=1059, vol=3.341455e+05
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   30 and name  HD1) 3.819 1.823 1.823 weight 1.000 ! spec=NOES..._H2O, no=235, id=1070, vol=2.790682e+05
    or (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   30 and name  HD2)
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   35 and name  HD2) 3.373 1.422 1.422 weight 1.000 ! spec=NOES..._H2O, no=236, id=1071, vol=3.192392e+05
assign (segid "   B" and resid   46 and name  HB2) (segid "   B" and resid   46 and name  HE3) 2.916 1.063 1.063 weight 1.000 ! spec=NOES..._H2O, no=270, id=1077, vol=7.241655e+05
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   10 and name  HG1) 3.646 1.661 1.661 weight 1.000 ! spec=NOES..._H2O, no=276, id=1079, vol=4.457398e+05
assign (segid "   B" and resid   47 and name HD22) (segid "   B" and resid   47 and name  HB1) 3.127 1.222 1.222 weight 1.000 ! spec=NOES..._H2O, no=284, id=1080, vol=4.304642e+05
assign (segid "   B" and resid   47 and name HD22) (segid "   B" and resid   47 and name  HB2) 3.120 1.216 1.216 weight 1.000 ! spec=NOES..._H2O, no=285, id=1081, vol=2.983748e+05
assign (segid "   B" and resid    7 and name HD22) (segid "   B" and resid    7 and name  HB1) 3.503 1.534 1.534 weight 1.000 ! spec=NOES..._H2O, no=287, id=1082, vol=5.024682e+05
assign (segid "   B" and resid    7 and name HD21) (segid "   B" and resid    7 and name  HB2) 4.115 2.117 2.117 weight 1.000 ! spec=NOES..._H2O, no=292, id=1084, vol=2.402155e+05
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   12 and name   HA) 2.888 1.043 1.043 weight 1.000 ! spec=NOES..._H2O, no=302, id=1086, vol=7.055652e+05
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   24 and name   HA) 3.135 1.228 1.228 weight 1.000 ! spec=NOES..._H2O, no=305, id=1088, vol=4.701668e+05
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name   HA) 2.706 0.915 0.915 weight 1.000 ! spec=NOES..._H2O, no=327, id=1092, vol=9.951262e+05
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   20 and name  HB2) 2.495 0.778 0.778 weight 1.000 ! spec=NOES..._H2O, no=341, id=1096, vol=1.561598e+06
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   20 and name  HB2)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   20 and name  HB2)
assign (segid "   B" and resid   36 and name HG22) (segid "   B" and resid   36 and name HG12) 2.622 0.859 0.859 weight 1.000 ! spec=NOES..._H2O, no=344, id=1097, vol=7.605230e+05
    or (segid "   B" and resid   36 and name HG21) (segid "   B" and resid   36 and name HG12)
    or (segid "   B" and resid   36 and name HG23) (segid "   B" and resid   36 and name HG12)
assign (segid "   B" and resid   46 and name  HH2) (segid "   B" and resid   46 and name  HE3) 3.827 1.830 1.830 weight 1.000 ! spec=NOES..._H2O, no=353, id=1102, vol=4.495998e+05
assign (segid "   B" and resid   46 and name  HZ3) (segid "   B" and resid   46 and name  HZ2) 3.873 1.875 1.875 weight 1.000 ! spec=NOES..._H2O, no=355, id=1104, vol=4.388918e+05
assign (segid "   B" and resid   46 and name  HZ2) (segid "   B" and resid   44 and name HG21) 3.619 1.637 1.637 weight 1.000 ! spec=NOES..._H2O, no=363, id=1105, vol=2.043548e+05
    or (segid "   B" and resid   46 and name  HZ2) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   46 and name  HZ2) (segid "   B" and resid   44 and name HG23)
assign (segid "   B" and resid   46 and name  HH2) (segid "   B" and resid   45 and name  HD2) 3.127 1.222 1.222 weight 1.000 ! spec=NOES..._H2O, no=365, id=1106, vol=4.921525e+05
assign (segid "   B" and resid   21 and name  HE1) (segid "   B" and resid   21 and name   HA) 3.925 1.925 1.925 weight 1.000 ! spec=NOES..._H2O, no=371, id=1108, vol=2.635552e+05
    or (segid "   B" and resid   21 and name  HE2) (segid "   B" and resid   21 and name   HA)
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   21 and name  HD1) 3.214 1.292 1.292 weight 1.000 ! spec=NOES..._H2O, no=373, id=1109, vol=8.166635e+05
    or (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   21 and name  HD2)
assign (segid "   B" and resid   46 and name   HA) (segid "   B" and resid   46 and name  HD1) 3.914 1.915 1.915 weight 1.000 ! spec=NOES..._H2O, no=378, id=1111, vol=3.284562e+05
assign (segid "   B" and resid   46 and name  HB1) (segid "   B" and resid   46 and name  HD1) 2.841 1.009 1.009 weight 1.000 ! spec=NOES..._H2O, no=379, id=1112, vol=9.040858e+05
assign (segid "   B" and resid   46 and name  HE3) (segid "   B" and resid   45 and name  HB2) 3.468 1.503 1.503 weight 1.000 ! spec=NOES..._H2O, no=383, id=1113, vol=1.939108e+05
assign (segid "   B" and resid   50 and name  HD1) (segid "   B" and resid   33 and name  HB2) 3.945 1.945 1.945 weight 1.000 ! spec=NOES..._H2O, no=384, id=1114, vol=3.585960e+05
    or (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   33 and name  HB2)
assign (segid "   B" and resid   50 and name  HD1) (segid "   B" and resid   50 and name  HB1) 2.709 0.918 0.918 weight 1.000 ! spec=NOES..._H2O, no=385, id=1115, vol=1.868415e+06
    or (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   50 and name  HB1)
assign (segid "   B" and resid   50 and name   HA) (segid "   B" and resid   50 and name  HD1) 2.994 1.120 1.120 weight 1.000 ! spec=NOES..._H2O, no=387, id=1116, vol=1.136566e+06
    or (segid "   B" and resid   50 and name   HA) (segid "   B" and resid   50 and name  HD2)
assign (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   21 and name  HD1) 3.340 1.395 1.395 weight 1.000 ! spec=NOES..._H2O, no=388, id=1117, vol=5.939042e+05
    or (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   21 and name  HD2)
assign (segid "   B" and resid   49 and name   HB) (segid "   B" and resid   50 and name  HD1) 3.717 1.727 1.727 weight 1.000 ! spec=NOES..._H2O, no=392, id=1118, vol=3.863372e+05
    or (segid "   B" and resid   49 and name   HB) (segid "   B" and resid   50 and name  HD2)
assign (segid "   B" and resid   49 and name HG11) (segid "   B" and resid   50 and name  HD1) 4.051 2.052 2.052 weight 1.000 ! spec=NOES..._H2O, no=393, id=1119, vol=4.639442e+05
    or (segid "   B" and resid   49 and name HG11) (segid "   B" and resid   50 and name  HD2)
assign (segid "   B" and resid   50 and name  HD1) (segid "   B" and resid   49 and name HD12) 3.772 1.778 1.778 weight 1.000 ! spec=NOES..._H2O, no=395, id=1120, vol=3.137062e+05
    or (segid "   B" and resid   50 and name  HD1) (segid "   B" and resid   49 and name HD11)
    or (segid "   B" and resid   50 and name  HD1) (segid "   B" and resid   49 and name HD13)
    or (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   49 and name HD12)
    or (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   49 and name HD11)
    or (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   49 and name HD13)
assign (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   21 and name  HE1) 3.421 1.463 1.463 weight 1.000 ! spec=NOES..._H2O, no=400, id=1121, vol=5.448165e+05
    or (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   21 and name  HE2)
assign (segid "   B" and resid   21 and name  HE1) (segid "   B" and resid   19 and name  HB2) 3.559 1.583 1.583 weight 1.000 ! spec=NOES..._H2O, no=404, id=1123, vol=4.066725e+05
    or (segid "   B" and resid   21 and name  HE2) (segid "   B" and resid   19 and name  HB2)
assign (segid "   B" and resid   38 and name  HG2) (segid "   B" and resid   38 and name   HA) 2.720 0.925 0.925 weight 1.000 ! spec=13C_...woLP, no=74, id=524, vol=6.510616e+08
    or (segid "   B" and resid   38 and name  HG1) (segid "   B" and resid   38 and name   HA)
assign (segid "   B" and resid   38 and name  HG2) (segid "   B" and resid   38 and name  HB1) 1.982 0.491 0.491 weight 1.000 ! spec=13C_...woLP, no=130, id=537, vol=1.795325e+09
    or (segid "   B" and resid   38 and name  HG1) (segid "   B" and resid   38 and name  HB1)
assign (segid "   B" and resid   20 and name HD22) (segid "   B" and resid   20 and name   HG) 2.152 0.579 0.579 weight 1.000 ! spec=13C_...woLP, no=213, id=565, vol=7.593421e+08
    or (segid "   B" and resid   20 and name HD21) (segid "   B" and resid   20 and name   HG)
    or (segid "   B" and resid   20 and name HD23) (segid "   B" and resid   20 and name   HG)
    or (segid "   B" and resid   20 and name HD22) (segid "   B" and resid   20 and name  HB2)
    or (segid "   B" and resid   20 and name HD21) (segid "   B" and resid   20 and name  HB2)
    or (segid "   B" and resid   20 and name HD23) (segid "   B" and resid   20 and name  HB2)
assign (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   20 and name   HG) 2.089 0.545 0.545 weight 1.000 ! spec=13C_...woLP, no=228, id=570, vol=1.071049e+09
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   20 and name   HG)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   20 and name   HG)
    or (segid "   B" and resid   20 and name HD12) (segid "   B" and resid   20 and name  HB2)
    or (segid "   B" and resid   20 and name HD11) (segid "   B" and resid   20 and name  HB2)
    or (segid "   B" and resid   20 and name HD13) (segid "   B" and resid   20 and name  HB2)
assign (segid "   B" and resid   26 and name  HB2) (segid "   B" and resid   22 and name  HB2) 4.147 2.149 2.149 weight 1.000 ! spec=13C_...woLP, no=275, id=590, vol=1.718017e+08
    or (segid "   B" and resid   26 and name  HB1) (segid "   B" and resid   22 and name  HB2)
assign (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   29 and name   HA) 2.580 0.832 0.832 weight 1.000 ! spec=13C_...woLP, no=297, id=600, vol=4.136633e+08
    or (segid "   B" and resid   26 and name   HA) (segid "   B" and resid   29 and name   HB)
assign (segid "   B" and resid    3 and name  HB2) (segid "   B" and resid    2 and name   HA) 3.832 1.836 1.836 weight 1.000 ! spec=13C_...woLP, no=362, id=622, vol=8.717813e+07
    or (segid "   B" and resid    3 and name  HB1) (segid "   B" and resid    2 and name   HA)
assign (segid "   B" and resid    3 and name  HG1) (segid "   B" and resid    3 and name   HA) 3.010 1.132 1.132 weight 1.000 ! spec=13C_...woLP, no=363, id=623, vol=3.529447e+08
    or (segid "   B" and resid    5 and name  HG2) (segid "   B" and resid    5 and name   HA)
assign (segid "   B" and resid    3 and name  HB2) (segid "   B" and resid    3 and name   HA) 2.404 0.722 0.722 weight 1.000 ! spec=13C_...woLP, no=364, id=624, vol=8.056982e+08
    or (segid "   B" and resid    3 and name  HB1) (segid "   B" and resid    3 and name   HA)
    or (segid "   B" and resid    5 and name  HB1) (segid "   B" and resid    5 and name   HA)
assign (segid "   B" and resid    3 and name  HB2) (segid "   B" and resid    3 and name  HG2) 2.591 0.839 0.839 weight 1.000 ! spec=13C_...woLP, no=365, id=625, vol=4.965064e+08
    or (segid "   B" and resid    5 and name  HB2) (segid "   B" and resid    5 and name  HG1)
    or (segid "   B" and resid    5 and name  HB1) (segid "   B" and resid    5 and name  HG1)
assign (segid "   B" and resid    3 and name  HB1) (segid "   B" and resid    3 and name  HG1) 2.553 0.815 0.815 weight 1.000 ! spec=13C_...woLP, no=366, id=626, vol=4.638920e+08
    or (segid "   B" and resid    5 and name  HB1) (segid "   B" and resid    5 and name  HG2)
    or (segid "   B" and resid    5 and name  HB2) (segid "   B" and resid    5 and name  HG2)
assign (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    6 and name  HB1) 2.478 0.768 0.768 weight 1.000 ! spec=13C_...woLP, no=378, id=629, vol=4.943864e+08
    or (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    6 and name  HB2)
assign (segid "   B" and resid    6 and name  HD1) (segid "   B" and resid    6 and name  HB1) 2.582 0.833 0.833 weight 1.000 ! spec=13C_...woLP, no=379, id=630, vol=5.196281e+08
    or (segid "   B" and resid    6 and name  HD1) (segid "   B" and resid    6 and name  HB2)
    or (segid "   B" and resid    6 and name  HD2) (segid "   B" and resid    6 and name  HB1)
assign (segid "   B" and resid    8 and name   HG) (segid "   B" and resid    8 and name HD12) 1.934 0.467 0.467 weight 1.000 ! spec=13C_...woLP, no=411, id=637, vol=1.648923e+09
    or (segid "   B" and resid    8 and name   HG) (segid "   B" and resid    8 and name HD11)
    or (segid "   B" and resid    8 and name   HG) (segid "   B" and resid    8 and name HD13)
    or (segid "   B" and resid    8 and name HD12) (segid "   B" and resid    8 and name  HB2)
    or (segid "   B" and resid    8 and name HD11) (segid "   B" and resid    8 and name  HB2)
    or (segid "   B" and resid    8 and name HD13) (segid "   B" and resid    8 and name  HB2)
assign (segid "   B" and resid    9 and name  HB2) (segid "   B" and resid    9 and name   HA) 2.223 0.618 0.618 weight 1.000 ! spec=13C_...woLP, no=413, id=638, vol=1.190309e+09
    or (segid "   B" and resid    9 and name  HB1) (segid "   B" and resid    9 and name   HA)
assign (segid "   B" and resid   15 and name  HD2) (segid "   B" and resid   12 and name   HA) 3.050 1.163 1.163 weight 1.000 ! spec=13C_...woLP, no=422, id=641, vol=1.635758e+08
    or (segid "   B" and resid   15 and name  HD1) (segid "   B" and resid   12 and name   HA)
assign (segid "   B" and resid   12 and name  HG1) (segid "   B" and resid   12 and name   HA) 2.872 1.031 1.031 weight 1.000 ! spec=13C_...woLP, no=423, id=642, vol=3.258115e+08
    or (segid "   B" and resid   12 and name  HG2) (segid "   B" and resid   12 and name   HA)
assign (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   12 and name   HA) 2.146 0.576 0.576 weight 1.000 ! spec=13C_...woLP, no=424, id=643, vol=1.306838e+09
    or (segid "   B" and resid   12 and name  HB1) (segid "   B" and resid   12 and name   HA)
assign (segid "   B" and resid   15 and name  HD2) (segid "   B" and resid   15 and name   HA) 4.104 2.105 2.105 weight 1.000 ! spec=13C_...woLP, no=430, id=647, vol=1.342195e+08
    or (segid "   B" and resid   15 and name  HD1) (segid "   B" and resid   15 and name   HA)
assign (segid "   B" and resid   15 and name  HD1) (segid "   B" and resid   15 and name  HB1) 2.365 0.699 0.699 weight 1.000 ! spec=13C_...woLP, no=435, id=652, vol=6.832187e+08
    or (segid "   B" and resid   15 and name  HD2) (segid "   B" and resid   15 and name  HB2)
    or (segid "   B" and resid   15 and name  HD1) (segid "   B" and resid   15 and name  HB2)
assign (segid "   B" and resid   15 and name  HB2) (segid "   B" and resid   15 and name   HA) 2.191 0.600 0.600 weight 1.000 ! spec=13C_...woLP, no=436, id=653, vol=1.132656e+09
    or (segid "   B" and resid   15 and name  HB1) (segid "   B" and resid   15 and name   HA)
assign (segid "   B" and resid   15 and name  HD2) (segid "   B" and resid   15 and name  HG1) 2.356 0.694 0.694 weight 1.000 ! spec=13C_...woLP, no=437, id=654, vol=7.443728e+08
    or (segid "   B" and resid   15 and name  HD1) (segid "   B" and resid   15 and name  HG1)
assign (segid "   B" and resid   15 and name  HD2) (segid "   B" and resid   15 and name  HG2) 2.161 0.584 0.584 weight 1.000 ! spec=13C_...woLP, no=440, id=656, vol=9.844200e+08
    or (segid "   B" and resid   15 and name  HD1) (segid "   B" and resid   15 and name  HG2)
assign (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   19 and name  HG1) 3.011 1.133 1.133 weight 1.000 ! spec=13C_...woLP, no=470, id=667, vol=1.979583e+08
    or (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   19 and name  HG2)
assign (segid "   B" and resid   32 and name  HB2) (segid "   B" and resid   32 and name   HA) 2.268 0.643 0.643 weight 1.000 ! spec=13C_...woLP, no=542, id=690, vol=1.004029e+09
    or (segid "   B" and resid   32 and name  HB1) (segid "   B" and resid   32 and name   HA)
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name  HB1) 2.480 0.769 0.769 weight 1.000 ! spec=13C_...woLP, no=546, id=693, vol=5.055668e+08
    or (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   32 and name  HB1)
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name  HB2) 2.598 0.844 0.844 weight 1.000 ! spec=13C_...woLP, no=547, id=694, vol=4.998458e+08
    or (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   32 and name  HB2)
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name  HB1) 2.138 0.571 0.571 weight 1.000 ! spec=13C_...woLP, no=550, id=695, vol=1.579281e+09
    or (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name  HB2)
assign (segid "   B" and resid   39 and name HG12) (segid "   B" and resid   39 and name   HA) 2.257 0.637 0.637 weight 1.000 ! spec=13C_...woLP, no=583, id=701, vol=8.711451e+08
    or (segid "   B" and resid   39 and name HG11) (segid "   B" and resid   39 and name   HA)
    or (segid "   B" and resid   39 and name HG13) (segid "   B" and resid   39 and name   HA)
    or (segid "   B" and resid   39 and name HG22) (segid "   B" and resid   39 and name   HA)
    or (segid "   B" and resid   39 and name HG21) (segid "   B" and resid   39 and name   HA)
    or (segid "   B" and resid   39 and name HG23) (segid "   B" and resid   39 and name   HA)
assign (segid "   B" and resid   28 and name  HD2) (segid "   B" and resid   25 and name   HA) 3.167 1.254 1.254 weight 1.000 ! spec=13C_...woLP, no=585, id=703, vol=1.461415e+08
    or (segid "   B" and resid   28 and name  HD1) (segid "   B" and resid   25 and name   HA)
assign (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid   25 and name   HA) 2.980 1.110 1.110 weight 1.000 ! spec=13C_...woLP, no=586, id=704, vol=1.785652e+08
    or (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid   25 and name   HA)
assign (segid "   B" and resid   27 and name  HB1) (segid "   B" and resid   27 and name   HA) 2.333 0.680 0.680 weight 1.000 ! spec=13C_...woLP, no=617, id=715, vol=7.767341e+08
    or (segid "   B" and resid   27 and name  HB2) (segid "   B" and resid   27 and name   HA)
assign (segid "   B" and resid   27 and name  HB2) (segid "   B" and resid   22 and name  HB2) 3.026 1.145 1.145 weight 1.000 ! spec=13C_...woLP, no=618, id=716, vol=1.689441e+08
    or (segid "   B" and resid   27 and name  HB1) (segid "   B" and resid   22 and name  HB2)
assign (segid "   B" and resid   28 and name  HD2) (segid "   B" and resid   28 and name  HB1) 2.529 0.800 0.800 weight 1.000 ! spec=13C_...woLP, no=629, id=717, vol=4.600467e+08
    or (segid "   B" and resid   28 and name  HD2) (segid "   B" and resid   28 and name  HB2)
    or (segid "   B" and resid   28 and name  HD1) (segid "   B" and resid   28 and name  HB2)
assign (segid "   B" and resid   28 and name   HA) (segid "   B" and resid   28 and name  HB2) 2.469 0.762 0.762 weight 1.000 ! spec=13C_...woLP, no=630, id=718, vol=5.558423e+08
    or (segid "   B" and resid   28 and name   HA) (segid "   B" and resid   28 and name  HB1)
assign (segid "   B" and resid   39 and name HG12) (segid "   B" and resid   39 and name   HB) 2.000 0.500 0.500 weight 1.000 ! spec=13C_...woLP, no=632, id=719, vol=1.064705e+09
    or (segid "   B" and resid   39 and name HG11) (segid "   B" and resid   39 and name   HB)
    or (segid "   B" and resid   39 and name HG13) (segid "   B" and resid   39 and name   HB)
    or (segid "   B" and resid   39 and name HG22) (segid "   B" and resid   39 and name   HB)
    or (segid "   B" and resid   39 and name HG21) (segid "   B" and resid   39 and name   HB)
    or (segid "   B" and resid   39 and name HG23) (segid "   B" and resid   39 and name   HB)
assign (segid "   B" and resid   43 and name  HD1) (segid "   B" and resid   43 and name  HG1) 2.715 0.922 0.922 weight 1.000 ! spec=13C_...woLP, no=666, id=725, vol=2.570057e+08
    or (segid "   B" and resid   43 and name  HD2) (segid "   B" and resid   43 and name  HG1)
assign (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   44 and name   HA) 4.439 2.463 2.463 weight 1.000 ! spec=13C_...woLP, no=670, id=727, vol=9.989508e+07
    or (segid "   B" and resid   45 and name  HG2) (segid "   B" and resid   44 and name   HA)
    or (segid "   B" and resid   45 and name  HG1) (segid "   B" and resid   44 and name   HA)
assign (segid "   B" and resid   51 and name  HB2) (segid "   B" and resid   51 and name   HA) 2.739 0.938 0.938 weight 1.000 ! spec=13C_...woLP, no=799, id=752, vol=3.310652e+08
    or (segid "   B" and resid   51 and name  HB1) (segid "   B" and resid   51 and name   HA)
assign (segid "   B" and resid   51 and name  HB1) (segid "   B" and resid   52 and name   HA) 3.139 1.231 1.231 weight 1.000 ! spec=13C_...woLP, no=810, id=756, vol=1.998562e+08
    or (segid "   B" and resid   51 and name  HB2) (segid "   B" and resid   52 and name   HA)
assign (segid "   B" and resid   52 and name   HA) (segid "   B" and resid   52 and name  HD1) 4.144 2.147 2.147 weight 1.000 ! spec=13C_...woLP, no=814, id=757, vol=1.316660e+08
    or (segid "   B" and resid   52 and name   HA) (segid "   B" and resid   52 and name  HD2)
assign (segid "   B" and resid   52 and name  HB1) (segid "   B" and resid   52 and name  HD2) 2.729 0.931 0.931 weight 1.000 ! spec=13C_...woLP, no=815, id=758, vol=3.263435e+08
    or (segid "   B" and resid   52 and name  HB2) (segid "   B" and resid   52 and name  HD1)
    or (segid "   B" and resid   52 and name  HB2) (segid "   B" and resid   52 and name  HD2)
    or (segid "   B" and resid   52 and name  HB1) (segid "   B" and resid   52 and name  HD1)
assign (segid "   B" and resid   52 and name  HG2) (segid "   B" and resid   52 and name  HD1) 2.362 0.697 0.697 weight 1.000 ! spec=13C_...woLP, no=818, id=759, vol=5.521691e+08
    or (segid "   B" and resid   52 and name  HG2) (segid "   B" and resid   52 and name  HD2)
    or (segid "   B" and resid   52 and name  HG1) (segid "   B" and resid   52 and name  HD1)
assign (segid "   B" and resid   52 and name   HA) (segid "   B" and resid   52 and name  HG1) 3.090 1.193 1.193 weight 1.000 ! spec=13C_...woLP, no=819, id=760, vol=1.757931e+08
    or (segid "   B" and resid   52 and name   HA) (segid "   B" and resid   52 and name  HG2)
assign (segid "   B" and resid   10 and name  HB1) (segid "   B" and resid   11 and name   HA) 3.915 1.916 1.916 weight 1.000 ! spec=13C_...woLP, no=935, id=780, vol=5.494071e+07
    or (segid "   B" and resid   10 and name  HB2) (segid "   B" and resid   11 and name   HA)
assign (segid "   B" and resid   28 and name  HD1) (segid "   B" and resid   28 and name  HG2) 2.323 0.674 0.674 weight 1.000 ! spec=13C_...woLP, no=943, id=781, vol=7.313105e+08
    or (segid "   B" and resid   28 and name  HD1) (segid "   B" and resid   28 and name  HG1)
    or (segid "   B" and resid   28 and name  HD2) (segid "   B" and resid   28 and name  HG2)
assign (segid "   B" and resid   46 and name   HA) (segid "   B" and resid   46 and name  HB1) 3.156 1.245 1.245 weight 1.000 ! spec=13C_...woLP, no=1205, id=823, vol=1.380569e+08
    or (segid "   B" and resid   46 and name   HA) (segid "   B" and resid   46 and name  HB2)
assign (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   45 and name  HD2) 2.742 0.940 0.940 weight 1.000 ! spec=13C_...woLP, no=1222, id=829, vol=5.386415e+08
    or (segid "   B" and resid   34 and name  HB2) (segid "   B" and resid   34 and name   HA)
assign (segid "   B" and resid   27 and name  HB2) (segid "   B" and resid   20 and name HD12) 2.679 0.897 0.897 weight 1.000 ! spec=13C_...woLP, no=1355, id=851, vol=4.075570e+08
    or (segid "   B" and resid   27 and name  HB2) (segid "   B" and resid   20 and name HD11)
    or (segid "   B" and resid   27 and name  HB2) (segid "   B" and resid   20 and name HD13)
    or (segid "   B" and resid   27 and name  HB1) (segid "   B" and resid   20 and name HD12)
    or (segid "   B" and resid   27 and name  HB1) (segid "   B" and resid   20 and name HD11)
    or (segid "   B" and resid   27 and name  HB1) (segid "   B" and resid   20 and name HD13)
assign (segid "   B" and resid   50 and name   HZ) (segid "   B" and resid   30 and name  HB1) 3.654 1.669 1.669 weight 1.000 ! spec=13C_...woLP, no=1552, id=862, vol=1.423852e+08
    or (segid "   B" and resid   50 and name  HE1) (segid "   B" and resid   30 and name  HB1)
    or (segid "   B" and resid   50 and name  HE2) (segid "   B" and resid   30 and name  HB1)
assign (segid "   B" and resid   50 and name  HE1) (segid "   B" and resid   30 and name  HB2) 3.801 1.806 1.806 weight 1.000 ! spec=13C_...woLP, no=1553, id=863, vol=7.368292e+07
    or (segid "   B" and resid   50 and name  HE2) (segid "   B" and resid   30 and name  HB2)
    or (segid "   B" and resid   50 and name   HZ) (segid "   B" and resid   30 and name  HB2)
assign (segid "   B" and resid    4 and name  HA2) (segid "   B" and resid    3 and name  HB2) 3.011 1.133 1.133 weight 1.000 ! spec=13C_...woLP, no=1630, id=868, vol=2.862277e+08
    or (segid "   B" and resid    4 and name  HA2) (segid "   B" and resid    3 and name  HB1)
    or (segid "   B" and resid    4 and name  HA1) (segid "   B" and resid    3 and name  HB2)
    or (segid "   B" and resid    4 and name  HA1) (segid "   B" and resid    3 and name  HB1)
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name   HA) 2.600 0.845 0.845 weight 1.000 ! spec=13C_...woLP, no=1646, id=869, vol=5.180268e+08
    or (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   32 and name   HA)
assign (segid "   B" and resid   21 and name   HZ) (segid "   B" and resid   19 and name  HG2) 4.350 2.365 2.365 weight 1.000 ! spec=13C_...woLP, no=1657, id=870, vol=4.199962e+07
    or (segid "   B" and resid   21 and name   HZ) (segid "   B" and resid   19 and name  HG1)
assign (segid "   B" and resid   24 and name  HB2) (segid "   B" and resid   24 and name   HA) 2.423 0.734 0.734 weight 1.000 ! spec=13C_...woLP, no=1688, id=872, vol=7.425225e+08
    or (segid "   B" and resid   24 and name  HB1) (segid "   B" and resid   24 and name   HA)
assign (segid "   B" and resid   38 and name  HG1) (segid "   B" and resid   38 and name  HD2) 2.419 0.731 0.731 weight 1.000 ! spec=13C_...woLP, no=1793, id=888, vol=4.814303e+08
    or (segid "   B" and resid   38 and name  HG2) (segid "   B" and resid   38 and name  HD2)
assign (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   19 and name  HG1) 2.707 0.916 0.916 weight 1.000 ! spec=13C_...woLP, no=1824, id=892, vol=3.446735e+08
    or (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   19 and name  HG2)
assign (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   42 and name  HG2) 2.484 0.771 0.771 weight 1.000 ! spec=13C_...woLP, no=1895, id=900, vol=5.924155e+08
    or (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   42 and name  HG1)
assign (segid "   B" and resid   43 and name  HD1) (segid "   B" and resid   43 and name   HA) 3.468 1.503 1.503 weight 1.000 ! spec=13C_...woLP, no=1910, id=902, vol=2.215778e+08
    or (segid "   B" and resid   43 and name  HD2) (segid "   B" and resid   43 and name   HA)
assign (segid "   B" and resid   45 and name  HG1) (segid "   B" and resid   45 and name   HA) 3.155 1.244 1.244 weight 1.000 ! spec=13C_...woLP, no=2066, id=923, vol=2.916034e+08
    or (segid "   B" and resid   45 and name  HG2) (segid "   B" and resid   45 and name   HA)
assign (segid "   B" and resid   42 and name  HG1) (segid "   B" and resid   41 and name   HA) 3.563 1.587 1.587 weight 1.000 ! spec=13C_...woLP, no=2106, id=929, vol=8.711987e+07
    or (segid "   B" and resid   42 and name  HG2) (segid "   B" and resid   41 and name   HA)
assign (segid "   B" and resid   40 and name  HB1) (segid "   B" and resid   40 and name   HA) 2.539 0.806 0.806 weight 1.000 ! spec=13C_...woLP, no=2119, id=930, vol=5.000934e+08
    or (segid "   B" and resid   40 and name  HB2) (segid "   B" and resid   40 and name   HA)
assign (segid "   B" and resid   39 and name HG12) (segid "   B" and resid   40 and name   HA) 3.697 1.708 1.708 weight 1.000 ! spec=13C_...woLP, no=2120, id=931, vol=7.578676e+07
    or (segid "   B" and resid   39 and name HG11) (segid "   B" and resid   40 and name   HA)
    or (segid "   B" and resid   39 and name HG13) (segid "   B" and resid   40 and name   HA)
    or (segid "   B" and resid   39 and name HG22) (segid "   B" and resid   40 and name   HA)
    or (segid "   B" and resid   39 and name HG21) (segid "   B" and resid   40 and name   HA)
    or (segid "   B" and resid   39 and name HG23) (segid "   B" and resid   40 and name   HA)
assign (segid "   B" and resid   40 and name   HA) (segid "   B" and resid   40 and name  HG1) 2.804 0.983 0.983 weight 1.000 ! spec=13C_...woLP, no=2124, id=932, vol=3.094393e+08
    or (segid "   B" and resid   40 and name   HA) (segid "   B" and resid   40 and name  HG2)
assign (segid "   B" and resid   12 and name  HG1) (segid "   B" and resid   13 and name HG12) 3.750 1.758 1.758 weight 1.000 ! spec=13C_...woLP, no=2180, id=942, vol=1.454562e+08
    or (segid "   B" and resid   12 and name  HG1) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   12 and name  HG1) (segid "   B" and resid   13 and name HG13)
    or (segid "   B" and resid   12 and name  HG2) (segid "   B" and resid   13 and name HG12)
    or (segid "   B" and resid   12 and name  HG2) (segid "   B" and resid   13 and name HG11)
    or (segid "   B" and resid   12 and name  HG2) (segid "   B" and resid   13 and name HG13)
assign (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   21 and name   HZ) 3.528 1.556 1.556 weight 1.000 ! spec=13C_...woLP, no=2192, id=945, vol=9.784247e+07
    or (segid "   B" and resid   21 and name  HE1) (segid "   B" and resid   19 and name  HB2)
    or (segid "   B" and resid   21 and name  HE2) (segid "   B" and resid   19 and name  HB2)
assign (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   21 and name   HZ) 3.476 1.511 1.511 weight 1.000 ! spec=13C_...woLP, no=2195, id=946, vol=8.436961e+07
    or (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   21 and name  HE1)
    or (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   21 and name  HE2)
assign (segid "   B" and resid    8 and name  HB2) (segid "   B" and resid   14 and name  HB1) 3.975 1.975 1.975 weight 1.000 ! spec=13C_...woLP, no=2227, id=951, vol=4.509889e+07
    or (segid "   B" and resid   15 and name  HG2) (segid "   B" and resid   14 and name  HB1)
assign (segid "   B" and resid    8 and name HD22) (segid "   B" and resid    8 and name   HA) 2.600 0.845 0.845 weight 1.000 ! spec=13C_...woLP, no=2248, id=956, vol=6.560331e+08
    or (segid "   B" and resid    8 and name HD21) (segid "   B" and resid    8 and name   HA)
    or (segid "   B" and resid    8 and name HD23) (segid "   B" and resid    8 and name   HA)
    or (segid "   B" and resid    8 and name HD12) (segid "   B" and resid    8 and name   HA)
    or (segid "   B" and resid    8 and name HD11) (segid "   B" and resid    8 and name   HA)
    or (segid "   B" and resid    8 and name HD13) (segid "   B" and resid    8 and name   HA)
assign (segid "   B" and resid   34 and name  HB2) (segid "   B" and resid   27 and name  HB2) 3.823 1.827 1.827 weight 1.000 ! spec=13C_...woLP, no=2292, id=964, vol=8.261319e+07
    or (segid "   B" and resid   34 and name  HB2) (segid "   B" and resid   27 and name  HB1)
assign (segid "   B" and resid   28 and name   HA) (segid "   B" and resid   28 and name  HG2) 2.642 0.872 0.872 weight 1.000 ! spec=13C_...woLP, no=2298, id=967, vol=3.848977e+08
    or (segid "   B" and resid   28 and name  HG1) (segid "   B" and resid   28 and name   HA)
assign (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   28 and name  HB1) 3.516 1.546 1.546 weight 1.000 ! spec=13C_...woLP, no=2302, id=968, vol=6.667981e+07
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid   29 and name HG12) (segid "   B" and resid   28 and name  HB2)
    or (segid "   B" and resid   29 and name HG11) (segid "   B" and resid   28 and name  HB2)
    or (segid "   B" and resid   29 and name HG13) (segid "   B" and resid   28 and name  HB2)
assign (segid "   B" and resid   27 and name  HB2) (segid "   B" and resid   22 and name  HB1) 3.929 1.930 1.930 weight 1.000 ! spec=13C_...woLP, no=2347, id=973, vol=9.483758e+07
    or (segid "   B" and resid   27 and name  HB1) (segid "   B" and resid   22 and name  HB1)
assign (segid "   B" and resid    8 and name HD22) (segid "   B" and resid    6 and name  HD2) 3.479 1.513 1.513 weight 1.000 ! spec=13C_...woLP, no=2394, id=981, vol=1.468728e+08
    or (segid "   B" and resid    8 and name HD21) (segid "   B" and resid    6 and name  HD2)
    or (segid "   B" and resid    8 and name HD23) (segid "   B" and resid    6 and name  HD2)
    or (segid "   B" and resid    8 and name HD22) (segid "   B" and resid    6 and name  HD1)
    or (segid "   B" and resid    8 and name HD21) (segid "   B" and resid    6 and name  HD1)
    or (segid "   B" and resid    8 and name HD23) (segid "   B" and resid    6 and name  HD1)
assign (segid "   B" and resid    6 and name  HD1) (segid "   B" and resid    6 and name   HA) 2.677 0.895 0.895 weight 1.000 ! spec=13C_...woLP, no=2395, id=982, vol=3.036503e+08
    or (segid "   B" and resid    6 and name  HD2) (segid "   B" and resid    6 and name   HA)
assign (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   44 and name HG21) 3.871 1.873 1.873 weight 1.000 ! spec=13C_...woLP, no=2425, id=994, vol=1.500764e+08
    or (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   44 and name HG23)
    or (segid "   B" and resid   45 and name  HG1) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   45 and name  HG1) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   45 and name  HG1) (segid "   B" and resid   44 and name HG23)
assign (segid "   B" and resid   41 and name  HB2) (segid "   B" and resid   42 and name  HG1) 2.748 0.944 0.944 weight 1.000 ! spec=13C_...woLP, no=2428, id=996, vol=3.236654e+08
    or (segid "   B" and resid   41 and name  HB1) (segid "   B" and resid   42 and name  HG1)
    or (segid "   B" and resid   41 and name  HB3) (segid "   B" and resid   42 and name  HG1)
    or (segid "   B" and resid   41 and name  HB2) (segid "   B" and resid   42 and name  HG2)
    or (segid "   B" and resid   41 and name  HB1) (segid "   B" and resid   42 and name  HG2)
    or (segid "   B" and resid   41 and name  HB3) (segid "   B" and resid   42 and name  HG2)
assign (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    6 and name  HG2) 2.730 0.931 0.931 weight 1.000 ! spec=13C_...woLP, no=2434, id=998, vol=3.232311e+08
    or (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    6 and name  HG1)
assign (segid "   B" and resid    6 and name  HD2) (segid "   B" and resid    6 and name  HG1) 2.236 0.625 0.625 weight 1.000 ! spec=13C_...woLP, no=2436, id=999, vol=8.580210e+08
    or (segid "   B" and resid    6 and name  HD2) (segid "   B" and resid    6 and name  HG2)
    or (segid "   B" and resid    6 and name  HD1) (segid "   B" and resid    6 and name  HG2)
assign (segid "   B" and resid   52 and name  HG2) (segid "   B" and resid   49 and name   HA) 3.330 1.386 1.386 weight 1.000 ! spec=13C_...woLP, no=2448, id=1000, vol=9.983481e+07
    or (segid "   B" and resid   52 and name  HG1) (segid "   B" and resid   49 and name   HA)
assign (segid "   B" and resid   52 and name  HD2) (segid "   B" and resid   49 and name   HA) 3.504 1.535 1.535 weight 1.000 ! spec=13C_...woLP, no=2449, id=1001, vol=8.759709e+07
    or (segid "   B" and resid   52 and name  HD1) (segid "   B" and resid   49 and name   HA)
assign (segid "   B" and resid   39 and name HG22) (segid "   B" and resid   42 and name  HG2) 3.227 1.302 1.302 weight 1.000 ! spec=13C_...woLP, no=2462, id=1008, vol=2.184903e+08
    or (segid "   B" and resid   39 and name HG21) (segid "   B" and resid   42 and name  HG2)
    or (segid "   B" and resid   39 and name HG23) (segid "   B" and resid   42 and name  HG2)
    or (segid "   B" and resid   39 and name HG22) (segid "   B" and resid   42 and name  HG1)
    or (segid "   B" and resid   39 and name HG21) (segid "   B" and resid   42 and name  HG1)
    or (segid "   B" and resid   39 and name HG23) (segid "   B" and resid   42 and name  HG1)
assign (segid "   B" and resid   26 and name   HA) (segid "   B" and resid   26 and name  HB1) 2.537 0.804 0.804 weight 1.000 ! spec=13C_...woLP, no=2492, id=1016, vol=4.846100e+08
    or (segid "   B" and resid   26 and name   HA) (segid "   B" and resid   26 and name  HB2)
assign (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid   29 and name HG22) 3.877 1.878 1.878 weight 1.000 ! spec=13C_...woLP, no=2502, id=1022, vol=8.304459e+07
    or (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid   29 and name HG21)
    or (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid   29 and name HG23)
    or (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid   29 and name HG22)
    or (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid   29 and name HG21)
    or (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid   29 and name HG23)
assign (segid "   B" and resid   28 and name  HG1) (segid "   B" and resid   25 and name   HA) 4.223 2.229 2.229 weight 1.000 ! spec=13C_...woLP, no=2503, id=1023, vol=5.937120e+07
    or (segid "   B" and resid   28 and name  HG2) (segid "   B" and resid   25 and name   HA)
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   32 and name  HG1) 4.321 2.334 2.334 weight 1.000 ! spec=15N_...Y_FI, no=77, id=46, vol=1.310026e+07
    or (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   32 and name  HG2)
assign (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   29 and name   HA) 2.567 0.824 0.824 weight 1.000 ! spec=15N_...Y_FI, no=91, id=51, vol=8.591094e+07
    or (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   26 and name   HA)
assign (segid "   B" and resid   28 and name   HN) (segid "   B" and resid   28 and name  HD2) 4.102 2.104 2.104 weight 1.000 ! spec=15N_...Y_FI, no=92, id=52, vol=2.149275e+07
    or (segid "   B" and resid   28 and name   HN) (segid "   B" and resid   28 and name  HD1)
assign (segid "   B" and resid   28 and name   HN) (segid "   B" and resid   28 and name  HG2) 3.093 1.196 1.196 weight 1.000 ! spec=15N_...Y_FI, no=99, id=54, vol=4.264706e+07
    or (segid "   B" and resid   28 and name   HN) (segid "   B" and resid   28 and name  HG1)
assign (segid "   B" and resid   28 and name   HN) (segid "   B" and resid   28 and name  HB1) 2.165 0.586 0.586 weight 1.000 ! spec=15N_...Y_FI, no=107, id=59, vol=1.876795e+08
    or (segid "   B" and resid   28 and name   HN) (segid "   B" and resid   28 and name  HB2)
assign (segid "   B" and resid    7 and name HD21) (segid "   B" and resid   10 and name  HB1) 4.137 2.139 2.139 weight 1.000 ! spec=15N_...Y_FI, no=130, id=72, vol=8.166356e+06
    or (segid "   B" and resid    7 and name HD21) (segid "   B" and resid   10 and name  HB2)
assign (segid "   B" and resid    7 and name HD22) (segid "   B" and resid   10 and name  HG1) 4.553 2.591 2.591 weight 1.000 ! spec=15N_...Y_FI, no=133, id=73, vol=3.929919e+06
    or (segid "   B" and resid    7 and name HD22) (segid "   B" and resid   10 and name  HG2)
assign (segid "   B" and resid    3 and name   HN) (segid "   B" and resid    3 and name  HB1) 3.388 1.435 1.435 weight 1.000 ! spec=15N_...Y_FI, no=157, id=83, vol=1.743551e+07
    or (segid "   B" and resid    3 and name   HN) (segid "   B" and resid    3 and name  HB2)
assign (segid "   B" and resid    3 and name   HN) (segid "   B" and resid    3 and name  HG1) 4.240 2.247 2.247 weight 1.000 ! spec=15N_...Y_FI, no=162, id=85, vol=7.422756e+06
    or (segid "   B" and resid    3 and name   HN) (segid "   B" and resid    3 and name  HG2)
assign (segid "   B" and resid    4 and name   HN) (segid "   B" and resid    4 and name  HA1) 2.626 0.862 0.862 weight 1.000 ! spec=15N_...Y_FI, no=167, id=87, vol=8.092779e+07
    or (segid "   B" and resid    4 and name   HN) (segid "   B" and resid    4 and name  HA2)
assign (segid "   B" and resid    4 and name   HN) (segid "   B" and resid    3 and name  HB2) 4.036 2.036 2.036 weight 1.000 ! spec=15N_...Y_FI, no=168, id=88, vol=1.248869e+07
    or (segid "   B" and resid    4 and name   HN) (segid "   B" and resid    3 and name  HB1)
assign (segid "   B" and resid    4 and name   HN) (segid "   B" and resid    5 and name  HG2) 4.728 2.795 2.795 weight 1.000 ! spec=15N_...Y_FI, no=169, id=89, vol=5.551969e+06
    or (segid "   B" and resid    4 and name   HN) (segid "   B" and resid    3 and name  HG1)
assign (segid "   B" and resid    4 and name   HN) (segid "   B" and resid    5 and name  HG1) 4.875 2.970 2.970 weight 1.000 ! spec=15N_...Y_FI, no=171, id=90, vol=6.318355e+06
    or (segid "   B" and resid    4 and name   HN) (segid "   B" and resid    3 and name  HG2)
assign (segid "   B" and resid    5 and name   HN) (segid "   B" and resid    4 and name  HA1) 2.467 0.761 0.761 weight 1.000 ! spec=15N_...Y_FI, no=178, id=92, vol=1.178166e+08
    or (segid "   B" and resid    5 and name   HN) (segid "   B" and resid    4 and name  HA2)
assign (segid "   B" and resid    5 and name   HN) (segid "   B" and resid    5 and name  HG2) 3.282 1.346 1.346 weight 1.000 ! spec=15N_...Y_FI, no=179, id=93, vol=3.111098e+07
    or (segid "   B" and resid    5 and name   HN) (segid "   B" and resid    5 and name  HG1)
assign (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    5 and name  HG2) 4.481 2.509 2.509 weight 1.000 ! spec=15N_...Y_FI, no=193, id=96, vol=1.200289e+07
    or (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    5 and name  HG1)
assign (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    5 and name  HB1) 3.592 1.613 1.613 weight 1.000 ! spec=15N_...Y_FI, no=194, id=97, vol=3.187837e+07
    or (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    5 and name  HB2)
assign (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    6 and name  HB1) 2.556 0.817 0.817 weight 1.000 ! spec=15N_...Y_FI, no=195, id=98, vol=8.846882e+07
    or (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    6 and name  HB2)
assign (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    6 and name  HG2) 2.706 0.915 0.915 weight 1.000 ! spec=15N_...Y_FI, no=196, id=99, vol=7.238536e+07
    or (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    6 and name  HG1)
assign (segid "   B" and resid    7 and name   HN) (segid "   B" and resid    6 and name  HG2) 4.564 2.603 2.603 weight 1.000 ! spec=15N_...Y_FI, no=204, id=105, vol=1.149747e+07
    or (segid "   B" and resid    7 and name   HN) (segid "   B" and resid    6 and name  HG1)
assign (segid "   B" and resid    9 and name   HN) (segid "   B" and resid    8 and name  HB2) 2.770 0.959 0.959 weight 1.000 ! spec=15N_...Y_FI, no=236, id=116, vol=5.076906e+07
    or (segid "   B" and resid    9 and name   HN) (segid "   B" and resid    8 and name  HB1)
    or (segid "   B" and resid    9 and name   HN) (segid "   B" and resid    8 and name   HG)
assign (segid "   B" and resid   10 and name   HN) (segid "   B" and resid    9 and name  HB2) 3.109 1.208 1.208 weight 1.000 ! spec=15N_...Y_FI, no=251, id=121, vol=4.215092e+07
    or (segid "   B" and resid   10 and name   HN) (segid "   B" and resid    9 and name  HB1)
assign (segid "   B" and resid   10 and name   HN) (segid "   B" and resid   10 and name  HG1) 2.600 0.845 0.845 weight 1.000 ! spec=15N_...Y_FI, no=254, id=123, vol=8.329360e+07
    or (segid "   B" and resid   10 and name   HN) (segid "   B" and resid   10 and name  HG2)
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   10 and name  HB2) 3.215 1.292 1.292 weight 1.000 ! spec=15N_...Y_FI, no=276, id=132, vol=2.800122e+07
    or (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   10 and name  HB1)
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   10 and name  HG1) 3.790 1.795 1.795 weight 1.000 ! spec=15N_...Y_FI, no=277, id=133, vol=2.425110e+07
    or (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   10 and name  HG2)
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   12 and name  HG2) 3.014 1.136 1.136 weight 1.000 ! spec=15N_...Y_FI, no=292, id=140, vol=2.779138e+07
    or (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   12 and name  HG1)
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   12 and name  HB2) 2.546 0.810 0.810 weight 1.000 ! spec=15N_...Y_FI, no=293, id=141, vol=9.123203e+07
    or (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   12 and name  HB1)
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   12 and name  HG1) 4.450 2.475 2.475 weight 1.000 ! spec=15N_...Y_FI, no=310, id=151, vol=1.139659e+07
    or (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   12 and name  HG2)
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   14 and name   HN) 2.220 0.616 0.616 weight 1.000 ! spec=15N_...Y_FI, no=318, id=156, vol=1.504649e+08
    or (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   15 and name   HN)
assign (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   15 and name  HB2) 4.440 2.464 2.464 weight 1.000 ! spec=15N_...Y_FI, no=333, id=167, vol=1.044364e+07
    or (segid "   B" and resid   14 and name   HN) (segid "   B" and resid   15 and name  HB1)
assign (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   15 and name  HD2) 3.684 1.696 1.696 weight 1.000 ! spec=15N_...Y_FI, no=381, id=193, vol=3.274930e+07
    or (segid "   B" and resid   16 and name   HN) (segid "   B" and resid   15 and name  HD1)
assign (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   15 and name  HB2) 4.190 2.194 2.194 weight 1.000 ! spec=15N_...Y_FI, no=398, id=205, vol=1.035319e+07
    or (segid "   B" and resid   17 and name   HN) (segid "   B" and resid   15 and name  HB1)
assign (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   18 and name   HN) 3.376 1.424 1.424 weight 1.000 ! spec=15N_...Y_FI, no=415, id=214, vol=6.516706e+07
    or (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   20 and name   HN)
assign (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   19 and name  HG1) 3.246 1.317 1.317 weight 1.000 ! spec=15N_...Y_FI, no=424, id=217, vol=3.238184e+07
    or (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   19 and name  HG2)
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   19 and name  HG1) 4.149 2.151 2.151 weight 1.000 ! spec=15N_...Y_FI, no=439, id=227, vol=2.134525e+07
    or (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   19 and name  HG2)
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   24 and name  HB1) 2.781 0.967 0.967 weight 1.000 ! spec=15N_...Y_FI, no=484, id=250, vol=6.112029e+07
    or (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   24 and name  HB2)
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   32 and name  HG2) 2.785 0.970 0.970 weight 1.000 ! spec=15N_...Y_FI, no=603, id=279, vol=5.374934e+07
    or (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   32 and name  HG1)
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   31 and name  HB2) 4.189 2.193 2.193 weight 1.000 ! spec=15N_...Y_FI, no=627, id=286, vol=1.756831e+07
    or (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   30 and name  HB1)
assign (segid "   B" and resid   40 and name   HN) (segid "   B" and resid   40 and name  HB2) 2.629 0.864 0.864 weight 1.000 ! spec=15N_...Y_FI, no=700, id=311, vol=7.241859e+07
    or (segid "   B" and resid   40 and name   HN) (segid "   B" and resid   40 and name  HB1)
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   40 and name  HB1) 3.450 1.487 1.487 weight 1.000 ! spec=15N_...Y_FI, no=711, id=313, vol=2.728598e+07
    or (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   40 and name  HB2)
assign (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   42 and name  HB1) 2.815 0.991 0.991 weight 1.000 ! spec=15N_...Y_FI, no=729, id=316, vol=5.955705e+07
    or (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   42 and name  HB2)
assign (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   43 and name   HA) 2.484 0.771 0.771 weight 1.000 ! spec=15N_...Y_FI, no=739, id=319, vol=8.102754e+07
    or (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   42 and name   HA)
assign (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   46 and name  HB2) 3.124 1.220 1.220 weight 1.000 ! spec=15N_...Y_FI, no=761, id=323, vol=3.493336e+07
    or (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   46 and name  HB1)
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   46 and name  HB1) 3.576 1.598 1.598 weight 1.000 ! spec=15N_...Y_FI, no=777, id=327, vol=1.547302e+07
    or (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   46 and name  HB2)
assign (segid "   B" and resid   52 and name   HN) (segid "   B" and resid   52 and name  HG2) 2.711 0.919 0.919 weight 1.000 ! spec=15N_...Y_FI, no=817, id=350, vol=3.935001e+07
    or (segid "   B" and resid   52 and name   HN) (segid "   B" and resid   52 and name  HG1)
assign (segid "   B" and resid   52 and name   HN) (segid "   B" and resid   52 and name  HB1) 2.782 0.968 0.968 weight 1.000 ! spec=15N_...Y_FI, no=818, id=351, vol=5.453062e+07
    or (segid "   B" and resid   52 and name   HN) (segid "   B" and resid   52 and name  HB2)
assign (segid "   B" and resid   52 and name   HN) (segid "   B" and resid   51 and name  HB1) 2.822 0.996 0.996 weight 1.000 ! spec=15N_...Y_FI, no=819, id=352, vol=4.040052e+07
    or (segid "   B" and resid   52 and name   HN) (segid "   B" and resid   51 and name  HB2)
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   53 and name  HG2) 2.991 1.118 1.118 weight 1.000 ! spec=15N_...Y_FI, no=836, id=359, vol=5.382259e+07
    or (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   53 and name  HG1)
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   52 and name  HB1) 3.309 1.369 1.369 weight 1.000 ! spec=15N_...Y_FI, no=837, id=360, vol=2.534432e+07
    or (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   52 and name  HB2)
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   52 and name  HG2) 4.043 2.044 2.044 weight 1.000 ! spec=15N_...Y_FI, no=838, id=361, vol=1.244022e+07
    or (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   52 and name  HG1)
assign (segid "   B" and resid   55 and name   HN) (segid "   B" and resid   54 and name   HA) 2.516 0.791 0.791 weight 1.000 ! spec=15N_...Y_FI, no=851, id=369, vol=8.884307e+07
    or (segid "   B" and resid   55 and name   HN) (segid "   B" and resid   55 and name   HA)
assign (segid "   B" and resid   55 and name   HN) (segid "   B" and resid   55 and name  HG2) 3.633 1.650 1.650 weight 1.000 ! spec=15N_...Y_FI, no=853, id=370, vol=1.148434e+07
    or (segid "   B" and resid   55 and name   HN) (segid "   B" and resid   55 and name  HG1)
assign (segid "   B" and resid   46 and name  HE1) (segid "   B" and resid   46 and name  HB2) 4.824 2.908 2.908 weight 1.000 ! spec=15N_...Y_FI, no=918, id=381, vol=5.174462e+06
    or (segid "   B" and resid   46 and name  HE1) (segid "   B" and resid   46 and name  HB1)
assign (segid "   B" and resid   56 and name   HN) (segid "   B" and resid   54 and name  HG1) 4.087 2.088 2.088 weight 1.000 ! spec=15N_...Y_FI, no=933, id=382, vol=8.394088e+06
    or (segid "   B" and resid   56 and name   HN) (segid "   B" and resid   54 and name  HG2)
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   50 and name   HZ) 4.974 3.093 3.093 weight 1.000 ! spec=15N_...Y_FI, no=938, id=385, vol=1.175348e+07
    or (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   50 and name  HE1)
    or (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   50 and name  HE2)
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   28 and name  HB1) 4.617 2.665 2.665 weight 1.000 ! spec=15N_...Y_FI, no=1094, id=396, vol=8.666313e+06
    or (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   28 and name  HB2)
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   32 and name  HB1) 4.176 2.180 2.180 weight 1.000 ! spec=15N_...Y_FI, no=1239, id=401, vol=1.361621e+07
    or (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   32 and name  HB2)
assign (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   45 and name  HG2) 3.886 1.887 1.887 weight 1.000 ! spec=15N_...Y_FI, no=1281, id=411, vol=2.161779e+07
    or (segid "   B" and resid   46 and name   HN) (segid "   B" and resid   45 and name  HG1)
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   42 and name  HG2) 4.449 2.474 2.474 weight 1.000 ! spec=15N_...Y_FI, no=1334, id=419, vol=1.054954e+07
    or (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   42 and name  HG1)
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid    9 and name  HB2) 4.391 2.410 2.410 weight 1.000 ! spec=15N_...Y_FI, no=1434, id=429, vol=9.628728e+06
    or (segid "   B" and resid   11 and name   HN) (segid "   B" and resid    9 and name  HB1)
assign (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   42 and name  HB1) 3.253 1.322 1.322 weight 1.000 ! spec=15N_...Y_FI, no=1478, id=436, vol=4.259313e+07
    or (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   42 and name  HB2)
assign (segid "   B" and resid   48 and name   HN) (segid "   B" and resid   46 and name  HB1) 4.289 2.299 2.299 weight 1.000 ! spec=15N_...Y_FI, no=1483, id=441, vol=1.082273e+07
    or (segid "   B" and resid   48 and name   HN) (segid "   B" and resid   46 and name  HB2)
assign (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    6 and name  HD1) 4.413 2.435 2.435 weight 1.000 ! spec=15N_...Y_FI, no=1489, id=446, vol=1.169711e+07
    or (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    6 and name  HD2)
assign (segid "   B" and resid   10 and name   HN) (segid "   B" and resid    8 and name   HG) 4.266 2.275 2.275 weight 1.000 ! spec=15N_...Y_FI, no=1493, id=447, vol=1.668503e+07
    or (segid "   B" and resid   10 and name   HN) (segid "   B" and resid    8 and name  HB1)
assign (segid "   B" and resid    7 and name HD21) (segid "   B" and resid   10 and name  HG2) 3.699 1.711 1.711 weight 1.000 ! spec=NOES..._H2O, no=295, id=1085, vol=2.015180e+05
    or (segid "   B" and resid    7 and name HD21) (segid "   B" and resid   10 and name  HG1)
assign (segid "   B" and resid   21 and name  HE1) (segid "   B" and resid   43 and name  HD1) 3.672 1.686 1.686 weight 1.000 ! spec=NOES..._H2O, no=375, id=1110, vol=4.740380e+05
    or (segid "   B" and resid   21 and name  HE2) (segid "   B" and resid   43 and name  HD1)
    or (segid "   B" and resid   21 and name  HE1) (segid "   B" and resid   43 and name  HD2)
    or (segid "   B" and resid   21 and name  HE2) (segid "   B" and resid   43 and name  HD2)
assign (segid "   B" and resid   21 and name  HE1) (segid "   B" and resid   19 and name  HG1) 4.609 2.656 2.656 weight 1.000 ! spec=NOES..._H2O, no=403, id=1122, vol=1.802432e+05
    or (segid "   B" and resid   21 and name  HE2) (segid "   B" and resid   19 and name  HG1)
    or (segid "   B" and resid   21 and name  HE1) (segid "   B" and resid   19 and name  HG2)
    or (segid "   B" and resid   21 and name  HE2) (segid "   B" and resid   19 and name  HG2)

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1  10.307  -8.680   6.192
    2    H2   GLY   1           HT2      GLY   1   9.548  -9.888   5.285
    3    H3   GLY   1           HT3      GLY   1  11.185 -10.032   5.681
    4    HA2  GLY   1           HA1      GLY   1  10.623 -10.185   8.034
    5    HA3  GLY   1           HA2      GLY   1   8.924 -10.065   7.601
    6    H    ALA   2           HN       ALA   2   9.644 -12.211   9.045
    7    HA   ALA   2           HA       ALA   2  10.508 -14.462   7.579
    8    HB1  ALA   2           HB1      ALA   2   8.768 -14.386  10.045
    9    HB2  ALA   2           HB2      ALA   2  10.530 -14.375  10.033
   10    HB3  ALA   2           HB3      ALA   2   9.653 -15.787   9.440
   11    H    MET   3           HN       MET   3   7.276 -13.268   8.373
   12    HA   MET   3           HA       MET   3   6.214 -14.936   6.192
   13    HB2  MET   3           HB2      MET   3   5.602 -15.772   8.487
   14    HB3  MET   3           HB1      MET   3   4.755 -14.257   8.754
   15    HG2  MET   3           HG2      MET   3   3.283 -14.771   6.846
   16    HG3  MET   3           HG1      MET   3   4.108 -16.316   6.653
   17    HE1  MET   3           HE1      MET   3   1.669 -17.437   6.747
   18    HE2  MET   3           HE2      MET   3   0.920 -15.867   7.047
   19    HE3  MET   3           HE3      MET   3   0.558 -17.232   8.101
   20    H    GLY   4           HN       GLY   4   7.184 -12.170   6.303
   21    HA2  GLY   4           HA2      GLY   4   4.761 -10.872   5.275
   22    HA3  GLY   4           HA1      GLY   4   5.721 -10.033   6.487
   23    H    MET   5           HN       MET   5   5.101  -9.512   3.564
   24    HA   MET   5           HA       MET   5   7.884  -9.285   2.636
   25    HB2  MET   5           HB2      MET   5   5.362  -9.716   1.034
   26    HB3  MET   5           HB1      MET   5   6.887  -9.225   0.312
   27    HG2  MET   5           HG2      MET   5   6.414 -11.764   1.857
   28    HG3  MET   5           HG1      MET   5   6.509 -11.625   0.103
   29    HE1  MET   5           HE1      MET   5   8.703 -10.932  -1.205
   30    HE2  MET   5           HE2      MET   5  10.248 -10.586  -0.430
   31    HE3  MET   5           HE3      MET   5   8.891  -9.480  -0.222
   32    H    ARG   6           HN       ARG   6   8.263  -7.257   3.451
   33    HA   ARG   6           HA       ARG   6   6.588  -5.087   2.396
   34    HB2  ARG   6           HB2      ARG   6   8.664  -5.060   4.595
   35    HB3  ARG   6           HB1      ARG   6   7.817  -3.637   4.009
   36    HG2  ARG   6           HG2      ARG   6   5.688  -4.620   4.728
   37    HG3  ARG   6           HG1      ARG   6   6.560  -6.026   5.346
   38    HD2  ARG   6           HD2      ARG   6   7.816  -4.546   6.863
   39    HD3  ARG   6           HD1      ARG   6   6.891  -3.172   6.265
   40    HE   ARG   6           HE       ARG   6   5.172  -5.207   7.242
   41   HH11  ARG   6          HH11      ARG   6   7.326  -2.659   8.279
   42   HH12  ARG   6          HH12      ARG   6   6.505  -2.399   9.783
   43   HH21  ARG   6          HH21      ARG   6   4.078  -4.865   9.225
   44   HH22  ARG   6          HH22      ARG   6   4.662  -3.659  10.325
   45    H    ASN   7           HN       ASN   7   7.460  -5.348   0.287
   46    HA   ASN   7           HA       ASN   7  10.268  -4.938  -0.183
   47    HB2  ASN   7           HB2      ASN   7   9.553  -4.857  -2.604
   48    HB3  ASN   7           HB1      ASN   7   9.167  -6.347  -1.756
   49   HD21  ASN   7          HD21      ASN   7   7.985  -4.983  -4.158
   50   HD22  ASN   7          HD22      ASN   7   6.296  -4.892  -3.820
   51    H    LEU   8           HN       LEU   8   9.970  -2.932   1.214
   52    HA   LEU   8           HA       LEU   8   8.912  -0.648  -0.233
   53    HB2  LEU   8           HB2      LEU   8   9.482   0.545   1.967
   54    HB3  LEU   8           HB1      LEU   8   8.142  -0.579   1.940
   55    HG   LEU   8           HG       LEU   8   9.663  -2.309   2.934
   56   HD11  LEU   8          HD11      LEU   8  11.510   0.031   3.372
   57   HD12  LEU   8          HD12      LEU   8  11.800  -1.308   2.262
   58   HD13  LEU   8          HD13      LEU   8  11.715  -1.604   3.999
   59   HD21  LEU   8          HD21      LEU   8   9.231   0.229   4.495
   60   HD22  LEU   8          HD22      LEU   8   9.551  -1.361   5.186
   61   HD23  LEU   8          HD23      LEU   8   8.068  -1.078   4.277
   62    H    ASP   9           HN       ASP   9  11.788  -2.185  -0.180
   63    HA   ASP   9           HA       ASP   9  13.512   0.113  -0.017
   64    HB2  ASP   9           HB2      ASP   9  14.372  -2.105   0.583
   65    HB3  ASP   9           HB1      ASP   9  14.083  -2.671  -1.056
   66    H    GLU  10           HN       GLU  10  11.903  -1.731  -2.494
   67    HA   GLU  10           HA       GLU  10  12.968  -0.049  -4.621
   68    HB2  GLU  10           HB2      GLU  10  11.040  -2.371  -4.609
   69    HB3  GLU  10           HB1      GLU  10  11.422  -1.450  -6.053
   70    HG2  GLU  10           HG2      GLU  10  13.445  -2.910  -4.386
   71    HG3  GLU  10           HG1      GLU  10  12.694  -3.554  -5.847
   72    H    CYS  11           HN       CYS  11  10.925   0.566  -2.329
   73    HA   CYS  11           HA       CYS  11   8.777   1.685  -3.979
   74    HB2  CYS  11           HB2      CYS  11   8.230   0.145  -2.087
   75    HB3  CYS  11           HB1      CYS  11   8.898   1.336  -0.986
   76    H    GLU  12           HN       GLU  12   9.706   3.546  -4.700
   77    HA   GLU  12           HA       GLU  12  11.356   5.309  -3.369
   78    HB2  GLU  12           HB2      GLU  12   9.239   6.231  -5.296
   79    HB3  GLU  12           HB1      GLU  12  10.850   6.884  -5.060
   80    HG2  GLU  12           HG2      GLU  12  10.182   4.230  -6.314
   81    HG3  GLU  12           HG1      GLU  12  10.672   5.691  -7.166
   82    H    VAL  13           HN       VAL  13   7.860   5.093  -3.396
   83    HA   VAL  13           HA       VAL  13   7.421   7.615  -2.168
   84    HB   VAL  13           HB       VAL  13   5.750   6.683  -3.637
   85   HG11  VAL  13          HG11      VAL  13   6.083   4.327  -3.209
   86   HG12  VAL  13          HG12      VAL  13   4.390   4.764  -3.001
   87   HG13  VAL  13          HG13      VAL  13   5.412   4.510  -1.588
   88   HG21  VAL  13          HG21      VAL  13   4.718   6.845  -0.815
   89   HG22  VAL  13          HG22      VAL  13   3.753   7.016  -2.281
   90   HG23  VAL  13          HG23      VAL  13   4.992   8.212  -1.893
   91    H    CYS  14           HN       CYS  14   7.995   4.416  -0.891
   92    HA   CYS  14           HA       CYS  14   6.860   4.908   1.682
   93    HB2  CYS  14           HB2      CYS  14   8.452   2.788   0.455
   94    HB3  CYS  14           HB1      CYS  14   8.854   3.067   2.145
   95    H    ARG  15           HN       ARG  15   9.951   5.508   0.196
   96    HA   ARG  15           HA       ARG  15  11.327   6.236   2.584
   97    HB2  ARG  15           HB2      ARG  15  11.942   7.189  -0.207
   98    HB3  ARG  15           HB1      ARG  15  13.050   7.094   1.154
   99    HG2  ARG  15           HG2      ARG  15  12.905   4.658   1.108
  100    HG3  ARG  15           HG1      ARG  15  11.791   4.756  -0.258
  101    HD2  ARG  15           HD2      ARG  15  13.686   6.171  -1.338
  102    HD3  ARG  15           HD1      ARG  15  14.707   5.383  -0.138
  103    HE   ARG  15           HE       ARG  15  13.973   3.242  -1.119
  104   HH11  ARG  15          HH11      ARG  15  13.750   6.191  -2.987
  105   HH12  ARG  15          HH12      ARG  15  13.694   5.377  -4.522
  106   HH21  ARG  15          HH21      ARG  15  13.922   2.154  -3.150
  107   HH22  ARG  15          HH22      ARG  15  13.765   3.092  -4.609
  108    H    ASP  16           HN       ASP  16   9.323   7.869   0.284
  109    HA   ASP  16           HA       ASP  16   9.796  10.527   1.166
  110    HB2  ASP  16           HB2      ASP  16   8.836   9.977  -1.043
  111    HB3  ASP  16           HB1      ASP  16   7.392   9.354  -0.258
  112    H    GLY  17           HN       GLY  17   8.265   7.933   2.612
  113    HA2  GLY  17           HA2      GLY  17   7.282   7.923   4.738
  114    HA3  GLY  17           HA1      GLY  17   7.039   9.661   4.610
  115    H    GLY  18           HN       GLY  18   6.082   7.613   1.971
  116    HA2  GLY  18           HA2      GLY  18   3.405   8.532   2.079
  117    HA3  GLY  18           HA1      GLY  18   4.027   7.262   1.039
  118    H    GLU  19           HN       GLU  19   1.560   7.561   2.700
  119    HA   GLU  19           HA       GLU  19   1.840   5.433   4.655
  120    HB2  GLU  19           HB2      GLU  19  -0.292   7.414   3.974
  121    HB3  GLU  19           HB1      GLU  19  -0.732   5.954   4.853
  122    HG2  GLU  19           HG2      GLU  19   1.364   7.937   5.729
  123    HG3  GLU  19           HG1      GLU  19  -0.294   7.882   6.328
  124    H    LEU  20           HN       LEU  20   0.686   3.538   4.626
  125    HA   LEU  20           HA       LEU  20  -0.090   2.563   1.991
  126    HB2  LEU  20           HB2      LEU  20   0.542   1.283   4.621
  127    HB3  LEU  20           HB1      LEU  20  -0.413   0.405   3.443
  128    HG   LEU  20           HG       LEU  20   2.313   1.528   2.803
  129   HD11  LEU  20          HD11      LEU  20   1.572  -1.221   3.805
  130   HD12  LEU  20          HD12      LEU  20   2.543  -0.023   4.662
  131   HD13  LEU  20          HD13      LEU  20   3.150  -0.754   3.177
  132   HD21  LEU  20          HD21      LEU  20   2.228  -0.164   1.020
  133   HD22  LEU  20          HD22      LEU  20   0.910   0.997   0.876
  134   HD23  LEU  20          HD23      LEU  20   0.600  -0.612   1.527
  135    H    PHE  21           HN       PHE  21  -2.151   2.084   1.441
  136    HA   PHE  21           HA       PHE  21  -4.186   2.342   3.551
  137    HB2  PHE  21           HB2      PHE  21  -4.418   2.998   0.597
  138    HB3  PHE  21           HB1      PHE  21  -5.755   3.057   1.748
  139    HD1  PHE  21           HD1      PHE  21  -5.684   4.706   3.630
  140    HD2  PHE  21           HD2      PHE  21  -2.860   4.787   0.434
  141    HE1  PHE  21           HE1      PHE  21  -5.056   7.000   4.241
  142    HE2  PHE  21           HE2      PHE  21  -2.238   7.081   1.049
  143    HZ   PHE  21           HZ       PHE  21  -3.331   8.192   2.952
  144    H    CYS  22           HN       CYS  22  -2.779   0.018   3.074
  145    HA   CYS  22           HA       CYS  22  -4.936  -1.750   2.189
  146    HB2  CYS  22           HB2      CYS  22  -2.050  -1.824   1.359
  147    HB3  CYS  22           HB1      CYS  22  -3.000  -3.307   1.416
  148    H    CYS  23           HN       CYS  23  -4.938  -3.800   3.166
  149    HA   CYS  23           HA       CYS  23  -3.970  -3.807   5.877
  150    HB2  CYS  23           HB2      CYS  23  -5.273  -5.802   6.143
  151    HB3  CYS  23           HB1      CYS  23  -6.218  -4.721   5.122
  152    H    ASP  24           HN       ASP  24  -2.874  -5.931   6.659
  153    HA   ASP  24           HA       ASP  24  -0.325  -6.096   5.629
  154    HB2  ASP  24           HB2      ASP  24  -1.930  -8.051   7.253
  155    HB3  ASP  24           HB1      ASP  24  -0.298  -8.443   6.732
  156    H    THR  25           HN       THR  25  -3.034  -8.280   4.966
  157    HA   THR  25           HA       THR  25  -1.651 -10.128   3.414
  158    HB   THR  25           HB       THR  25  -4.556  -9.359   3.115
  159    HG1  THR  25           HG1      THR  25  -3.246 -11.129   4.931
  160   HG21  THR  25          HG21      THR  25  -4.854 -11.677   2.406
  161   HG22  THR  25          HG22      THR  25  -3.123 -11.963   2.585
  162   HG23  THR  25          HG23      THR  25  -3.708 -10.847   1.352
  163    H    CYS  26           HN       CYS  26  -3.482  -7.252   2.342
  164    HA   CYS  26           HA       CYS  26  -2.894  -7.773  -0.412
  165    HB2  CYS  26           HB2      CYS  26  -3.963  -5.259   0.866
  166    HB3  CYS  26           HB1      CYS  26  -3.929  -5.590  -0.857
  167    H    SER  27           HN       SER  27  -1.418  -5.773   2.102
  168    HA   SER  27           HA       SER  27   0.104  -4.137   0.369
  169    HB2  SER  27           HB2      SER  27  -0.271  -3.509   2.699
  170    HB3  SER  27           HB1      SER  27   0.603  -4.936   3.250
  171    HG   SER  27           HG       SER  27   2.249  -3.632   3.229
  172    H    ARG  28           HN       ARG  28   0.686  -7.280   1.855
  173    HA   ARG  28           HA       ARG  28   3.430  -7.431   1.157
  174    HB2  ARG  28           HB2      ARG  28   1.439  -9.610   1.805
  175    HB3  ARG  28           HB1      ARG  28   3.181  -9.842   1.697
  176    HG2  ARG  28           HG2      ARG  28   3.555  -8.407   3.565
  177    HG3  ARG  28           HG1      ARG  28   1.862  -7.924   3.600
  178    HD2  ARG  28           HD2      ARG  28   1.291 -10.326   4.052
  179    HD3  ARG  28           HD1      ARG  28   3.018 -10.629   4.241
  180    HE   ARG  28           HE       ARG  28   2.372  -8.494   5.896
  181   HH11  ARG  28          HH11      ARG  28   1.629 -11.908   5.629
  182   HH12  ARG  28          HH12      ARG  28   1.301 -12.094   7.319
  183   HH21  ARG  28          HH21      ARG  28   1.907  -8.734   8.113
  184   HH22  ARG  28          HH22      ARG  28   1.467 -10.291   8.734
  185    H    VAL  29           HN       VAL  29   0.553  -7.857  -0.644
  186    HA   VAL  29           HA       VAL  29   1.955  -9.420  -2.686
  187    HB   VAL  29           HB       VAL  29  -1.001  -8.846  -2.475
  188   HG11  VAL  29          HG11      VAL  29   0.518 -10.771  -4.232
  189   HG12  VAL  29          HG12      VAL  29  -0.269  -9.287  -4.764
  190   HG13  VAL  29          HG13      VAL  29  -1.235 -10.624  -4.143
  191   HG21  VAL  29          HG21      VAL  29  -1.195 -11.201  -1.779
  192   HG22  VAL  29          HG22      VAL  29  -0.291 -10.224  -0.622
  193   HG23  VAL  29          HG23      VAL  29   0.564 -11.307  -1.720
  194    H    PHE  30           HN       PHE  30   0.131  -6.403  -2.242
  195    HA   PHE  30           HA       PHE  30   1.018  -5.586  -4.935
  196    HB2  PHE  30           HB2      PHE  30  -1.624  -4.869  -3.640
  197    HB3  PHE  30           HB1      PHE  30  -1.078  -4.353  -5.232
  198    HD1  PHE  30           HD1      PHE  30  -0.512  -6.338  -6.894
  199    HD2  PHE  30           HD2      PHE  30  -3.030  -6.655  -3.472
  200    HE1  PHE  30           HE1      PHE  30  -1.605  -8.305  -7.882
  201    HE2  PHE  30           HE2      PHE  30  -4.120  -8.626  -4.452
  202    HZ   PHE  30           HZ       PHE  30  -3.409  -9.455  -6.661
  203    H    HIS  31           HN       HIS  31   2.464  -5.044  -2.612
  204    HA   HIS  31           HA       HIS  31   1.977  -2.776  -1.167
  205    HB2  HIS  31           HB2      HIS  31   3.894  -4.282  -0.830
  206    HB3  HIS  31           HB1      HIS  31   4.641  -3.655  -2.292
  207    HD1  HIS  31           HD1      HIS  31   3.600  -2.405   1.164
  208    HD2  HIS  31           HD2      HIS  31   6.296  -1.573  -1.886
  209    HE1  HIS  31           HE1      HIS  31   5.200  -0.648   2.076
  210    H    GLU  32           HN       GLU  32   3.406  -2.938  -4.392
  211    HA   GLU  32           HA       GLU  32   4.148  -0.196  -4.502
  212    HB2  GLU  32           HB2      GLU  32   3.735  -2.215  -6.715
  213    HB3  GLU  32           HB1      GLU  32   4.514  -0.652  -6.909
  214    HG2  GLU  32           HG2      GLU  32   6.358  -1.292  -5.589
  215    HG3  GLU  32           HG1      GLU  32   5.528  -2.726  -4.987
  216    H    ASP  33           HN       ASP  33   1.330  -2.010  -5.544
  217    HA   ASP  33           HA       ASP  33   0.137   0.219  -6.931
  218    HB2  ASP  33           HB2      ASP  33  -0.203  -2.279  -7.445
  219    HB3  ASP  33           HB1      ASP  33  -1.272  -2.300  -6.048
  220    H    CYS  34           HN       CYS  34   0.123  -1.118  -3.745
  221    HA   CYS  34           HA       CYS  34  -2.348  -0.004  -2.872
  222    HB2  CYS  34           HB2      CYS  34  -0.035  -1.366  -1.555
  223    HB3  CYS  34           HB1      CYS  34  -1.205  -0.508  -0.551
  224    H    HIS  35           HN       HIS  35   0.632   1.434  -3.462
  225    HA   HIS  35           HA       HIS  35   0.193   3.578  -1.528
  226    HB2  HIS  35           HB2      HIS  35   2.400   2.996  -3.498
  227    HB3  HIS  35           HB1      HIS  35   2.295   4.530  -2.633
  228    HD1  HIS  35           HD1      HIS  35   2.790   4.461  -0.046
  229    HD2  HIS  35           HD2      HIS  35   3.170   0.812  -1.996
  230    HE1  HIS  35           HE1      HIS  35   4.013   2.927   1.547
  231    H    ILE  36           HN       ILE  36  -0.952   2.763  -4.502
  232    HA   ILE  36           HA       ILE  36  -1.245   5.570  -5.328
  233    HB   ILE  36           HB       ILE  36  -1.077   3.154  -7.131
  234   HG12  ILE  36          HG12      ILE  36   0.918   5.391  -6.702
  235   HG13  ILE  36          HG11      ILE  36   1.089   3.749  -6.092
  236   HG21  ILE  36          HG21      ILE  36  -1.267   6.091  -7.793
  237   HG22  ILE  36          HG22      ILE  36  -2.528   4.882  -8.035
  238   HG23  ILE  36          HG23      ILE  36  -1.029   4.788  -8.960
  239   HD11  ILE  36          HD11      ILE  36   0.977   4.546  -8.992
  240   HD12  ILE  36          HD12      ILE  36   1.170   2.904  -8.375
  241   HD13  ILE  36          HD13      ILE  36   2.426   4.109  -8.089
  242    HA   PRO  37           HA       PRO  37  -2.353   6.904  -5.305
  243    HB2  PRO  37           HB2      PRO  37  -4.643   8.413  -5.254
  244    HB3  PRO  37           HB1      PRO  37  -3.832   7.911  -6.746
  245    HG2  PRO  37           HG2      PRO  37  -6.408   7.090  -5.749
  246    HG3  PRO  37           HG1      PRO  37  -5.618   6.622  -7.264
  247    HD2  PRO  37           HD2      PRO  37  -5.752   5.175  -4.678
  248    HD3  PRO  37           HD1      PRO  37  -5.503   4.537  -6.319
  249    HA   PRO  38           HA       PRO  38  -3.129   7.349  -0.886
  250    HB2  PRO  38           HB2      PRO  38  -1.809   9.942  -0.975
  251    HB3  PRO  38           HB1      PRO  38  -1.258   8.450  -0.211
  252    HG2  PRO  38           HG2      PRO  38  -0.064   9.530  -2.410
  253    HG3  PRO  38           HG1      PRO  38  -0.064   7.791  -2.056
  254    HD2  PRO  38           HD2      PRO  38  -1.774   9.336  -3.977
  255    HD3  PRO  38           HD1      PRO  38  -1.041   7.725  -4.159
  256    H    VAL  39           HN       VAL  39  -4.936   8.126   0.050
  257    HA   VAL  39           HA       VAL  39  -6.498  10.078  -1.352
  258    HB   VAL  39           HB       VAL  39  -7.626   8.175  -0.356
  259   HG11  VAL  39          HG11      VAL  39  -7.923   8.031   2.096
  260   HG12  VAL  39          HG12      VAL  39  -6.697   9.286   2.280
  261   HG13  VAL  39          HG13      VAL  39  -6.269   7.733   1.565
  262   HG21  VAL  39          HG21      VAL  39  -8.400  10.786   0.927
  263   HG22  VAL  39          HG22      VAL  39  -9.436   9.366   0.795
  264   HG23  VAL  39          HG23      VAL  39  -8.902  10.205  -0.660
  265    H    GLU  40           HN       GLU  40  -6.503  12.193  -1.034
  266    HA   GLU  40           HA       GLU  40  -5.130  13.223   1.344
  267    HB2  GLU  40           HB2      GLU  40  -4.231  13.845  -0.910
  268    HB3  GLU  40           HB1      GLU  40  -5.738  14.696  -1.222
  269    HG2  GLU  40           HG2      GLU  40  -4.002  16.229  -0.513
  270    HG3  GLU  40           HG1      GLU  40  -5.311  16.167   0.665
  271    H    ALA  41           HN       ALA  41  -7.330  12.544   2.245
  272    HA   ALA  41           HA       ALA  41  -8.762  14.947   2.826
  273    HB1  ALA  41           HB1      ALA  41 -10.229  12.732   1.395
  274    HB2  ALA  41           HB2      ALA  41  -9.888  14.334   0.745
  275    HB3  ALA  41           HB3      ALA  41 -10.971  14.155   2.123
  276    H    GLU  42           HN       GLU  42  -9.856  11.600   2.830
  277    HA   GLU  42           HA       GLU  42  -9.699  11.593   5.758
  278    HB2  GLU  42           HB2      GLU  42 -11.290   9.797   3.918
  279    HB3  GLU  42           HB1      GLU  42 -11.306   9.742   5.675
  280    HG2  GLU  42           HG2      GLU  42 -12.233  12.028   3.960
  281    HG3  GLU  42           HG1      GLU  42 -13.261  10.887   4.827
  282    H    ARG  43           HN       ARG  43  -7.443  11.165   5.706
  283    HA   ARG  43           HA       ARG  43  -6.361   8.897   4.359
  284    HB2  ARG  43           HB2      ARG  43  -5.253  10.525   6.648
  285    HB3  ARG  43           HB1      ARG  43  -4.356   9.308   5.756
  286    HG2  ARG  43           HG2      ARG  43  -4.668  10.656   3.699
  287    HG3  ARG  43           HG1      ARG  43  -5.434  11.909   4.684
  288    HD2  ARG  43           HD2      ARG  43  -3.399  12.108   6.018
  289    HD3  ARG  43           HD1      ARG  43  -2.641  10.838   5.063
  290    HE   ARG  43           HE       ARG  43  -3.537  13.099   3.507
  291   HH11  ARG  43          HH11      ARG  43  -0.920  11.745   5.401
  292   HH12  ARG  43          HH12      ARG  43   0.306  12.704   4.634
  293   HH21  ARG  43          HH21      ARG  43  -1.913  14.367   2.481
  294   HH22  ARG  43          HH22      ARG  43  -0.252  14.176   2.970
  295    H    THR  44           HN       THR  44  -7.550   7.118   4.928
  296    HA   THR  44           HA       THR  44  -7.511   6.335   7.755
  297    HB   THR  44           HB       THR  44  -9.302   4.707   7.058
  298    HG1  THR  44           HG1      THR  44  -8.779   4.788   4.776
  299   HG21  THR  44          HG21      THR  44  -9.872   6.822   8.140
  300   HG22  THR  44          HG22      THR  44 -11.075   6.412   6.916
  301   HG23  THR  44          HG23      THR  44  -9.853   7.639   6.578
  302    HA   PRO  45           HA       PRO  45  -4.302   3.629   5.893
  303    HB2  PRO  45           HB2      PRO  45  -3.396   3.408   8.678
  304    HB3  PRO  45           HB1      PRO  45  -2.513   3.963   7.251
  305    HG2  PRO  45           HG2      PRO  45  -3.282   5.661   9.192
  306    HG3  PRO  45           HG1      PRO  45  -3.236   6.142   7.485
  307    HD2  PRO  45           HD2      PRO  45  -5.592   5.348   9.168
  308    HD3  PRO  45           HD1      PRO  45  -5.450   6.662   7.977
  309    H    TRP  46           HN       TRP  46  -6.629   3.106   8.366
  310    HA   TRP  46           HA       TRP  46  -6.027   0.276   8.612
  311    HB2  TRP  46           HB2      TRP  46  -7.998   0.250  10.166
  312    HB3  TRP  46           HB1      TRP  46  -6.723   1.364  10.649
  313    HD1  TRP  46           HD1      TRP  46 -10.318   1.315   9.323
  314    HE1  TRP  46           HE1      TRP  46 -11.360   3.638   9.671
  315    HE3  TRP  46           HE3      TRP  46  -6.147   3.849  10.867
  316    HZ2  TRP  46           HZ2      TRP  46 -10.524   6.204  10.487
  317    HZ3  TRP  46           HZ3      TRP  46  -6.359   6.241  11.409
  318    HH2  TRP  46           HH2      TRP  46  -8.497   7.391  11.220
  319    H    ASN  47           HN       ASN  47  -7.840   2.279   6.614
  320    HA   ASN  47           HA       ASN  47  -9.813   0.243   5.925
  321    HB2  ASN  47           HB2      ASN  47 -10.514   2.632   5.991
  322    HB3  ASN  47           HB1      ASN  47  -9.360   2.985   4.708
  323   HD21  ASN  47          HD21      ASN  47 -12.397   1.471   5.490
  324   HD22  ASN  47          HD22      ASN  47 -12.938   1.269   3.856
  325    H    CYS  48           HN       CYS  48  -9.249  -1.311   4.517
  326    HA   CYS  48           HA       CYS  48  -6.924  -0.882   2.837
  327    HB2  CYS  48           HB2      CYS  48  -7.217  -3.021   4.092
  328    HB3  CYS  48           HB1      CYS  48  -8.645  -3.363   3.121
  329    H    ILE  49           HN       ILE  49  -7.046  -0.198   0.812
  330    HA   ILE  49           HA       ILE  49  -9.607   0.098  -0.454
  331    HB   ILE  49           HB       ILE  49  -8.320   1.067  -2.362
  332   HG12  ILE  49          HG12      ILE  49  -5.933   0.755  -0.530
  333   HG13  ILE  49          HG11      ILE  49  -6.214  -0.212  -1.973
  334   HG21  ILE  49          HG21      ILE  49  -7.813   2.220   0.375
  335   HG22  ILE  49          HG22      ILE  49  -9.222   2.498  -0.645
  336   HG23  ILE  49          HG23      ILE  49  -7.642   3.101  -1.140
  337   HD11  ILE  49          HD11      ILE  49  -6.090   1.816  -3.337
  338   HD12  ILE  49          HD12      ILE  49  -4.617   1.560  -2.400
  339   HD13  ILE  49          HD13      ILE  49  -5.794   2.768  -1.882
  340    H    PHE  50           HN       PHE  50  -6.980  -2.175  -0.645
  341    HA   PHE  50           HA       PHE  50  -7.800  -3.218  -3.199
  342    HB2  PHE  50           HB2      PHE  50  -5.536  -3.605  -1.471
  343    HB3  PHE  50           HB1      PHE  50  -6.227  -5.173  -1.897
  344    HD1  PHE  50           HD1      PHE  50  -6.423  -5.836  -4.269
  345    HD2  PHE  50           HD2      PHE  50  -4.427  -2.259  -3.098
  346    HE1  PHE  50           HE1      PHE  50  -5.364  -5.706  -6.481
  347    HE2  PHE  50           HE2      PHE  50  -3.370  -2.127  -5.310
  348    HZ   PHE  50           HZ       PHE  50  -3.832  -3.850  -7.003
  349    H    CYS  51           HN       CYS  51  -8.423  -3.975   0.171
  350    HA   CYS  51           HA       CYS  51  -9.915  -6.346  -0.410
  351    HB2  CYS  51           HB2      CYS  51  -9.720  -4.550   1.992
  352    HB3  CYS  51           HB1      CYS  51 -10.986  -5.767   1.905
  353    H    ARG  52           HN       ARG  52 -10.774  -2.943   0.145
  354    HA   ARG  52           HA       ARG  52 -13.522  -3.192  -0.331
  355    HB2  ARG  52           HB2      ARG  52 -12.187  -1.236   0.669
  356    HB3  ARG  52           HB1      ARG  52 -11.879  -0.754  -0.988
  357    HG2  ARG  52           HG2      ARG  52 -13.693   0.542  -0.237
  358    HG3  ARG  52           HG1      ARG  52 -14.369  -0.673  -1.323
  359    HD2  ARG  52           HD2      ARG  52 -14.303  -0.977   1.677
  360    HD3  ARG  52           HD1      ARG  52 -15.658  -0.268   0.808
  361    HE   ARG  52           HE       ARG  52 -16.009  -2.405  -0.270
  362   HH11  ARG  52          HH11      ARG  52 -13.851  -2.411   2.506
  363   HH12  ARG  52          HH12      ARG  52 -14.071  -4.100   2.831
  364   HH21  ARG  52          HH21      ARG  52 -16.299  -4.617   0.155
  365   HH22  ARG  52          HH22      ARG  52 -15.479  -5.356   1.503
  366    H    MET  53           HN       MET  53 -10.899  -3.410  -2.455
  367    HA   MET  53           HA       MET  53 -12.155  -2.450  -4.838
  368    HB2  MET  53           HB2      MET  53  -9.726  -2.494  -4.655
  369    HB3  MET  53           HB1      MET  53  -9.746  -4.232  -4.420
  370    HG2  MET  53           HG2      MET  53 -10.815  -2.996  -6.924
  371    HG3  MET  53           HG1      MET  53  -9.092  -3.285  -6.709
  372    HE1  MET  53           HE1      MET  53  -8.949  -7.186  -6.355
  373    HE2  MET  53           HE2      MET  53  -9.130  -6.055  -5.016
  374    HE3  MET  53           HE3      MET  53  -8.033  -5.680  -6.343
  375    H    LYS  54           HN       LYS  54 -11.970  -5.479  -3.149
  376    HA   LYS  54           HA       LYS  54 -13.204  -6.944  -5.339
  377    HB2  LYS  54           HB2      LYS  54 -11.347  -7.924  -3.926
  378    HB3  LYS  54           HB1      LYS  54 -12.466  -7.929  -2.571
  379    HG2  LYS  54           HG2      LYS  54 -13.945  -9.450  -3.815
  380    HG3  LYS  54           HG1      LYS  54 -12.784  -9.464  -5.146
  381    HD2  LYS  54           HD2      LYS  54 -11.078 -10.377  -3.620
  382    HD3  LYS  54           HD1      LYS  54 -12.278 -10.410  -2.325
  383    HE2  LYS  54           HE2      LYS  54 -13.637 -11.973  -3.592
  384    HE3  LYS  54           HE1      LYS  54 -12.501 -11.902  -4.936
  385    HZ1  LYS  54           HZ1      LYS  54 -12.191 -13.874  -3.557
  386    HZ2  LYS  54           HZ2      LYS  54 -11.859 -12.902  -2.217
  387    HZ3  LYS  54           HZ3      LYS  54 -10.814 -12.892  -3.549
  388    H    GLU  55           HN       GLU  55 -14.946  -5.178  -4.905
  389    HA   GLU  55           HA       GLU  55 -16.648  -5.642  -2.634
  390    HB2  GLU  55           HB2      GLU  55 -16.208  -3.417  -3.882
  391    HB3  GLU  55           HB1      GLU  55 -17.407  -4.000  -5.029
  392    HG2  GLU  55           HG2      GLU  55 -18.521  -2.594  -3.482
  393    HG3  GLU  55           HG1      GLU  55 -18.992  -4.253  -3.113
  394    H    SER  56           HN       SER  56 -16.530  -6.561  -5.988
  395    HA   SER  56           HA       SER  56 -19.079  -7.992  -5.664
  396    HB2  SER  56           HB2      SER  56 -19.028  -6.259  -7.475
  397    HB3  SER  56           HB1      SER  56 -17.743  -7.175  -8.259
  398    HG   SER  56           HG       SER  56 -19.926  -7.592  -9.031
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1  13.449  -6.083  -5.760
    2    H2   GLY   1           HT2      GLY   1  14.336  -5.569  -4.417
    3    H3   GLY   1           HT3      GLY   1  12.752  -5.025  -4.641
    4    HA2  GLY   1           HA1      GLY   1  12.785  -6.708  -2.936
    5    HA3  GLY   1           HA2      GLY   1  11.910  -7.274  -4.351
    6    H    ALA   2           HN       ALA   2  12.301  -9.437  -3.656
    7    HA   ALA   2           HA       ALA   2  13.400 -11.428  -3.567
    8    HB1  ALA   2           HB1      ALA   2  15.049 -10.178  -5.763
    9    HB2  ALA   2           HB2      ALA   2  13.494 -10.981  -5.978
   10    HB3  ALA   2           HB3      ALA   2  14.894 -11.902  -5.428
   11    H    MET   3           HN       MET   3  14.235  -9.804  -1.547
   12    HA   MET   3           HA       MET   3  16.769 -10.875  -0.866
   13    HB2  MET   3           HB2      MET   3  17.505  -9.087  -2.432
   14    HB3  MET   3           HB1      MET   3  16.704  -7.897  -1.419
   15    HG2  MET   3           HG2      MET   3  18.208  -8.494   0.434
   16    HG3  MET   3           HG1      MET   3  19.033  -9.635  -0.628
   17    HE1  MET   3           HE1      MET   3  21.352  -8.413  -0.034
   18    HE2  MET   3           HE2      MET   3  20.478  -7.287   1.002
   19    HE3  MET   3           HE3      MET   3  21.603  -6.678  -0.210
   20    H    GLY   4           HN       GLY   4  15.213 -11.482   0.795
   21    HA2  GLY   4           HA2      GLY   4  14.873 -11.161   3.129
   22    HA3  GLY   4           HA1      GLY   4  15.017  -9.425   2.880
   23    H    MET   5           HN       MET   5  12.994  -9.767   4.328
   24    HA   MET   5           HA       MET   5  10.608 -10.405   2.780
   25    HB2  MET   5           HB2      MET   5  11.023  -9.732   5.696
   26    HB3  MET   5           HB1      MET   5   9.430  -9.918   4.979
   27    HG2  MET   5           HG2      MET   5  11.563 -12.043   5.067
   28    HG3  MET   5           HG1      MET   5  10.168 -11.940   6.139
   29    HE1  MET   5           HE1      MET   5   7.668 -12.197   5.330
   30    HE2  MET   5           HE2      MET   5   7.193 -12.546   3.669
   31    HE3  MET   5           HE3      MET   5   7.881 -10.974   4.077
   32    H    ARG   6           HN       ARG   6  11.426  -8.456   1.456
   33    HA   ARG   6           HA       ARG   6   9.827  -6.163   2.226
   34    HB2  ARG   6           HB2      ARG   6  11.773  -4.631   1.593
   35    HB3  ARG   6           HB1      ARG   6  11.852  -5.419   3.162
   36    HG2  ARG   6           HG2      ARG   6  13.406  -7.047   2.326
   37    HG3  ARG   6           HG1      ARG   6  13.242  -6.414   0.690
   38    HD2  ARG   6           HD2      ARG   6  14.273  -4.340   1.330
   39    HD3  ARG   6           HD1      ARG   6  14.285  -4.824   3.027
   40    HE   ARG   6           HE       ARG   6  15.749  -6.758   2.032
   41   HH11  ARG   6          HH11      ARG   6  15.824  -3.381   1.111
   42   HH12  ARG   6          HH12      ARG   6  17.523  -3.386   0.774
   43   HH21  ARG   6          HH21      ARG   6  17.981  -6.759   1.579
   44   HH22  ARG   6          HH22      ARG   6  18.742  -5.303   1.020
   45    H    ASN   7           HN       ASN   7   8.875  -5.234   0.535
   46    HA   ASN   7           HA       ASN   7   9.915  -5.807  -2.162
   47    HB2  ASN   7           HB2      ASN   7   7.814  -7.091  -1.601
   48    HB3  ASN   7           HB1      ASN   7   6.987  -5.547  -1.429
   49   HD21  ASN   7          HD21      ASN   7   9.442  -6.306  -3.824
   50   HD22  ASN   7          HD22      ASN   7   8.409  -6.159  -5.198
   51    H    LEU   8           HN       LEU   8  10.117  -3.590  -0.147
   52    HA   LEU   8           HA       LEU   8   8.677  -1.433  -1.477
   53    HB2  LEU   8           HB2      LEU   8   9.368  -0.088   0.522
   54    HB3  LEU   8           HB1      LEU   8   8.298  -1.435   0.852
   55    HG   LEU   8           HG       LEU   8  10.563  -2.686   1.381
   56   HD11  LEU   8          HD11      LEU   8  12.219  -1.240   2.400
   57   HD12  LEU   8          HD12      LEU   8  11.279   0.185   1.954
   58   HD13  LEU   8          HD13      LEU   8  12.006  -0.821   0.700
   59   HD21  LEU   8          HD21      LEU   8   8.737  -2.361   2.944
   60   HD22  LEU   8          HD22      LEU   8   9.258  -0.702   3.235
   61   HD23  LEU   8          HD23      LEU   8  10.286  -2.048   3.728
   62    H    ASP   9           HN       ASP   9  11.402  -2.826  -2.154
   63    HA   ASP   9           HA       ASP   9  13.311  -0.718  -2.009
   64    HB2  ASP   9           HB2      ASP   9  13.269  -3.236  -3.682
   65    HB3  ASP   9           HB1      ASP   9  14.648  -2.147  -3.554
   66    H    GLU  10           HN       GLU  10  10.977  -1.769  -4.370
   67    HA   GLU  10           HA       GLU  10  11.853   0.214  -6.311
   68    HB2  GLU  10           HB2      GLU  10   9.491  -1.677  -6.349
   69    HB3  GLU  10           HB1      GLU  10   9.963  -0.623  -7.673
   70    HG2  GLU  10           HG2      GLU  10  12.128  -1.815  -7.791
   71    HG3  GLU  10           HG1      GLU  10  11.538  -2.925  -6.555
   72    H    CYS  11           HN       CYS  11  10.271   0.383  -3.526
   73    HA   CYS  11           HA       CYS  11   8.173   2.215  -4.441
   74    HB2  CYS  11           HB2      CYS  11   7.506   0.274  -3.053
   75    HB3  CYS  11           HB1      CYS  11   8.557   0.849  -1.770
   76    H    GLU  12           HN       GLU  12   9.523   4.044  -4.743
   77    HA   GLU  12           HA       GLU  12  11.210   5.060  -2.710
   78    HB2  GLU  12           HB2      GLU  12   9.919   6.439  -5.056
   79    HB3  GLU  12           HB1      GLU  12  11.058   7.220  -3.974
   80    HG2  GLU  12           HG2      GLU  12  12.695   5.391  -4.588
   81    HG3  GLU  12           HG1      GLU  12  11.571   4.954  -5.874
   82    H    VAL  13           HN       VAL  13   7.812   5.307  -3.345
   83    HA   VAL  13           HA       VAL  13   7.307   7.653  -1.908
   84    HB   VAL  13           HB       VAL  13   5.689   6.717  -3.486
   85   HG11  VAL  13          HG11      VAL  13   5.963   4.353  -2.962
   86   HG12  VAL  13          HG12      VAL  13   4.274   4.850  -2.906
   87   HG13  VAL  13          HG13      VAL  13   5.171   4.612  -1.407
   88   HG21  VAL  13          HG21      VAL  13   4.590   6.960  -0.699
   89   HG22  VAL  13          HG22      VAL  13   3.661   7.115  -2.189
   90   HG23  VAL  13          HG23      VAL  13   4.915   8.296  -1.801
   91    H    CYS  14           HN       CYS  14   7.700   4.328  -0.844
   92    HA   CYS  14           HA       CYS  14   6.797   4.679   1.808
   93    HB2  CYS  14           HB2      CYS  14   8.401   2.700   0.365
   94    HB3  CYS  14           HB1      CYS  14   8.857   2.877   2.055
   95    H    ARG  15           HN       ARG  15   9.865   5.267   0.248
   96    HA   ARG  15           HA       ARG  15  11.298   5.930   2.627
   97    HB2  ARG  15           HB2      ARG  15  11.888   6.625  -0.253
   98    HB3  ARG  15           HB1      ARG  15  13.021   6.767   1.085
   99    HG2  ARG  15           HG2      ARG  15  13.091   4.409   1.382
  100    HG3  ARG  15           HG1      ARG  15  11.752   4.171   0.259
  101    HD2  ARG  15           HD2      ARG  15  13.817   3.612  -0.841
  102    HD3  ARG  15           HD1      ARG  15  13.164   5.086  -1.550
  103    HE   ARG  15           HE       ARG  15  14.927   5.873   0.443
  104   HH11  ARG  15          HH11      ARG  15  15.051   4.098  -2.568
  105   HH12  ARG  15          HH12      ARG  15  16.687   4.552  -2.919
  106   HH21  ARG  15          HH21      ARG  15  17.092   6.485  -0.021
  107   HH22  ARG  15          HH22      ARG  15  17.846   5.915  -1.479
  108    H    ASP  16           HN       ASP  16   9.484   7.670   0.236
  109    HA   ASP  16           HA       ASP  16  10.029  10.289   1.155
  110    HB2  ASP  16           HB2      ASP  16   9.123   9.744  -1.084
  111    HB3  ASP  16           HB1      ASP  16   7.615   9.239  -0.340
  112    H    GLY  17           HN       GLY  17   8.222   7.784   2.527
  113    HA2  GLY  17           HA2      GLY  17   7.388   7.944   4.749
  114    HA3  GLY  17           HA1      GLY  17   7.120   9.664   4.494
  115    H    GLY  18           HN       GLY  18   6.098   7.634   1.952
  116    HA2  GLY  18           HA2      GLY  18   3.400   8.446   2.186
  117    HA3  GLY  18           HA1      GLY  18   4.013   7.217   1.097
  118    H    GLU  19           HN       GLU  19   1.583   7.383   2.736
  119    HA   GLU  19           HA       GLU  19   1.905   5.268   4.696
  120    HB2  GLU  19           HB2      GLU  19  -0.358   7.085   3.924
  121    HB3  GLU  19           HB1      GLU  19  -0.642   5.675   4.937
  122    HG2  GLU  19           HG2      GLU  19   1.268   7.924   5.555
  123    HG3  GLU  19           HG1      GLU  19  -0.339   7.724   6.253
  124    H    LEU  20           HN       LEU  20   0.351   3.493   4.733
  125    HA   LEU  20           HA       LEU  20  -0.009   2.371   2.048
  126    HB2  LEU  20           HB2      LEU  20   0.477   1.184   4.746
  127    HB3  LEU  20           HB1      LEU  20  -0.345   0.233   3.525
  128    HG   LEU  20           HG       LEU  20   2.335   1.498   3.001
  129   HD11  LEU  20          HD11      LEU  20   1.770  -1.246   4.118
  130   HD12  LEU  20          HD12      LEU  20   2.556   0.080   4.977
  131   HD13  LEU  20          HD13      LEU  20   3.341  -0.653   3.578
  132   HD21  LEU  20          HD21      LEU  20   2.465  -0.313   1.333
  133   HD22  LEU  20          HD22      LEU  20   1.094   0.758   1.046
  134   HD23  LEU  20          HD23      LEU  20   0.840  -0.824   1.779
  135    H    PHE  21           HN       PHE  21  -1.995   1.918   1.312
  136    HA   PHE  21           HA       PHE  21  -4.229   2.199   3.204
  137    HB2  PHE  21           HB2      PHE  21  -4.148   2.706   0.212
  138    HB3  PHE  21           HB1      PHE  21  -5.599   2.821   1.212
  139    HD1  PHE  21           HD1      PHE  21  -5.765   4.578   2.956
  140    HD2  PHE  21           HD2      PHE  21  -2.515   4.457   0.197
  141    HE1  PHE  21           HE1      PHE  21  -5.175   6.888   3.545
  142    HE2  PHE  21           HE2      PHE  21  -1.926   6.766   0.791
  143    HZ   PHE  21           HZ       PHE  21  -3.252   7.983   2.465
  144    H    CYS  22           HN       CYS  22  -2.850  -0.129   3.104
  145    HA   CYS  22           HA       CYS  22  -4.891  -1.960   2.086
  146    HB2  CYS  22           HB2      CYS  22  -2.019  -1.858   1.334
  147    HB3  CYS  22           HB1      CYS  22  -2.712  -3.454   1.601
  148    H    CYS  23           HN       CYS  23  -4.788  -4.091   3.077
  149    HA   CYS  23           HA       CYS  23  -4.110  -4.103   5.858
  150    HB2  CYS  23           HB2      CYS  23  -4.663  -6.552   4.170
  151    HB3  CYS  23           HB1      CYS  23  -4.968  -6.328   5.891
  152    H    ASP  24           HN       ASP  24  -2.594  -5.880   6.754
  153    HA   ASP  24           HA       ASP  24  -0.016  -5.528   5.768
  154    HB2  ASP  24           HB2      ASP  24  -0.420  -6.324   8.041
  155    HB3  ASP  24           HB1      ASP  24  -1.051  -7.845   7.415
  156    H    THR  25           HN       THR  25  -2.218  -8.272   5.253
  157    HA   THR  25           HA       THR  25  -0.482  -9.757   3.615
  158    HB   THR  25           HB       THR  25  -3.491  -9.782   3.461
  159    HG1  THR  25           HG1      THR  25  -1.713 -10.980   5.336
  160   HG21  THR  25          HG21      THR  25  -3.171 -12.145   2.878
  161   HG22  THR  25          HG22      THR  25  -1.422 -11.930   2.978
  162   HG23  THR  25          HG23      THR  25  -2.346 -11.086   1.735
  163    H    CYS  26           HN       CYS  26  -3.062  -7.438   2.811
  164    HA   CYS  26           HA       CYS  26  -2.854  -7.680   0.019
  165    HB2  CYS  26           HB2      CYS  26  -3.787  -5.295   1.640
  166    HB3  CYS  26           HB1      CYS  26  -4.119  -5.568  -0.069
  167    H    SER  27           HN       SER  27  -1.287  -5.490   2.301
  168    HA   SER  27           HA       SER  27   0.144  -3.969   0.394
  169    HB2  SER  27           HB2      SER  27  -0.188  -3.162   2.667
  170    HB3  SER  27           HB1      SER  27   0.735  -4.518   3.310
  171    HG   SER  27           HG       SER  27   2.152  -2.859   3.212
  172    H    ARG  28           HN       ARG  28   0.696  -7.080   1.823
  173    HA   ARG  28           HA       ARG  28   3.475  -7.210   1.161
  174    HB2  ARG  28           HB2      ARG  28   2.609  -8.520   3.001
  175    HB3  ARG  28           HB1      ARG  28   1.466  -9.325   1.941
  176    HG2  ARG  28           HG2      ARG  28   3.292 -10.415   0.768
  177    HG3  ARG  28           HG1      ARG  28   4.461  -9.585   1.799
  178    HD2  ARG  28           HD2      ARG  28   3.643 -10.715   3.743
  179    HD3  ARG  28           HD1      ARG  28   2.297 -11.404   2.839
  180    HE   ARG  28           HE       ARG  28   4.479 -12.359   1.539
  181   HH11  ARG  28          HH11      ARG  28   3.532 -12.314   4.909
  182   HH12  ARG  28          HH12      ARG  28   4.276 -13.838   5.274
  183   HH21  ARG  28          HH21      ARG  28   5.451 -14.369   2.007
  184   HH22  ARG  28          HH22      ARG  28   5.366 -15.015   3.616
  185    H    VAL  29           HN       VAL  29   0.486  -7.879  -0.465
  186    HA   VAL  29           HA       VAL  29   1.847  -9.381  -2.561
  187    HB   VAL  29           HB       VAL  29  -1.097  -8.750  -2.320
  188   HG11  VAL  29          HG11      VAL  29  -0.384  -9.252  -4.607
  189   HG12  VAL  29          HG12      VAL  29  -1.386 -10.547  -3.952
  190   HG13  VAL  29          HG13      VAL  29   0.362 -10.748  -4.049
  191   HG21  VAL  29          HG21      VAL  29  -0.415 -10.107  -0.448
  192   HG22  VAL  29          HG22      VAL  29   0.443 -11.212  -1.520
  193   HG23  VAL  29          HG23      VAL  29  -1.316 -11.102  -1.590
  194    H    PHE  30           HN       PHE  30  -0.107  -6.417  -2.212
  195    HA   PHE  30           HA       PHE  30   0.730  -5.659  -4.945
  196    HB2  PHE  30           HB2      PHE  30  -1.728  -4.661  -3.489
  197    HB3  PHE  30           HB1      PHE  30  -1.320  -4.411  -5.183
  198    HD1  PHE  30           HD1      PHE  30  -1.132  -6.611  -6.623
  199    HD2  PHE  30           HD2      PHE  30  -3.197  -6.311  -2.908
  200    HE1  PHE  30           HE1      PHE  30  -2.473  -8.584  -7.209
  201    HE2  PHE  30           HE2      PHE  30  -4.532  -8.288  -3.490
  202    HZ   PHE  30           HZ       PHE  30  -4.174  -9.427  -5.641
  203    H    HIS  31           HN       HIS  31   2.448  -5.104  -2.864
  204    HA   HIS  31           HA       HIS  31   2.073  -2.914  -1.269
  205    HB2  HIS  31           HB2      HIS  31   4.038  -4.402  -1.188
  206    HB3  HIS  31           HB1      HIS  31   4.649  -3.659  -2.661
  207    HD1  HIS  31           HD1      HIS  31   3.777  -2.607   0.913
  208    HD2  HIS  31           HD2      HIS  31   6.301  -1.570  -2.229
  209    HE1  HIS  31           HE1      HIS  31   5.382  -0.868   1.826
  210    H    GLU  32           HN       GLU  32   3.258  -2.848  -4.618
  211    HA   GLU  32           HA       GLU  32   3.943  -0.090  -4.553
  212    HB2  GLU  32           HB2      GLU  32   3.454  -1.974  -6.860
  213    HB3  GLU  32           HB1      GLU  32   4.042  -0.330  -7.051
  214    HG2  GLU  32           HG2      GLU  32   6.055  -0.851  -5.850
  215    HG3  GLU  32           HG1      GLU  32   5.449  -2.460  -5.455
  216    H    ASP  33           HN       ASP  33   1.104  -1.871  -5.643
  217    HA   ASP  33           HA       ASP  33  -0.186   0.472  -6.700
  218    HB2  ASP  33           HB2      ASP  33  -0.506  -1.993  -7.431
  219    HB3  ASP  33           HB1      ASP  33  -1.572  -2.116  -6.036
  220    H    CYS  34           HN       CYS  34   0.009  -1.149  -3.663
  221    HA   CYS  34           HA       CYS  34  -2.432  -0.193  -2.545
  222    HB2  CYS  34           HB2      CYS  34   0.025  -1.509  -1.437
  223    HB3  CYS  34           HB1      CYS  34  -1.186  -0.839  -0.346
  224    H    HIS  35           HN       HIS  35   0.420   1.396  -3.262
  225    HA   HIS  35           HA       HIS  35   0.034   3.413  -1.175
  226    HB2  HIS  35           HB2      HIS  35   2.174   3.016  -3.260
  227    HB3  HIS  35           HB1      HIS  35   2.070   4.475  -2.274
  228    HD1  HIS  35           HD1      HIS  35   2.752   4.243   0.241
  229    HD2  HIS  35           HD2      HIS  35   2.990   0.722  -1.950
  230    HE1  HIS  35           HE1      HIS  35   4.098   2.624   1.641
  231    H    ILE  36           HN       ILE  36  -1.054   2.722  -4.253
  232    HA   ILE  36           HA       ILE  36  -1.237   5.551  -5.032
  233    HB   ILE  36           HB       ILE  36  -1.275   3.108  -6.806
  234   HG12  ILE  36          HG12      ILE  36   0.897   5.188  -6.456
  235   HG13  ILE  36          HG11      ILE  36   0.935   3.570  -5.764
  236   HG21  ILE  36          HG21      ILE  36  -1.236   6.039  -7.513
  237   HG22  ILE  36          HG22      ILE  36  -2.587   4.929  -7.735
  238   HG23  ILE  36          HG23      ILE  36  -1.102   4.707  -8.660
  239   HD11  ILE  36          HD11      ILE  36   0.884   4.231  -8.700
  240   HD12  ILE  36          HD12      ILE  36   0.926   2.609  -8.008
  241   HD13  ILE  36          HD13      ILE  36   2.290   3.705  -7.775
  242    HA   PRO  37           HA       PRO  37  -2.208   6.985  -5.444
  243    HB2  PRO  37           HB2      PRO  37  -4.175   8.777  -5.409
  244    HB3  PRO  37           HB1      PRO  37  -3.856   7.819  -6.868
  245    HG2  PRO  37           HG2      PRO  37  -6.022   7.522  -4.836
  246    HG3  PRO  37           HG1      PRO  37  -6.079   7.256  -6.589
  247    HD2  PRO  37           HD2      PRO  37  -5.767   5.273  -4.607
  248    HD3  PRO  37           HD1      PRO  37  -5.509   5.069  -6.352
  249    HA   PRO  38           HA       PRO  38  -2.224   7.660  -1.005
  250    HB2  PRO  38           HB2      PRO  38  -0.960  10.259  -1.622
  251    HB3  PRO  38           HB1      PRO  38  -0.359   8.926  -0.630
  252    HG2  PRO  38           HG2      PRO  38   0.696   9.457  -3.044
  253    HG3  PRO  38           HG1      PRO  38   0.530   7.796  -2.440
  254    HD2  PRO  38           HD2      PRO  38  -1.163   9.266  -4.436
  255    HD3  PRO  38           HD1      PRO  38  -0.630   7.568  -4.439
  256    H    VAL  39           HN       VAL  39  -3.867   8.440   0.185
  257    HA   VAL  39           HA       VAL  39  -5.647  10.423  -0.898
  258    HB   VAL  39           HB       VAL  39  -5.696   9.225   1.876
  259   HG11  VAL  39          HG11      VAL  39  -8.037   9.857   1.879
  260   HG12  VAL  39          HG12      VAL  39  -7.887  10.492   0.242
  261   HG13  VAL  39          HG13      VAL  39  -7.029  11.269   1.569
  262   HG21  VAL  39          HG21      VAL  39  -5.780   7.423   0.267
  263   HG22  VAL  39          HG22      VAL  39  -7.034   8.258  -0.647
  264   HG23  VAL  39          HG23      VAL  39  -7.380   7.655   0.973
  265    H    GLU  40           HN       GLU  40  -4.561  12.330  -1.023
  266    HA   GLU  40           HA       GLU  40  -2.921  13.261   1.149
  267    HB2  GLU  40           HB2      GLU  40  -3.705  14.633  -1.422
  268    HB3  GLU  40           HB1      GLU  40  -2.463  15.179  -0.304
  269    HG2  GLU  40           HG2      GLU  40  -2.421  12.555  -1.775
  270    HG3  GLU  40           HG1      GLU  40  -1.561  14.008  -2.275
  271    H    ALA  41           HN       ALA  41  -4.668  13.231   2.678
  272    HA   ALA  41           HA       ALA  41  -5.593  15.760   3.395
  273    HB1  ALA  41           HB1      ALA  41  -7.171  15.543   1.543
  274    HB2  ALA  41           HB2      ALA  41  -8.021  15.507   3.088
  275    HB3  ALA  41           HB3      ALA  41  -7.744  14.011   2.197
  276    H    GLU  42           HN       GLU  42  -6.194  12.321   3.443
  277    HA   GLU  42           HA       GLU  42  -5.993  12.254   6.318
  278    HB2  GLU  42           HB2      GLU  42  -8.117  10.813   6.410
  279    HB3  GLU  42           HB1      GLU  42  -8.309  12.557   6.300
  280    HG2  GLU  42           HG2      GLU  42  -8.797  12.406   3.953
  281    HG3  GLU  42           HG1      GLU  42  -8.469  10.675   3.959
  282    H    ARG  43           HN       ARG  43  -4.075  11.164   5.710
  283    HA   ARG  43           HA       ARG  43  -4.153   8.740   4.194
  284    HB2  ARG  43           HB2      ARG  43  -2.010   9.954   5.934
  285    HB3  ARG  43           HB1      ARG  43  -1.798   8.475   5.013
  286    HG2  ARG  43           HG2      ARG  43  -2.280   9.773   2.946
  287    HG3  ARG  43           HG1      ARG  43  -2.292  11.238   3.931
  288    HD2  ARG  43           HD2      ARG  43  -0.016  10.912   4.571
  289    HD3  ARG  43           HD1      ARG  43   0.017   9.312   3.837
  290    HE   ARG  43           HE       ARG  43  -0.595  11.283   1.886
  291   HH11  ARG  43          HH11      ARG  43   2.048  10.090   3.849
  292   HH12  ARG  43          HH12      ARG  43   3.266  10.498   2.684
  293   HH21  ARG  43          HH21      ARG  43   1.002  11.822   0.347
  294   HH22  ARG  43          HH22      ARG  43   2.673  11.460   0.677
  295    H    THR  44           HN       THR  44  -5.849   7.722   5.409
  296    HA   THR  44           HA       THR  44  -5.143   6.740   8.060
  297    HB   THR  44           HB       THR  44  -7.492   5.886   8.071
  298    HG1  THR  44           HG1      THR  44  -7.431   5.948   5.589
  299   HG21  THR  44          HG21      THR  44  -7.145   8.819   7.431
  300   HG22  THR  44          HG22      THR  44  -7.007   8.075   9.024
  301   HG23  THR  44          HG23      THR  44  -8.565   8.111   8.199
  302    HA   PRO  45           HA       PRO  45  -3.785   2.949   5.999
  303    HB2  PRO  45           HB2      PRO  45  -3.304   1.994   8.734
  304    HB3  PRO  45           HB1      PRO  45  -2.159   2.209   7.405
  305    HG2  PRO  45           HG2      PRO  45  -2.157   3.825   9.558
  306    HG3  PRO  45           HG1      PRO  45  -1.747   4.413   7.937
  307    HD2  PRO  45           HD2      PRO  45  -4.311   4.707   9.466
  308    HD3  PRO  45           HD1      PRO  45  -3.456   5.897   8.457
  309    H    TRP  46           HN       TRP  46  -6.343   3.446   8.146
  310    HA   TRP  46           HA       TRP  46  -7.195   0.663   8.210
  311    HB2  TRP  46           HB2      TRP  46  -8.678   3.093   9.253
  312    HB3  TRP  46           HB1      TRP  46  -9.000   1.409   9.648
  313    HD1  TRP  46           HD1      TRP  46  -7.301   0.207  11.370
  314    HE1  TRP  46           HE1      TRP  46  -5.699   1.178  13.129
  315    HE3  TRP  46           HE3      TRP  46  -7.141   5.049   9.744
  316    HZ2  TRP  46           HZ2      TRP  46  -4.524   3.661  13.748
  317    HZ3  TRP  46           HZ3      TRP  46  -5.751   6.660  10.977
  318    HH2  TRP  46           HH2      TRP  46  -4.470   5.981  12.934
  319    H    ASN  47           HN       ASN  47  -6.980   1.684   5.653
  320    HA   ASN  47           HA       ASN  47  -9.706   1.436   4.698
  321    HB2  ASN  47           HB2      ASN  47  -9.501   3.860   4.953
  322    HB3  ASN  47           HB1      ASN  47  -7.989   3.852   4.053
  323   HD21  ASN  47          HD21      ASN  47  -8.779   5.280   2.513
  324   HD22  ASN  47          HD22      ASN  47  -9.937   4.808   1.318
  325    H    CYS  48           HN       CYS  48  -9.164  -0.459   3.673
  326    HA   CYS  48           HA       CYS  48  -6.779  -0.539   1.998
  327    HB2  CYS  48           HB2      CYS  48  -7.307  -2.460   3.489
  328    HB3  CYS  48           HB1      CYS  48  -8.815  -2.702   2.621
  329    H    ILE  49           HN       ILE  49  -6.872  -0.067  -0.084
  330    HA   ILE  49           HA       ILE  49  -9.381   0.508  -1.323
  331    HB   ILE  49           HB       ILE  49  -7.842   0.748  -3.426
  332   HG12  ILE  49          HG12      ILE  49  -5.813   0.851  -1.189
  333   HG13  ILE  49          HG11      ILE  49  -5.899  -0.403  -2.422
  334   HG21  ILE  49          HG21      ILE  49  -8.918   2.600  -2.298
  335   HG22  ILE  49          HG22      ILE  49  -7.258   3.026  -2.712
  336   HG23  ILE  49          HG23      ILE  49  -7.669   2.596  -1.051
  337   HD11  ILE  49          HD11      ILE  49  -5.376   1.222  -4.135
  338   HD12  ILE  49          HD12      ILE  49  -4.154   1.262  -2.864
  339   HD13  ILE  49          HD13      ILE  49  -5.388   2.516  -2.938
  340    H    PHE  50           HN       PHE  50  -7.370  -2.287  -1.200
  341    HA   PHE  50           HA       PHE  50  -8.481  -3.416  -3.623
  342    HB2  PHE  50           HB2      PHE  50  -6.481  -4.407  -1.613
  343    HB3  PHE  50           HB1      PHE  50  -7.240  -5.532  -2.741
  344    HD1  PHE  50           HD2      PHE  50  -5.218  -2.443  -2.531
  345    HD2  PHE  50           HD1      PHE  50  -6.536  -5.664  -4.976
  346    HE1  PHE  50           HE2      PHE  50  -3.584  -1.801  -4.252
  347    HE2  PHE  50           HE1      PHE  50  -4.901  -5.035  -6.693
  348    HZ   PHE  50           HZ       PHE  50  -3.518  -3.038  -6.401
  349    H    CYS  51           HN       CYS  51  -8.888  -3.762  -0.140
  350    HA   CYS  51           HA       CYS  51 -10.705  -5.959  -0.378
  351    HB2  CYS  51           HB2      CYS  51  -9.869  -4.220   1.919
  352    HB3  CYS  51           HB1      CYS  51 -11.206  -5.351   2.085
  353    H    ARG  52           HN       ARG  52 -11.141  -2.565  -0.770
  354    HA   ARG  52           HA       ARG  52 -13.954  -2.804   0.042
  355    HB2  ARG  52           HB2      ARG  52 -12.270  -0.307  -0.271
  356    HB3  ARG  52           HB1      ARG  52 -13.982  -0.328   0.132
  357    HG2  ARG  52           HG2      ARG  52 -13.416  -1.617   2.185
  358    HG3  ARG  52           HG1      ARG  52 -11.710  -1.393   1.793
  359    HD2  ARG  52           HD2      ARG  52 -11.991   1.025   1.907
  360    HD3  ARG  52           HD1      ARG  52 -13.708   0.817   2.258
  361    HE   ARG  52           HE       ARG  52 -12.053  -0.575   4.117
  362   HH11  ARG  52          HH11      ARG  52 -13.364   2.568   3.333
  363   HH12  ARG  52          HH12      ARG  52 -13.265   3.162   4.958
  364   HH21  ARG  52          HH21      ARG  52 -11.914   0.193   6.256
  365   HH22  ARG  52          HH22      ARG  52 -12.430   1.807   6.624
  366    H    MET  53           HN       MET  53 -11.923  -2.876  -2.487
  367    HA   MET  53           HA       MET  53 -14.066  -2.298  -4.398
  368    HB2  MET  53           HB2      MET  53 -11.157  -1.565  -4.846
  369    HB3  MET  53           HB1      MET  53 -12.491  -1.285  -5.956
  370    HG2  MET  53           HG2      MET  53 -13.481   0.286  -4.374
  371    HG3  MET  53           HG1      MET  53 -12.152  -0.005  -3.255
  372    HE1  MET  53           HE1      MET  53 -12.952   2.900  -4.073
  373    HE2  MET  53           HE2      MET  53 -11.376   3.617  -4.407
  374    HE3  MET  53           HE3      MET  53 -11.575   2.526  -3.036
  375    H    LYS  54           HN       LYS  54 -13.576  -4.673  -3.293
  376    HA   LYS  54           HA       LYS  54 -11.481  -6.151  -4.586
  377    HB2  LYS  54           HB2      LYS  54 -12.195  -6.477  -2.202
  378    HB3  LYS  54           HB1      LYS  54 -13.712  -7.132  -2.793
  379    HG2  LYS  54           HG2      LYS  54 -12.576  -9.000  -3.800
  380    HG3  LYS  54           HG1      LYS  54 -11.002  -8.320  -3.368
  381    HD2  LYS  54           HD2      LYS  54 -11.601  -8.475  -0.993
  382    HD3  LYS  54           HD1      LYS  54 -13.154  -9.181  -1.434
  383    HE2  LYS  54           HE2      LYS  54 -11.998 -11.076  -2.458
  384    HE3  LYS  54           HE1      LYS  54 -10.443 -10.366  -2.016
  385    HZ1  LYS  54           HZ1      LYS  54 -12.554 -11.233  -0.116
  386    HZ2  LYS  54           HZ2      LYS  54 -11.070 -10.543   0.309
  387    HZ3  LYS  54           HZ3      LYS  54 -11.113 -12.057  -0.437
  388    H    GLU  55           HN       GLU  55 -12.190  -5.831  -6.747
  389    HA   GLU  55           HA       GLU  55 -14.199  -7.797  -7.569
  390    HB2  GLU  55           HB2      GLU  55 -13.998  -4.948  -8.545
  391    HB3  GLU  55           HB1      GLU  55 -14.933  -6.194  -9.353
  392    HG2  GLU  55           HG2      GLU  55 -16.351  -6.437  -7.405
  393    HG3  GLU  55           HG1      GLU  55 -15.382  -5.254  -6.530
  394    H    SER  56           HN       SER  56 -12.468  -9.143  -8.063
  395    HA   SER  56           HA       SER  56 -10.904 -10.130  -9.357
  396    HB2  SER  56           HB2      SER  56 -11.875  -8.187 -11.463
  397    HB3  SER  56           HB1      SER  56 -10.989  -9.684 -11.755
  398    HG   SER  56           HG       SER  56 -13.655  -9.284 -11.104
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  16.737  -8.747   2.355
    2    H2   GLY   1           HT2      GLY   1  17.059  -8.077   3.873
    3    H3   GLY   1           HT3      GLY   1  17.825  -7.461   2.498
    4    HA2  GLY   1           HA1      GLY   1  14.923  -7.331   3.074
    5    HA3  GLY   1           HA2      GLY   1  16.059  -5.997   3.219
    6    H    ALA   2           HN       ALA   2  13.882  -5.672   1.674
    7    HA   ALA   2           HA       ALA   2  13.287  -4.787  -0.320
    8    HB1  ALA   2           HB1      ALA   2  16.187  -5.069  -1.084
    9    HB2  ALA   2           HB2      ALA   2  15.484  -3.695  -0.233
   10    HB3  ALA   2           HB3      ALA   2  14.982  -4.061  -1.884
   11    H    MET   3           HN       MET   3  13.696  -7.825   0.133
   12    HA   MET   3           HA       MET   3  13.005  -8.547  -2.620
   13    HB2  MET   3           HB2      MET   3  15.099  -9.971  -0.955
   14    HB3  MET   3           HB1      MET   3  14.364 -10.661  -2.392
   15    HG2  MET   3           HG2      MET   3  15.294  -8.912  -3.767
   16    HG3  MET   3           HG1      MET   3  15.935  -8.091  -2.344
   17    HE1  MET   3           HE1      MET   3  17.678  -8.824  -4.916
   18    HE2  MET   3           HE2      MET   3  19.155  -9.412  -4.153
   19    HE3  MET   3           HE3      MET   3  18.329  -7.996  -3.504
   20    H    GLY   4           HN       GLY   4  11.059  -8.192  -0.983
   21    HA2  GLY   4           HA2      GLY   4   9.180  -9.587  -0.438
   22    HA3  GLY   4           HA1      GLY   4  10.305 -10.874  -0.026
   23    H    MET   5           HN       MET   5  12.058  -9.642   1.632
   24    HA   MET   5           HA       MET   5  10.397  -9.059   3.966
   25    HB2  MET   5           HB2      MET   5  13.393  -9.474   3.775
   26    HB3  MET   5           HB1      MET   5  12.475  -9.302   5.260
   27    HG2  MET   5           HG2      MET   5  11.334 -11.380   4.861
   28    HG3  MET   5           HG1      MET   5  12.094 -11.536   3.278
   29    HE1  MET   5           HE1      MET   5  13.025 -13.950   3.742
   30    HE2  MET   5           HE2      MET   5  12.137 -13.895   5.264
   31    HE3  MET   5           HE3      MET   5  13.824 -14.404   5.246
   32    H    ARG   6           HN       ARG   6   9.910  -7.000   4.341
   33    HA   ARG   6           HA       ARG   6   9.872  -4.734   4.150
   34    HB2  ARG   6           HB2      ARG   6  12.859  -5.048   4.505
   35    HB3  ARG   6           HB1      ARG   6  11.961  -3.551   4.701
   36    HG2  ARG   6           HG2      ARG   6  10.718  -4.575   6.566
   37    HG3  ARG   6           HG1      ARG   6  11.704  -6.029   6.388
   38    HD2  ARG   6           HD2      ARG   6  12.665  -3.260   7.098
   39    HD3  ARG   6           HD1      ARG   6  12.599  -4.662   8.163
   40    HE   ARG   6           HE       ARG   6  14.283  -4.731   5.755
   41   HH11  ARG   6          HH11      ARG   6  13.971  -4.837   9.240
   42   HH12  ARG   6          HH12      ARG   6  15.626  -5.280   9.501
   43   HH21  ARG   6          HH21      ARG   6  16.460  -5.319   6.096
   44   HH22  ARG   6          HH22      ARG   6  17.039  -5.560   7.715
   45    H    ASN   7           HN       ASN   7   9.370  -5.473   1.831
   46    HA   ASN   7           HA       ASN   7  11.420  -5.003  -0.137
   47    HB2  ASN   7           HB2      ASN   7   9.391  -6.624  -0.279
   48    HB3  ASN   7           HB1      ASN   7   8.492  -5.191  -0.767
   49   HD21  ASN   7          HD21      ASN   7   8.926  -4.247  -2.776
   50   HD22  ASN   7          HD22      ASN   7   9.855  -5.055  -3.986
   51    H    LEU   8           HN       LEU   8   9.577  -3.073   1.721
   52    HA   LEU   8           HA       LEU   8   8.820  -1.003  -0.050
   53    HB2  LEU   8           HB2      LEU   8   8.632   0.325   2.116
   54    HB3  LEU   8           HB1      LEU   8   7.614  -1.089   1.940
   55    HG   LEU   8           HG       LEU   8   9.503  -2.300   3.276
   56   HD11  LEU   8          HD11      LEU   8  11.097  -0.426   3.200
   57   HD12  LEU   8          HD12      LEU   8  10.695  -0.916   4.845
   58   HD13  LEU   8          HD13      LEU   8   9.973   0.537   4.158
   59   HD21  LEU   8          HD21      LEU   8   7.621  -0.336   4.567
   60   HD22  LEU   8          HD22      LEU   8   8.396  -1.699   5.374
   61   HD23  LEU   8          HD23      LEU   8   7.238  -1.985   4.076
   62    H    ASP   9           HN       ASP   9  11.838  -1.965   0.594
   63    HA   ASP   9           HA       ASP   9  13.113   0.533   1.174
   64    HB2  ASP   9           HB2      ASP   9  14.138  -1.621   1.801
   65    HB3  ASP   9           HB1      ASP   9  14.302  -2.033   0.100
   66    H    GLU  10           HN       GLU  10  12.537  -1.384  -1.727
   67    HA   GLU  10           HA       GLU  10  13.851   0.454  -3.487
   68    HB2  GLU  10           HB2      GLU  10  11.879  -1.773  -4.031
   69    HB3  GLU  10           HB1      GLU  10  12.670  -0.835  -5.289
   70    HG2  GLU  10           HG2      GLU  10  14.135  -2.457  -3.227
   71    HG3  GLU  10           HG1      GLU  10  13.712  -3.040  -4.836
   72    H    CYS  11           HN       CYS  11  10.693   0.147  -2.151
   73    HA   CYS  11           HA       CYS  11   9.270   1.845  -3.896
   74    HB2  CYS  11           HB2      CYS  11   8.176   0.268  -2.420
   75    HB3  CYS  11           HB1      CYS  11   8.855   1.057  -1.012
   76    H    GLU  12           HN       GLU  12  10.239   3.764  -4.281
   77    HA   GLU  12           HA       GLU  12  11.545   5.400  -2.421
   78    HB2  GLU  12           HB2      GLU  12  10.154   6.127  -4.995
   79    HB3  GLU  12           HB1      GLU  12  11.192   7.216  -4.087
   80    HG2  GLU  12           HG2      GLU  12  12.026   4.615  -5.343
   81    HG3  GLU  12           HG1      GLU  12  12.391   6.230  -5.947
   82    H    VAL  13           HN       VAL  13   8.218   4.876  -3.063
   83    HA   VAL  13           HA       VAL  13   7.189   7.300  -2.048
   84    HB   VAL  13           HB       VAL  13   5.861   4.593  -2.108
   85   HG11  VAL  13          HG11      VAL  13   4.630   6.052  -0.702
   86   HG12  VAL  13          HG12      VAL  13   3.782   5.991  -2.244
   87   HG13  VAL  13          HG13      VAL  13   4.779   7.385  -1.844
   88   HG21  VAL  13          HG21      VAL  13   5.915   6.775  -4.178
   89   HG22  VAL  13          HG22      VAL  13   4.879   5.349  -4.237
   90   HG23  VAL  13          HG23      VAL  13   6.632   5.171  -4.315
   91    H    CYS  14           HN       CYS  14   7.718   4.098  -0.618
   92    HA   CYS  14           HA       CYS  14   6.847   4.768   1.978
   93    HB2  CYS  14           HB2      CYS  14   8.486   2.584   0.802
   94    HB3  CYS  14           HB1      CYS  14   8.562   2.818   2.544
   95    H    ARG  15           HN       ARG  15   9.928   5.077   0.354
   96    HA   ARG  15           HA       ARG  15  11.450   5.775   2.644
   97    HB2  ARG  15           HB2      ARG  15  11.904   6.491  -0.256
   98    HB3  ARG  15           HB1      ARG  15  13.083   6.700   1.030
   99    HG2  ARG  15           HG2      ARG  15  13.158   4.302   1.384
  100    HG3  ARG  15           HG1      ARG  15  11.926   4.068   0.143
  101    HD2  ARG  15           HD2      ARG  15  14.057   3.610  -0.839
  102    HD3  ARG  15           HD1      ARG  15  13.481   5.144  -1.489
  103    HE   ARG  15           HE       ARG  15  15.139   5.544   0.789
  104   HH11  ARG  15          HH11      ARG  15  15.201   4.888  -2.654
  105   HH12  ARG  15          HH12      ARG  15  16.838   5.443  -2.852
  106   HH21  ARG  15          HH21      ARG  15  17.295   6.287   0.516
  107   HH22  ARG  15          HH22      ARG  15  18.021   6.237  -1.058
  108    H    ASP  16           HN       ASP  16   9.641   7.621   0.275
  109    HA   ASP  16           HA       ASP  16  10.219  10.168   1.355
  110    HB2  ASP  16           HB2      ASP  16   9.416   9.834  -0.933
  111    HB3  ASP  16           HB1      ASP  16   7.873   9.258  -0.324
  112    H    GLY  17           HN       GLY  17   8.224   7.669   2.489
  113    HA2  GLY  17           HA2      GLY  17   7.307   7.791   4.698
  114    HA3  GLY  17           HA1      GLY  17   7.071   9.517   4.467
  115    H    GLY  18           HN       GLY  18   6.178   7.653   1.779
  116    HA2  GLY  18           HA2      GLY  18   3.465   8.373   1.885
  117    HA3  GLY  18           HA1      GLY  18   4.149   7.143   0.841
  118    H    GLU  19           HN       GLU  19   1.605   7.199   2.260
  119    HA   GLU  19           HA       GLU  19   1.931   5.187   4.351
  120    HB2  GLU  19           HB2      GLU  19  -0.456   6.830   3.502
  121    HB3  GLU  19           HB1      GLU  19  -0.484   5.649   4.804
  122    HG2  GLU  19           HG2      GLU  19   1.332   6.998   5.916
  123    HG3  GLU  19           HG1      GLU  19   1.062   8.229   4.683
  124    H    LEU  20           HN       LEU  20   0.269   3.452   4.424
  125    HA   LEU  20           HA       LEU  20  -0.112   2.308   1.741
  126    HB2  LEU  20           HB2      LEU  20   0.440   1.096   4.423
  127    HB3  LEU  20           HB1      LEU  20  -0.351   0.150   3.179
  128    HG   LEU  20           HG       LEU  20   2.300   1.500   2.720
  129   HD11  LEU  20          HD11      LEU  20   3.288  -0.744   3.157
  130   HD12  LEU  20          HD12      LEU  20   1.730  -1.249   3.813
  131   HD13  LEU  20          HD13      LEU  20   2.636   0.045   4.592
  132   HD21  LEU  20          HD21      LEU  20   1.179   0.862   0.696
  133   HD22  LEU  20          HD22      LEU  20   0.796  -0.727   1.351
  134   HD23  LEU  20          HD23      LEU  20   2.469  -0.303   0.995
  135    H    PHE  21           HN       PHE  21  -2.115   1.795   1.078
  136    HA   PHE  21           HA       PHE  21  -4.313   2.258   2.986
  137    HB2  PHE  21           HB2      PHE  21  -4.486   2.279  -0.041
  138    HB3  PHE  21           HB1      PHE  21  -5.662   2.928   1.107
  139    HD1  PHE  21           HD1      PHE  21  -4.755   4.816   2.677
  140    HD2  PHE  21           HD2      PHE  21  -2.964   3.716  -1.026
  141    HE1  PHE  21           HE1      PHE  21  -3.714   7.037   2.521
  142    HE2  PHE  21           HE2      PHE  21  -1.919   5.930  -1.181
  143    HZ   PHE  21           HZ       PHE  21  -2.129   7.520   0.669
  144    H    CYS  22           HN       CYS  22  -2.969  -0.181   3.005
  145    HA   CYS  22           HA       CYS  22  -5.081  -2.011   2.135
  146    HB2  CYS  22           HB2      CYS  22  -2.180  -2.100   1.361
  147    HB3  CYS  22           HB1      CYS  22  -3.148  -3.568   1.385
  148    H    CYS  23           HN       CYS  23  -4.821  -4.220   3.090
  149    HA   CYS  23           HA       CYS  23  -4.173  -4.172   5.876
  150    HB2  CYS  23           HB2      CYS  23  -4.557  -6.659   4.191
  151    HB3  CYS  23           HB1      CYS  23  -4.857  -6.469   5.917
  152    H    ASP  24           HN       ASP  24  -2.602  -5.825   6.846
  153    HA   ASP  24           HA       ASP  24   0.001  -5.501   6.041
  154    HB2  ASP  24           HB2      ASP  24  -1.261  -7.816   7.511
  155    HB3  ASP  24           HB1      ASP  24   0.473  -7.697   7.246
  156    H    THR  25           HN       THR  25  -2.007  -8.350   5.325
  157    HA   THR  25           HA       THR  25  -0.155  -9.606   3.643
  158    HB   THR  25           HB       THR  25  -3.166  -9.845   3.574
  159    HG1  THR  25           HG1      THR  25  -1.224 -10.733   5.344
  160   HG21  THR  25          HG21      THR  25  -2.076 -10.846   1.619
  161   HG22  THR  25          HG22      THR  25  -2.750 -12.086   2.677
  162   HG23  THR  25          HG23      THR  25  -1.015 -11.768   2.682
  163    H    CYS  26           HN       CYS  26  -2.915  -7.505   2.860
  164    HA   CYS  26           HA       CYS  26  -2.705  -7.721   0.074
  165    HB2  CYS  26           HB2      CYS  26  -3.835  -5.432   1.696
  166    HB3  CYS  26           HB1      CYS  26  -4.172  -5.754  -0.002
  167    H    SER  27           HN       SER  27  -1.311  -5.396   2.336
  168    HA   SER  27           HA       SER  27  -0.176  -3.664   0.419
  169    HB2  SER  27           HB2      SER  27   0.577  -4.209   3.291
  170    HB3  SER  27           HB1      SER  27   1.282  -2.921   2.321
  171    HG   SER  27           HG       SER  27  -0.518  -2.274   3.650
  172    H    ARG  28           HN       ARG  28   0.921  -6.687   1.746
  173    HA   ARG  28           HA       ARG  28   3.616  -6.246   0.795
  174    HB2  ARG  28           HB2      ARG  28   2.321  -8.532   2.268
  175    HB3  ARG  28           HB1      ARG  28   4.002  -8.560   1.735
  176    HG2  ARG  28           HG2      ARG  28   4.543  -6.679   3.103
  177    HG3  ARG  28           HG1      ARG  28   2.848  -6.407   3.495
  178    HD2  ARG  28           HD2      ARG  28   2.821  -8.609   4.641
  179    HD3  ARG  28           HD1      ARG  28   4.556  -8.739   4.345
  180    HE   ARG  28           HE       ARG  28   4.439  -6.390   5.579
  181   HH11  ARG  28          HH11      ARG  28   2.925  -9.437   6.384
  182   HH12  ARG  28          HH12      ARG  28   2.823  -9.089   8.079
  183   HH21  ARG  28          HH21      ARG  28   4.324  -5.924   7.813
  184   HH22  ARG  28          HH22      ARG  28   3.625  -7.087   8.892
  185    H    VAL  29           HN       VAL  29   0.712  -7.668  -0.364
  186    HA   VAL  29           HA       VAL  29   2.116  -9.105  -2.464
  187    HB   VAL  29           HB       VAL  29  -0.856  -8.763  -2.026
  188   HG11  VAL  29          HG11      VAL  29   0.656 -10.611  -3.871
  189   HG12  VAL  29          HG12      VAL  29  -0.326  -9.229  -4.358
  190   HG13  VAL  29          HG13      VAL  29  -1.086 -10.629  -3.601
  191   HG21  VAL  29          HG21      VAL  29   0.972 -11.070  -1.372
  192   HG22  VAL  29          HG22      VAL  29  -0.786 -11.082  -1.223
  193   HG23  VAL  29          HG23      VAL  29   0.179 -10.006  -0.212
  194    H    PHE  30           HN       PHE  30  -0.082  -6.309  -2.150
  195    HA   PHE  30           HA       PHE  30   0.593  -5.588  -4.936
  196    HB2  PHE  30           HB2      PHE  30  -1.821  -4.640  -3.369
  197    HB3  PHE  30           HB1      PHE  30  -1.514  -4.416  -5.087
  198    HD1  PHE  30           HD1      PHE  30  -1.224  -6.702  -6.434
  199    HD2  PHE  30           HD2      PHE  30  -3.284  -6.271  -2.733
  200    HE1  PHE  30           HE1      PHE  30  -2.511  -8.739  -6.915
  201    HE2  PHE  30           HE2      PHE  30  -4.566  -8.314  -3.204
  202    HZ   PHE  30           HZ       PHE  30  -4.183  -9.552  -5.301
  203    H    HIS  31           HN       HIS  31   2.456  -4.888  -3.111
  204    HA   HIS  31           HA       HIS  31   2.064  -2.708  -1.467
  205    HB2  HIS  31           HB2      HIS  31   4.066  -4.201  -1.548
  206    HB3  HIS  31           HB1      HIS  31   4.605  -3.325  -2.975
  207    HD1  HIS  31           HD1      HIS  31   3.677  -2.466   0.635
  208    HD2  HIS  31           HD2      HIS  31   6.323  -1.352  -2.369
  209    HE1  HIS  31           HE1      HIS  31   5.263  -0.779   1.671
  210    H    GLU  32           HN       GLU  32   3.160  -2.659  -4.843
  211    HA   GLU  32           HA       GLU  32   3.678   0.138  -4.856
  212    HB2  GLU  32           HB2      GLU  32   3.289  -1.822  -7.119
  213    HB3  GLU  32           HB1      GLU  32   3.846  -0.167  -7.323
  214    HG2  GLU  32           HG2      GLU  32   5.864  -0.601  -6.183
  215    HG3  GLU  32           HG1      GLU  32   5.281  -2.153  -5.589
  216    H    ASP  33           HN       ASP  33   0.947  -1.856  -5.710
  217    HA   ASP  33           HA       ASP  33  -0.538   0.308  -6.892
  218    HB2  ASP  33           HB2      ASP  33  -1.390  -2.474  -6.050
  219    HB3  ASP  33           HB1      ASP  33  -2.440  -1.324  -6.871
  220    H    CYS  34           HN       CYS  34  -0.082  -1.026  -3.748
  221    HA   CYS  34           HA       CYS  34  -2.484   0.096  -2.621
  222    HB2  CYS  34           HB2      CYS  34  -0.101  -1.350  -1.484
  223    HB3  CYS  34           HB1      CYS  34  -1.310  -0.613  -0.432
  224    H    HIS  35           HN       HIS  35   0.303   1.515  -3.621
  225    HA   HIS  35           HA       HIS  35   0.190   3.596  -1.557
  226    HB2  HIS  35           HB2      HIS  35   2.188   2.998  -3.737
  227    HB3  HIS  35           HB1      HIS  35   2.184   4.536  -2.873
  228    HD1  HIS  35           HD1      HIS  35   2.587   4.346  -0.200
  229    HD2  HIS  35           HD2      HIS  35   3.292   0.901  -2.411
  230    HE1  HIS  35           HE1      HIS  35   3.872   2.782   1.313
  231    H    ILE  36           HN       ILE  36  -1.476   2.871  -4.184
  232    HA   ILE  36           HA       ILE  36  -1.819   5.680  -5.013
  233    HB   ILE  36           HB       ILE  36  -2.350   3.233  -6.715
  234   HG12  ILE  36          HG12      ILE  36  -0.014   5.154  -6.838
  235   HG13  ILE  36          HG11      ILE  36   0.063   3.491  -6.269
  236   HG21  ILE  36          HG21      ILE  36  -2.551   4.820  -8.554
  237   HG22  ILE  36          HG22      ILE  36  -2.238   6.156  -7.449
  238   HG23  ILE  36          HG23      ILE  36  -3.705   5.195  -7.274
  239   HD11  ILE  36          HD11      ILE  36   0.912   3.659  -8.522
  240   HD12  ILE  36          HD12      ILE  36  -0.599   4.391  -9.062
  241   HD13  ILE  36          HD13      ILE  36  -0.580   2.718  -8.506
  242    HA   PRO  37           HA       PRO  37  -3.326   7.000  -5.890
  243    HB2  PRO  37           HB2      PRO  37  -5.229   8.469  -4.220
  244    HB3  PRO  37           HB1      PRO  37  -5.144   8.375  -5.986
  245    HG2  PRO  37           HG2      PRO  37  -7.145   7.234  -4.561
  246    HG3  PRO  37           HG1      PRO  37  -6.542   6.548  -6.085
  247    HD2  PRO  37           HD2      PRO  37  -5.915   5.737  -3.260
  248    HD3  PRO  37           HD1      PRO  37  -6.270   4.711  -4.671
  249    HA   PRO  38           HA       PRO  38  -0.399   7.936  -2.753
  250    HB2  PRO  38           HB2      PRO  38   0.302  10.466  -3.626
  251    HB3  PRO  38           HB1      PRO  38   0.966   8.954  -4.253
  252    HG2  PRO  38           HG2      PRO  38  -1.201  10.687  -5.359
  253    HG3  PRO  38           HG1      PRO  38   0.071   9.796  -6.219
  254    HD2  PRO  38           HD2      PRO  38  -2.469   8.899  -6.127
  255    HD3  PRO  38           HD1      PRO  38  -1.085   7.780  -6.098
  256    H    VAL  39           HN       VAL  39   0.041   9.342  -1.002
  257    HA   VAL  39           HA       VAL  39  -2.215  10.210   0.403
  258    HB   VAL  39           HB       VAL  39   0.687  10.911   0.848
  259   HG11  VAL  39          HG11      VAL  39  -0.750  12.523   1.968
  260   HG12  VAL  39          HG12      VAL  39   0.037  11.466   3.140
  261   HG13  VAL  39          HG13      VAL  39  -1.656  11.209   2.718
  262   HG21  VAL  39          HG21      VAL  39   0.623   9.157   2.544
  263   HG22  VAL  39          HG22      VAL  39   0.235   8.515   0.950
  264   HG23  VAL  39          HG23      VAL  39  -1.051   8.804   2.122
  265    H    GLU  40           HN       GLU  40  -3.386  11.980   0.230
  266    HA   GLU  40           HA       GLU  40  -2.264  14.526  -0.505
  267    HB2  GLU  40           HB2      GLU  40  -2.621  13.411  -2.705
  268    HB3  GLU  40           HB1      GLU  40  -4.321  13.227  -2.305
  269    HG2  GLU  40           HG2      GLU  40  -3.988  15.113  -3.781
  270    HG3  GLU  40           HG1      GLU  40  -4.561  15.651  -2.203
  271    H    ALA  41           HN       ALA  41  -5.478  13.050  -0.789
  272    HA   ALA  41           HA       ALA  41  -6.408  14.249   1.650
  273    HB1  ALA  41           HB1      ALA  41  -7.488  15.204  -1.001
  274    HB2  ALA  41           HB2      ALA  41  -6.595  16.167   0.174
  275    HB3  ALA  41           HB3      ALA  41  -8.200  15.559   0.572
  276    H    GLU  42           HN       GLU  42  -8.324  13.290   2.366
  277    HA   GLU  42           HA       GLU  42  -9.981  11.753   2.541
  278    HB2  GLU  42           HB2      GLU  42  -9.959  12.013  -0.460
  279    HB3  GLU  42           HB1      GLU  42 -11.175  11.114   0.435
  280    HG2  GLU  42           HG2      GLU  42 -10.592  14.028   0.873
  281    HG3  GLU  42           HG1      GLU  42 -11.837  13.428  -0.224
  282    H    ARG  43           HN       ARG  43  -7.093  10.920   2.041
  283    HA   ARG  43           HA       ARG  43  -7.439   8.254   0.931
  284    HB2  ARG  43           HB2      ARG  43  -4.978   9.441   2.219
  285    HB3  ARG  43           HB1      ARG  43  -5.054   8.000   1.221
  286    HG2  ARG  43           HG2      ARG  43  -5.531  10.830   0.309
  287    HG3  ARG  43           HG1      ARG  43  -4.105   9.846  -0.005
  288    HD2  ARG  43           HD2      ARG  43  -5.574   8.227  -1.209
  289    HD3  ARG  43           HD1      ARG  43  -6.900   9.375  -1.018
  290    HE   ARG  43           HE       ARG  43  -4.401  10.090  -2.419
  291   HH11  ARG  43          HH11      ARG  43  -7.912   9.904  -2.332
  292   HH12  ARG  43          HH12      ARG  43  -8.115  10.785  -3.812
  293   HH21  ARG  43          HH21      ARG  43  -4.679  11.255  -4.359
  294   HH22  ARG  43          HH22      ARG  43  -6.280  11.555  -4.960
  295    H    THR  44           HN       THR  44  -7.341   6.364   2.121
  296    HA   THR  44           HA       THR  44  -7.539   6.730   5.037
  297    HB   THR  44           HB       THR  44  -9.069   4.742   5.006
  298    HG1  THR  44           HG1      THR  44  -8.435   3.950   2.921
  299   HG21  THR  44          HG21      THR  44  -9.955   7.135   3.386
  300   HG22  THR  44          HG22      THR  44  -9.971   7.011   5.144
  301   HG23  THR  44          HG23      THR  44 -11.027   5.979   4.179
  302    HA   PRO  45           HA       PRO  45  -3.966   3.887   4.444
  303    HB2  PRO  45           HB2      PRO  45  -3.162   4.939   7.063
  304    HB3  PRO  45           HB1      PRO  45  -2.282   4.957   5.531
  305    HG2  PRO  45           HG2      PRO  45  -3.304   7.203   6.611
  306    HG3  PRO  45           HG1      PRO  45  -3.219   6.951   4.858
  307    HD2  PRO  45           HD2      PRO  45  -5.566   6.657   6.705
  308    HD3  PRO  45           HD1      PRO  45  -5.495   7.387   5.083
  309    H    TRP  46           HN       TRP  46  -6.255   4.323   6.990
  310    HA   TRP  46           HA       TRP  46  -5.556   1.772   8.233
  311    HB2  TRP  46           HB2      TRP  46  -7.354   2.419   9.888
  312    HB3  TRP  46           HB1      TRP  46  -5.987   3.529   9.818
  313    HD1  TRP  46           HD1      TRP  46  -9.707   3.294   8.893
  314    HE1  TRP  46           HE1      TRP  46 -10.606   5.668   8.487
  315    HE3  TRP  46           HE3      TRP  46  -5.305   5.887   9.155
  316    HZ2  TRP  46           HZ2      TRP  46  -9.586   8.287   8.305
  317    HZ3  TRP  46           HZ3      TRP  46  -5.358   8.329   8.853
  318    HH2  TRP  46           HH2      TRP  46  -7.452   9.500   8.436
  319    H    ASN  47           HN       ASN  47  -6.903   2.242   5.525
  320    HA   ASN  47           HA       ASN  47  -8.982   0.238   5.903
  321    HB2  ASN  47           HB2      ASN  47 -10.137   2.452   5.966
  322    HB3  ASN  47           HB1      ASN  47  -9.478   2.807   4.374
  323   HD21  ASN  47          HD21      ASN  47 -11.735   0.805   6.151
  324   HD22  ASN  47          HD22      ASN  47 -12.649   0.290   4.773
  325    H    CYS  48           HN       CYS  48  -9.204  -1.119   4.147
  326    HA   CYS  48           HA       CYS  48  -7.027  -0.912   2.205
  327    HB2  CYS  48           HB2      CYS  48  -7.292  -2.934   3.639
  328    HB3  CYS  48           HB1      CYS  48  -8.846  -3.229   2.881
  329    H    ILE  49           HN       ILE  49  -7.432  -0.279   0.206
  330    HA   ILE  49           HA       ILE  49 -10.107   0.131  -0.713
  331    HB   ILE  49           HB       ILE  49  -8.915   0.744  -2.908
  332   HG12  ILE  49          HG12      ILE  49  -6.519   0.674  -1.071
  333   HG13  ILE  49          HG11      ILE  49  -6.807  -0.463  -2.383
  334   HG21  ILE  49          HG21      ILE  49  -9.801   2.406  -1.397
  335   HG22  ILE  49          HG22      ILE  49  -8.224   2.931  -1.987
  336   HG23  ILE  49          HG23      ILE  49  -8.380   2.268  -0.362
  337   HD11  ILE  49          HD11      ILE  49  -6.688   1.387  -3.985
  338   HD12  ILE  49          HD12      ILE  49  -5.210   1.235  -3.034
  339   HD13  ILE  49          HD13      ILE  49  -6.375   2.503  -2.655
  340    H    PHE  50           HN       PHE  50  -7.824  -2.454  -1.063
  341    HA   PHE  50           HA       PHE  50  -9.022  -3.470  -3.500
  342    HB2  PHE  50           HB2      PHE  50  -6.837  -4.506  -1.690
  343    HB3  PHE  50           HB1      PHE  50  -7.505  -5.489  -2.995
  344    HD1  PHE  50           HD2      PHE  50  -5.630  -2.421  -2.209
  345    HD2  PHE  50           HD1      PHE  50  -6.973  -5.058  -5.264
  346    HE1  PHE  50           HE2      PHE  50  -4.128  -1.321  -3.813
  347    HE2  PHE  50           HE1      PHE  50  -5.474  -3.963  -6.875
  348    HZ   PHE  50           HZ       PHE  50  -4.052  -2.090  -6.151
  349    H    CYS  51           HN       CYS  51  -8.920  -4.332  -0.072
  350    HA   CYS  51           HA       CYS  51 -10.826  -6.408  -0.197
  351    HB2  CYS  51           HB2      CYS  51  -9.902  -4.627   2.047
  352    HB3  CYS  51           HB1      CYS  51 -11.211  -5.778   2.284
  353    H    ARG  52           HN       ARG  52 -11.174  -3.108  -0.738
  354    HA   ARG  52           HA       ARG  52 -13.943  -3.024   0.217
  355    HB2  ARG  52           HB2      ARG  52 -12.483  -1.082   0.802
  356    HB3  ARG  52           HB1      ARG  52 -12.254  -0.772  -0.914
  357    HG2  ARG  52           HG2      ARG  52 -14.830  -0.622  -0.998
  358    HG3  ARG  52           HG1      ARG  52 -14.713  -0.425   0.751
  359    HD2  ARG  52           HD2      ARG  52 -13.344   1.297  -1.310
  360    HD3  ARG  52           HD1      ARG  52 -14.803   1.724  -0.424
  361    HE   ARG  52           HE       ARG  52 -12.547   1.090   1.253
  362   HH11  ARG  52          HH11      ARG  52 -14.278   3.598  -0.465
  363   HH12  ARG  52          HH12      ARG  52 -13.572   4.892   0.448
  364   HH21  ARG  52          HH21      ARG  52 -11.618   2.781   2.463
  365   HH22  ARG  52          HH22      ARG  52 -12.069   4.427   2.131
  366    H    MET  53           HN       MET  53 -11.982  -3.542  -2.441
  367    HA   MET  53           HA       MET  53 -12.206  -3.705  -4.691
  368    HB2  MET  53           HB2      MET  53 -15.031  -4.362  -3.861
  369    HB3  MET  53           HB1      MET  53 -14.409  -4.586  -5.492
  370    HG2  MET  53           HG2      MET  53 -12.741  -6.146  -4.653
  371    HG3  MET  53           HG1      MET  53 -13.336  -5.909  -3.011
  372    HE1  MET  53           HE1      MET  53 -12.991  -8.756  -4.438
  373    HE2  MET  53           HE2      MET  53 -14.464  -9.561  -3.902
  374    HE3  MET  53           HE3      MET  53 -13.550  -8.554  -2.779
  375    H    LYS  54           HN       LYS  54 -12.683  -1.091  -3.445
  376    HA   LYS  54           HA       LYS  54 -13.786   0.189  -5.825
  377    HB2  LYS  54           HB2      LYS  54 -15.592   0.064  -4.090
  378    HB3  LYS  54           HB1      LYS  54 -14.566   1.010  -3.022
  379    HG2  LYS  54           HG2      LYS  54 -16.163   2.473  -4.025
  380    HG3  LYS  54           HG1      LYS  54 -14.581   2.833  -4.718
  381    HD2  LYS  54           HD2      LYS  54 -15.130   1.543  -6.698
  382    HD3  LYS  54           HD1      LYS  54 -16.682   1.087  -5.995
  383    HE2  LYS  54           HE2      LYS  54 -17.041   2.870  -7.561
  384    HE3  LYS  54           HE1      LYS  54 -17.303   3.484  -5.931
  385    HZ1  LYS  54           HZ1      LYS  54 -16.028   5.018  -7.310
  386    HZ2  LYS  54           HZ2      LYS  54 -14.822   3.856  -7.520
  387    HZ3  LYS  54           HZ3      LYS  54 -15.117   4.499  -5.979
  388    H    GLU  55           HN       GLU  55 -11.959   1.150  -6.517
  389    HA   GLU  55           HA       GLU  55 -10.026   2.261  -4.703
  390    HB2  GLU  55           HB2      GLU  55  -9.411   1.242  -6.885
  391    HB3  GLU  55           HB1      GLU  55 -10.219   2.572  -7.701
  392    HG2  GLU  55           HG2      GLU  55  -8.644   4.108  -6.451
  393    HG3  GLU  55           HG1      GLU  55  -7.737   2.658  -6.018
  394    H    SER  56           HN       SER  56 -11.318   3.756  -3.576
  395    HA   SER  56           HA       SER  56 -12.401   5.690  -3.110
  396    HB2  SER  56           HB2      SER  56 -11.260   7.737  -4.088
  397    HB3  SER  56           HB1      SER  56 -10.211   6.611  -3.233
  398    HG   SER  56           HG       SER  56 -10.420   6.011  -5.879
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1  15.951 -13.283   1.502
    2    H2   GLY   1           HT2      GLY   1  17.135 -13.623   2.658
    3    H3   GLY   1           HT3      GLY   1  17.093 -12.108   1.914
    4    HA2  GLY   1           HA1      GLY   1  16.206 -11.981   4.150
    5    HA3  GLY   1           HA2      GLY   1  14.986 -11.601   2.943
    6    H    ALA   2           HN       ALA   2  15.467 -13.209   5.735
    7    HA   ALA   2           HA       ALA   2  13.162 -14.937   5.257
    8    HB1  ALA   2           HB1      ALA   2  15.074 -16.397   4.850
    9    HB2  ALA   2           HB2      ALA   2  14.236 -16.864   6.329
   10    HB3  ALA   2           HB3      ALA   2  15.750 -15.967   6.421
   11    H    MET   3           HN       MET   3  13.137 -12.560   6.588
   12    HA   MET   3           HA       MET   3  12.432 -13.450   9.270
   13    HB2  MET   3           HB2      MET   3  14.825 -12.579   9.304
   14    HB3  MET   3           HB1      MET   3  14.168 -11.000   8.895
   15    HG2  MET   3           HG2      MET   3  12.870 -10.990  10.955
   16    HG3  MET   3           HG1      MET   3  13.478 -12.594  11.359
   17    HE1  MET   3           HE1      MET   3  16.560 -12.356  10.435
   18    HE2  MET   3           HE2      MET   3  15.991 -13.124  11.916
   19    HE3  MET   3           HE3      MET   3  17.275 -11.916  11.986
   20    H    GLY   4           HN       GLY   4  11.003 -12.707   6.899
   21    HA2  GLY   4           HA2      GLY   4   8.791 -11.578   7.325
   22    HA3  GLY   4           HA1      GLY   4   9.755 -10.170   7.746
   23    H    MET   5           HN       MET   5   7.879  -9.890   5.823
   24    HA   MET   5           HA       MET   5   9.324 -10.027   3.276
   25    HB2  MET   5           HB2      MET   5   7.079 -10.941   3.190
   26    HB3  MET   5           HB1      MET   5   6.412  -9.471   3.885
   27    HG2  MET   5           HG2      MET   5   6.013  -9.625   1.476
   28    HG3  MET   5           HG1      MET   5   6.987  -8.220   1.900
   29    HE1  MET   5           HE1      MET   5   6.971 -11.811   0.317
   30    HE2  MET   5           HE2      MET   5   8.121 -11.992   1.641
   31    HE3  MET   5           HE3      MET   5   8.683 -12.062  -0.027
   32    H    ARG   6           HN       ARG   6  10.747  -8.340   3.472
   33    HA   ARG   6           HA       ARG   6   9.543  -5.662   3.718
   34    HB2  ARG   6           HB2      ARG   6  12.343  -6.573   4.402
   35    HB3  ARG   6           HB1      ARG   6  11.824  -4.895   4.396
   36    HG2  ARG   6           HG2      ARG   6  10.174  -5.433   6.153
   37    HG3  ARG   6           HG1      ARG   6  10.796  -7.086   6.189
   38    HD2  ARG   6           HD2      ARG   6  12.986  -6.280   6.836
   39    HD3  ARG   6           HD1      ARG   6  12.441  -4.612   6.703
   40    HE   ARG   6           HE       ARG   6  10.854  -6.094   8.549
   41   HH11  ARG   6          HH11      ARG   6  13.930  -4.475   8.167
   42   HH12  ARG   6          HH12      ARG   6  14.089  -4.092   9.849
   43   HH21  ARG   6          HH21      ARG   6  11.067  -5.598  10.784
   44   HH22  ARG   6          HH22      ARG   6  12.471  -4.748  11.341
   45    H    ASN   7           HN       ASN   7   9.218  -5.010   1.652
   46    HA   ASN   7           HA       ASN   7  11.642  -4.726   0.041
   47    HB2  ASN   7           HB2      ASN   7  10.200  -6.676  -0.783
   48    HB3  ASN   7           HB1      ASN   7   9.025  -5.453  -1.262
   49   HD21  ASN   7          HD21      ASN   7  10.514  -7.293  -2.969
   50   HD22  ASN   7          HD22      ASN   7  11.432  -6.312  -4.060
   51    H    LEU   8           HN       LEU   8  10.885  -2.751   1.542
   52    HA   LEU   8           HA       LEU   8   9.327  -0.938  -0.128
   53    HB2  LEU   8           HB2      LEU   8   9.582   0.667   1.779
   54    HB3  LEU   8           HB1      LEU   8   8.680  -0.787   2.150
   55    HG   LEU   8           HG       LEU   8  10.964  -1.644   3.090
   56   HD11  LEU   8          HD11      LEU   8  12.367   0.106   4.026
   57   HD12  LEU   8          HD12      LEU   8  11.369   1.339   3.258
   58   HD13  LEU   8          HD13      LEU   8  12.314   0.229   2.267
   59   HD21  LEU   8          HD21      LEU   8  10.393  -0.706   5.275
   60   HD22  LEU   8          HD22      LEU   8   8.961  -1.271   4.414
   61   HD23  LEU   8          HD23      LEU   8   9.319   0.455   4.495
   62    H    ASP   9           HN       ASP   9  12.250  -2.072  -0.173
   63    HA   ASP   9           HA       ASP   9  13.896   0.256  -0.250
   64    HB2  ASP   9           HB2      ASP   9  14.351  -2.546  -1.286
   65    HB3  ASP   9           HB1      ASP   9  15.569  -1.277  -1.330
   66    H    GLU  10           HN       GLU  10  12.101  -1.627  -2.578
   67    HA   GLU  10           HA       GLU  10  13.023   0.051  -4.777
   68    HB2  GLU  10           HB2      GLU  10  11.086  -2.271  -4.755
   69    HB3  GLU  10           HB1      GLU  10  11.649  -1.429  -6.194
   70    HG2  GLU  10           HG2      GLU  10  13.936  -2.137  -5.713
   71    HG3  GLU  10           HG1      GLU  10  13.367  -2.978  -4.271
   72    H    CYS  11           HN       CYS  11  10.992   0.491  -2.394
   73    HA   CYS  11           HA       CYS  11   8.828   1.686  -3.969
   74    HB2  CYS  11           HB2      CYS  11   8.238   0.012  -2.226
   75    HB3  CYS  11           HB1      CYS  11   8.956   1.060  -1.015
   76    H    GLU  12           HN       GLU  12   9.795   3.599  -4.547
   77    HA   GLU  12           HA       GLU  12  11.407   5.200  -2.913
   78    HB2  GLU  12           HB2      GLU  12   9.679   5.989  -5.261
   79    HB3  GLU  12           HB1      GLU  12  10.956   6.977  -4.566
   80    HG2  GLU  12           HG2      GLU  12  11.366   4.261  -5.789
   81    HG3  GLU  12           HG1      GLU  12  11.643   5.793  -6.615
   82    H    VAL  13           HN       VAL  13   7.955   5.094  -3.403
   83    HA   VAL  13           HA       VAL  13   7.366   7.542  -2.152
   84    HB   VAL  13           HB       VAL  13   5.781   6.561  -3.668
   85   HG11  VAL  13          HG11      VAL  13   6.317   4.202  -3.174
   86   HG12  VAL  13          HG12      VAL  13   4.592   4.535  -3.245
   87   HG13  VAL  13          HG13      VAL  13   5.386   4.340  -1.684
   88   HG21  VAL  13          HG21      VAL  13   3.742   6.778  -2.389
   89   HG22  VAL  13          HG22      VAL  13   4.915   7.980  -1.847
   90   HG23  VAL  13          HG23      VAL  13   4.629   6.527  -0.888
   91    H    CYS  14           HN       CYS  14   7.972   4.338  -0.901
   92    HA   CYS  14           HA       CYS  14   6.896   4.754   1.694
   93    HB2  CYS  14           HB2      CYS  14   8.561   2.752   0.396
   94    HB3  CYS  14           HB1      CYS  14   9.074   3.066   2.048
   95    H    ARG  15           HN       ARG  15  10.039   5.354   0.239
   96    HA   ARG  15           HA       ARG  15  11.261   6.173   2.684
   97    HB2  ARG  15           HB2      ARG  15  12.120   6.608  -0.175
   98    HB3  ARG  15           HB1      ARG  15  13.106   6.985   1.234
   99    HG2  ARG  15           HG2      ARG  15  12.847   4.544   1.886
  100    HG3  ARG  15           HG1      ARG  15  12.206   4.293   0.264
  101    HD2  ARG  15           HD2      ARG  15  14.892   5.523   0.839
  102    HD3  ARG  15           HD1      ARG  15  14.646   3.809   0.533
  103    HE   ARG  15           HE       ARG  15  13.550   4.896  -1.648
  104   HH11  ARG  15          HH11      ARG  15  16.576   5.573  -0.026
  105   HH12  ARG  15          HH12      ARG  15  17.428   5.946  -1.492
  106   HH21  ARG  15          HH21      ARG  15  14.669   5.356  -3.592
  107   HH22  ARG  15          HH22      ARG  15  16.340   5.844  -3.515
  108    H    ASP  16           HN       ASP  16   9.470   7.761   0.179
  109    HA   ASP  16           HA       ASP  16   9.962  10.402   1.186
  110    HB2  ASP  16           HB2      ASP  16   8.085   9.255  -0.847
  111    HB3  ASP  16           HB1      ASP  16   7.861  10.904  -0.275
  112    H    GLY  17           HN       GLY  17   8.457   7.964   2.636
  113    HA2  GLY  17           HA2      GLY  17   7.307   8.051   4.647
  114    HA3  GLY  17           HA1      GLY  17   7.096   9.779   4.414
  115    H    GLY  18           HN       GLY  18   6.175   7.553   1.924
  116    HA2  GLY  18           HA2      GLY  18   3.499   8.461   1.861
  117    HA3  GLY  18           HA1      GLY  18   4.140   7.080   0.989
  118    H    GLU  19           HN       GLU  19   1.590   7.118   2.013
  119    HA   GLU  19           HA       GLU  19   1.736   5.413   4.401
  120    HB2  GLU  19           HB2      GLU  19  -0.554   7.020   3.270
  121    HB3  GLU  19           HB1      GLU  19  -0.692   5.953   4.660
  122    HG2  GLU  19           HG2      GLU  19   1.164   7.382   5.699
  123    HG3  GLU  19           HG1      GLU  19   0.821   8.533   4.409
  124    H    LEU  20           HN       LEU  20   0.415   3.567   4.523
  125    HA   LEU  20           HA       LEU  20  -0.087   2.302   1.932
  126    HB2  LEU  20           HB2      LEU  20   0.335   1.260   4.713
  127    HB3  LEU  20           HB1      LEU  20  -0.436   0.260   3.498
  128    HG   LEU  20           HG       LEU  20   2.296   1.479   3.111
  129   HD11  LEU  20          HD11      LEU  20   2.341   0.032   5.080
  130   HD12  LEU  20          HD12      LEU  20   3.196  -0.715   3.730
  131   HD13  LEU  20          HD13      LEU  20   1.574  -1.261   4.157
  132   HD21  LEU  20          HD21      LEU  20   1.164   0.791   1.064
  133   HD22  LEU  20          HD22      LEU  20   0.838  -0.796   1.758
  134   HD23  LEU  20          HD23      LEU  20   2.496  -0.305   1.427
  135    H    PHE  21           HN       PHE  21  -2.111   1.935   1.235
  136    HA   PHE  21           HA       PHE  21  -4.299   2.455   3.136
  137    HB2  PHE  21           HB2      PHE  21  -4.381   2.569   0.106
  138    HB3  PHE  21           HB1      PHE  21  -5.665   3.065   1.209
  139    HD1  PHE  21           HD1      PHE  21  -5.116   4.986   2.851
  140    HD2  PHE  21           HD2      PHE  21  -2.806   4.121  -0.627
  141    HE1  PHE  21           HE1      PHE  21  -4.218   7.267   2.877
  142    HE2  PHE  21           HE2      PHE  21  -1.907   6.403  -0.594
  143    HZ   PHE  21           HZ       PHE  21  -2.532   7.948   1.221
  144    H    CYS  22           HN       CYS  22  -2.879  -0.001   2.951
  145    HA   CYS  22           HA       CYS  22  -5.039  -1.801   2.117
  146    HB2  CYS  22           HB2      CYS  22  -2.133  -1.923   1.379
  147    HB3  CYS  22           HB1      CYS  22  -3.069  -3.411   1.511
  148    H    CYS  23           HN       CYS  23  -5.019  -3.845   3.178
  149    HA   CYS  23           HA       CYS  23  -4.010  -3.754   5.883
  150    HB2  CYS  23           HB2      CYS  23  -5.298  -5.731   6.259
  151    HB3  CYS  23           HB1      CYS  23  -6.275  -4.733   5.181
  152    H    ASP  24           HN       ASP  24  -2.861  -5.874   6.649
  153    HA   ASP  24           HA       ASP  24  -0.313  -5.837   5.599
  154    HB2  ASP  24           HB2      ASP  24  -1.640  -8.093   7.106
  155    HB3  ASP  24           HB1      ASP  24   0.094  -7.938   6.847
  156    H    THR  25           HN       THR  25  -2.833  -8.239   4.961
  157    HA   THR  25           HA       THR  25  -1.267  -9.974   3.431
  158    HB   THR  25           HB       THR  25  -4.252  -9.553   3.241
  159    HG1  THR  25           HG1      THR  25  -2.598 -10.974   5.061
  160   HG21  THR  25          HG21      THR  25  -3.338 -10.952   1.442
  161   HG22  THR  25          HG22      THR  25  -4.302 -11.908   2.567
  162   HG23  THR  25          HG23      THR  25  -2.542 -11.970   2.642
  163    H    CYS  26           HN       CYS  26  -3.445  -7.353   2.362
  164    HA   CYS  26           HA       CYS  26  -2.913  -7.833  -0.400
  165    HB2  CYS  26           HB2      CYS  26  -4.074  -5.373   0.913
  166    HB3  CYS  26           HB1      CYS  26  -4.107  -5.721  -0.807
  167    H    SER  27           HN       SER  27  -1.512  -5.723   2.046
  168    HA   SER  27           HA       SER  27  -0.109  -4.015   0.286
  169    HB2  SER  27           HB2      SER  27  -0.528  -3.414   2.622
  170    HB3  SER  27           HB1      SER  27   0.473  -4.758   3.164
  171    HG   SER  27           HG       SER  27   1.986  -3.297   3.131
  172    H    ARG  28           HN       ARG  28   0.658  -7.122   1.736
  173    HA   ARG  28           HA       ARG  28   3.403  -7.047   0.947
  174    HB2  ARG  28           HB2      ARG  28   1.647  -9.289   1.948
  175    HB3  ARG  28           HB1      ARG  28   3.367  -9.472   1.619
  176    HG2  ARG  28           HG2      ARG  28   3.924  -7.869   3.312
  177    HG3  ARG  28           HG1      ARG  28   2.226  -7.472   3.559
  178    HD2  ARG  28           HD2      ARG  28   1.863  -9.842   4.269
  179    HD3  ARG  28           HD1      ARG  28   3.612 -10.069   4.200
  180    HE   ARG  28           HE       ARG  28   2.902  -7.822   5.798
  181   HH11  ARG  28          HH11      ARG  28   3.064 -11.321   5.850
  182   HH12  ARG  28          HH12      ARG  28   3.256 -11.411   7.572
  183   HH21  ARG  28          HH21      ARG  28   3.143  -7.935   8.057
  184   HH22  ARG  28          HH22      ARG  28   3.304  -9.483   8.828
  185    H    VAL  29           HN       VAL  29   0.481  -7.837  -0.646
  186    HA   VAL  29           HA       VAL  29   1.874  -9.357  -2.714
  187    HB   VAL  29           HB       VAL  29  -1.072  -8.730  -2.486
  188   HG11  VAL  29          HG11      VAL  29  -0.370  -9.145  -4.791
  189   HG12  VAL  29          HG12      VAL  29  -1.360 -10.472  -4.182
  190   HG13  VAL  29          HG13      VAL  29   0.391 -10.655  -4.291
  191   HG21  VAL  29          HG21      VAL  29   0.457 -11.232  -1.798
  192   HG22  VAL  29          HG22      VAL  29  -1.301 -11.090  -1.827
  193   HG23  VAL  29          HG23      VAL  29  -0.360 -10.154  -0.665
  194    H    PHE  30           HN       PHE  30   0.119  -6.307  -2.284
  195    HA   PHE  30           HA       PHE  30   1.070  -5.478  -4.953
  196    HB2  PHE  30           HB2      PHE  30  -1.513  -4.584  -3.645
  197    HB3  PHE  30           HB1      PHE  30  -0.949  -4.158  -5.256
  198    HD1  PHE  30           HD1      PHE  30  -0.602  -6.187  -6.894
  199    HD2  PHE  30           HD2      PHE  30  -3.020  -6.287  -3.388
  200    HE1  PHE  30           HE1      PHE  30  -1.866  -8.079  -7.818
  201    HE2  PHE  30           HE2      PHE  30  -4.280  -8.187  -4.306
  202    HZ   PHE  30           HZ       PHE  30  -3.704  -9.085  -6.526
  203    H    HIS  31           HN       HIS  31   2.750  -4.974  -2.969
  204    HA   HIS  31           HA       HIS  31   2.261  -2.908  -1.196
  205    HB2  HIS  31           HB2      HIS  31   4.235  -4.397  -1.126
  206    HB3  HIS  31           HB1      HIS  31   4.903  -3.552  -2.519
  207    HD1  HIS  31           HD1      HIS  31   3.729  -2.593   1.004
  208    HD2  HIS  31           HD2      HIS  31   6.633  -1.630  -1.810
  209    HE1  HIS  31           HE1      HIS  31   5.251  -0.888   2.100
  210    H    GLU  32           HN       GLU  32   3.570  -2.676  -4.485
  211    HA   GLU  32           HA       GLU  32   4.198   0.090  -4.300
  212    HB2  GLU  32           HB2      GLU  32   3.736  -1.630  -6.742
  213    HB3  GLU  32           HB1      GLU  32   4.459  -0.029  -6.752
  214    HG2  GLU  32           HG2      GLU  32   6.337  -0.833  -5.459
  215    HG3  GLU  32           HG1      GLU  32   5.603  -2.431  -5.343
  216    H    ASP  33           HN       ASP  33   1.419  -1.701  -5.463
  217    HA   ASP  33           HA       ASP  33   0.090   0.631  -6.500
  218    HB2  ASP  33           HB2      ASP  33  -0.757  -2.236  -6.135
  219    HB3  ASP  33           HB1      ASP  33  -1.883  -1.000  -6.683
  220    H    CYS  34           HN       CYS  34   0.214  -1.040  -3.482
  221    HA   CYS  34           HA       CYS  34  -2.263  -0.013  -2.470
  222    HB2  CYS  34           HB2      CYS  34   0.031  -1.559  -1.318
  223    HB3  CYS  34           HB1      CYS  34  -1.150  -0.816  -0.236
  224    H    HIS  35           HN       HIS  35   0.636   1.462  -3.060
  225    HA   HIS  35           HA       HIS  35   0.288   3.454  -0.947
  226    HB2  HIS  35           HB2      HIS  35   2.379   3.048  -3.078
  227    HB3  HIS  35           HB1      HIS  35   2.293   4.525  -2.116
  228    HD1  HIS  35           HD1      HIS  35   2.994   4.334   0.397
  229    HD2  HIS  35           HD2      HIS  35   3.223   0.781  -1.737
  230    HE1  HIS  35           HE1      HIS  35   4.281   2.713   1.853
  231    H    ILE  36           HN       ILE  36  -1.004   2.763  -3.868
  232    HA   ILE  36           HA       ILE  36  -1.388   5.582  -4.617
  233    HB   ILE  36           HB       ILE  36  -1.378   3.170  -6.445
  234   HG12  ILE  36          HG12      ILE  36   0.690   5.360  -6.132
  235   HG13  ILE  36          HG11      ILE  36   0.865   3.705  -5.562
  236   HG21  ILE  36          HG21      ILE  36  -1.511   6.110  -7.112
  237   HG22  ILE  36          HG22      ILE  36  -2.848   4.966  -7.220
  238   HG23  ILE  36          HG23      ILE  36  -1.444   4.784  -8.270
  239   HD11  ILE  36          HD11      ILE  36   2.075   4.046  -7.629
  240   HD12  ILE  36          HD12      ILE  36   0.594   4.565  -8.433
  241   HD13  ILE  36          HD13      ILE  36   0.756   2.903  -7.867
  242    HA   PRO  37           HA       PRO  37  -2.592   6.804  -5.579
  243    HB2  PRO  37           HB2      PRO  37  -4.978   8.270  -4.974
  244    HB3  PRO  37           HB1      PRO  37  -4.355   7.836  -6.571
  245    HG2  PRO  37           HG2      PRO  37  -6.690   6.845  -5.473
  246    HG3  PRO  37           HG1      PRO  37  -5.758   6.043  -6.753
  247    HD2  PRO  37           HD2      PRO  37  -5.771   5.512  -3.796
  248    HD3  PRO  37           HD1      PRO  37  -5.735   4.354  -5.151
  249    HA   PRO  38           HA       PRO  38  -1.440   8.132  -1.464
  250    HB2  PRO  38           HB2      PRO  38  -0.268  10.499  -2.263
  251    HB3  PRO  38           HB1      PRO  38   0.543   8.931  -2.261
  252    HG2  PRO  38           HG2      PRO  38  -0.739  10.405  -4.524
  253    HG3  PRO  38           HG1      PRO  38   0.757   9.449  -4.513
  254    HD2  PRO  38           HD2      PRO  38  -1.547   8.479  -5.532
  255    HD3  PRO  38           HD1      PRO  38  -0.387   7.431  -4.682
  256    H    VAL  39           HN       VAL  39  -2.166   9.648   0.060
  257    HA   VAL  39           HA       VAL  39  -4.760  10.604  -0.443
  258    HB   VAL  39           HB       VAL  39  -4.089   9.925   1.790
  259   HG11  VAL  39          HG11      VAL  39  -2.335  12.368   1.757
  260   HG12  VAL  39          HG12      VAL  39  -1.830  10.688   1.919
  261   HG13  VAL  39          HG13      VAL  39  -2.747  11.457   3.209
  262   HG21  VAL  39          HG21      VAL  39  -4.924  12.818   1.683
  263   HG22  VAL  39          HG22      VAL  39  -5.154  11.722   3.046
  264   HG23  VAL  39          HG23      VAL  39  -5.994  11.425   1.523
  265    H    GLU  40           HN       GLU  40  -5.379  12.307  -1.505
  266    HA   GLU  40           HA       GLU  40  -3.750  14.747  -1.381
  267    HB2  GLU  40           HB2      GLU  40  -3.502  13.605  -3.575
  268    HB3  GLU  40           HB1      GLU  40  -5.240  13.722  -3.809
  269    HG2  GLU  40           HG2      GLU  40  -5.090  16.150  -3.795
  270    HG3  GLU  40           HG1      GLU  40  -3.349  16.048  -3.534
  271    H    ALA  41           HN       ALA  41  -6.925  13.279  -1.658
  272    HA   ALA  41           HA       ALA  41  -8.097  15.835  -0.789
  273    HB1  ALA  41           HB1      ALA  41 -10.135  15.263  -2.020
  274    HB2  ALA  41           HB2      ALA  41  -9.360  13.796  -2.618
  275    HB3  ALA  41           HB3      ALA  41  -8.739  15.376  -3.091
  276    H    GLU  42           HN       GLU  42  -8.534  12.313  -0.798
  277    HA   GLU  42           HA       GLU  42  -9.128  12.213   1.968
  278    HB2  GLU  42           HB2      GLU  42 -11.469  11.306   1.673
  279    HB3  GLU  42           HB1      GLU  42 -11.282  13.037   1.427
  280    HG2  GLU  42           HG2      GLU  42 -11.218  12.646  -1.006
  281    HG3  GLU  42           HG1      GLU  42 -11.522  10.935  -0.711
  282    H    ARG  43           HN       ARG  43  -8.098  10.416   2.490
  283    HA   ARG  43           HA       ARG  43  -8.674   7.956   1.042
  284    HB2  ARG  43           HB2      ARG  43  -5.933   9.150   1.381
  285    HB3  ARG  43           HB1      ARG  43  -6.149   7.415   1.196
  286    HG2  ARG  43           HG2      ARG  43  -7.152   9.456  -0.772
  287    HG3  ARG  43           HG1      ARG  43  -5.598   8.629  -0.908
  288    HD2  ARG  43           HD2      ARG  43  -6.654   6.512  -1.152
  289    HD3  ARG  43           HD1      ARG  43  -8.219   7.167  -0.683
  290    HE   ARG  43           HE       ARG  43  -7.177   8.415  -3.034
  291   HH11  ARG  43          HH11      ARG  43  -8.848   5.577  -1.846
  292   HH12  ARG  43          HH12      ARG  43  -9.678   5.269  -3.345
  293   HH21  ARG  43          HH21      ARG  43  -8.286   8.025  -5.012
  294   HH22  ARG  43          HH22      ARG  43  -9.341   6.656  -5.142
  295    H    THR  44           HN       THR  44  -8.478   6.102   2.301
  296    HA   THR  44           HA       THR  44  -8.269   6.664   5.176
  297    HB   THR  44           HB       THR  44  -9.666   4.590   5.434
  298    HG1  THR  44           HG1      THR  44  -9.171   3.732   3.318
  299   HG21  THR  44          HG21      THR  44 -11.770   5.664   4.733
  300   HG22  THR  44          HG22      THR  44 -10.850   6.828   3.780
  301   HG23  THR  44          HG23      THR  44 -10.692   6.805   5.535
  302    HA   PRO  45           HA       PRO  45  -4.660   3.910   4.689
  303    HB2  PRO  45           HB2      PRO  45  -3.859   4.977   7.285
  304    HB3  PRO  45           HB1      PRO  45  -3.028   5.087   5.730
  305    HG2  PRO  45           HG2      PRO  45  -4.176   7.230   6.939
  306    HG3  PRO  45           HG1      PRO  45  -4.043   7.068   5.176
  307    HD2  PRO  45           HD2      PRO  45  -6.411   6.582   6.953
  308    HD3  PRO  45           HD1      PRO  45  -6.342   7.357   5.351
  309    H    TRP  46           HN       TRP  46  -6.956   4.317   7.255
  310    HA   TRP  46           HA       TRP  46  -6.151   1.822   8.545
  311    HB2  TRP  46           HB2      TRP  46  -7.950   2.445  10.217
  312    HB3  TRP  46           HB1      TRP  46  -6.602   3.572  10.112
  313    HD1  TRP  46           HD1      TRP  46 -10.327   3.269   9.204
  314    HE1  TRP  46           HE1      TRP  46 -11.268   5.631   8.821
  315    HE3  TRP  46           HE3      TRP  46  -5.967   5.938   9.476
  316    HZ2  TRP  46           HZ2      TRP  46 -10.292   8.271   8.653
  317    HZ3  TRP  46           HZ3      TRP  46  -6.064   8.382   9.190
  318    HH2  TRP  46           HH2      TRP  46  -8.178   9.519   8.785
  319    H    ASN  47           HN       ASN  47  -7.532   2.123   5.867
  320    HA   ASN  47           HA       ASN  47  -9.388  -0.067   6.313
  321    HB2  ASN  47           HB2      ASN  47 -10.821   1.973   6.327
  322    HB3  ASN  47           HB1      ASN  47 -10.190   2.401   4.742
  323   HD21  ASN  47          HD21      ASN  47 -12.146   0.063   6.498
  324   HD22  ASN  47          HD22      ASN  47 -12.992  -0.537   5.111
  325    H    CYS  48           HN       CYS  48  -9.317  -1.533   4.618
  326    HA   CYS  48           HA       CYS  48  -7.063  -1.071   2.854
  327    HB2  CYS  48           HB2      CYS  48  -7.326  -3.204   4.152
  328    HB3  CYS  48           HB1      CYS  48  -8.741  -3.575   3.173
  329    H    ILE  49           HN       ILE  49  -7.279  -0.378   0.833
  330    HA   ILE  49           HA       ILE  49  -9.899  -0.105  -0.307
  331    HB   ILE  49           HB       ILE  49  -8.701   0.907  -2.258
  332   HG12  ILE  49          HG12      ILE  49  -6.254   0.714  -0.505
  333   HG13  ILE  49          HG11      ILE  49  -6.544  -0.334  -1.890
  334   HG21  ILE  49          HG21      ILE  49  -8.032   2.949  -1.023
  335   HG22  ILE  49          HG22      ILE  49  -8.175   2.044   0.483
  336   HG23  ILE  49          HG23      ILE  49  -9.597   2.310  -0.523
  337   HD11  ILE  49          HD11      ILE  49  -6.528   1.613  -3.361
  338   HD12  ILE  49          HD12      ILE  49  -5.028   1.494  -2.438
  339   HD13  ILE  49          HD13      ILE  49  -6.262   2.664  -1.971
  340    H    PHE  50           HN       PHE  50  -7.269  -2.338  -0.654
  341    HA   PHE  50           HA       PHE  50  -8.181  -3.350  -3.193
  342    HB2  PHE  50           HB2      PHE  50  -5.913  -3.989  -1.383
  343    HB3  PHE  50           HB1      PHE  50  -6.498  -5.292  -2.420
  344    HD1  PHE  50           HD2      PHE  50  -5.270  -1.794  -2.480
  345    HD2  PHE  50           HD1      PHE  50  -5.917  -5.378  -4.675
  346    HE1  PHE  50           HE2      PHE  50  -4.033  -0.844  -4.377
  347    HE2  PHE  50           HE1      PHE  50  -4.678  -4.437  -6.581
  348    HZ   PHE  50           HZ       PHE  50  -3.736  -2.167  -6.438
  349    H    CYS  51           HN       CYS  51  -8.653  -4.148   0.184
  350    HA   CYS  51           HA       CYS  51  -9.761  -6.717  -0.216
  351    HB2  CYS  51           HB2      CYS  51  -9.758  -4.726   1.986
  352    HB3  CYS  51           HB1      CYS  51 -11.034  -5.936   2.022
  353    H    ARG  52           HN       ARG  52 -11.214  -3.475  -0.173
  354    HA   ARG  52           HA       ARG  52 -13.865  -4.413  -0.590
  355    HB2  ARG  52           HB2      ARG  52 -12.890  -1.681  -1.397
  356    HB3  ARG  52           HB1      ARG  52 -14.488  -2.150  -0.837
  357    HG2  ARG  52           HG2      ARG  52 -13.510  -2.597   1.405
  358    HG3  ARG  52           HG1      ARG  52 -11.975  -1.964   0.814
  359    HD2  ARG  52           HD2      ARG  52 -14.560  -0.520   1.282
  360    HD3  ARG  52           HD1      ARG  52 -12.955  -0.149   1.906
  361    HE   ARG  52           HE       ARG  52 -13.689   0.194  -0.932
  362   HH11  ARG  52          HH11      ARG  52 -12.063   1.340   1.967
  363   HH12  ARG  52          HH12      ARG  52 -11.594   2.847   1.240
  364   HH21  ARG  52          HH21      ARG  52 -13.059   2.163  -1.867
  365   HH22  ARG  52          HH22      ARG  52 -12.152   3.311  -0.936
  366    H    MET  53           HN       MET  53 -11.180  -4.250  -2.531
  367    HA   MET  53           HA       MET  53 -10.700  -4.334  -4.759
  368    HB2  MET  53           HB2      MET  53 -13.285  -5.888  -4.670
  369    HB3  MET  53           HB1      MET  53 -12.224  -5.840  -6.071
  370    HG2  MET  53           HG2      MET  53 -10.420  -6.813  -4.721
  371    HG3  MET  53           HG1      MET  53 -11.511  -6.886  -3.339
  372    HE1  MET  53           HE1      MET  53 -13.606  -8.447  -3.175
  373    HE2  MET  53           HE2      MET  53 -14.157  -9.509  -4.470
  374    HE3  MET  53           HE3      MET  53 -14.267  -7.760  -4.658
  375    H    LYS  54           HN       LYS  54 -12.132  -1.953  -3.964
  376    HA   LYS  54           HA       LYS  54 -13.745  -1.454  -6.369
  377    HB2  LYS  54           HB2      LYS  54 -14.907  -1.175  -4.176
  378    HB3  LYS  54           HB1      LYS  54 -13.777   0.113  -3.782
  379    HG2  LYS  54           HG2      LYS  54 -15.850   1.057  -4.568
  380    HG3  LYS  54           HG1      LYS  54 -14.574   1.376  -5.745
  381    HD2  LYS  54           HD2      LYS  54 -15.357  -0.545  -7.077
  382    HD3  LYS  54           HD1      LYS  54 -16.665  -0.792  -5.919
  383    HE2  LYS  54           HE2      LYS  54 -16.228   1.707  -7.545
  384    HE3  LYS  54           HE1      LYS  54 -17.376   0.431  -7.936
  385    HZ1  LYS  54           HZ1      LYS  54 -17.424   2.133  -5.507
  386    HZ2  LYS  54           HZ2      LYS  54 -18.505   0.876  -5.835
  387    HZ3  LYS  54           HZ3      LYS  54 -18.475   2.244  -6.827
  388    H    GLU  55           HN       GLU  55 -10.858  -0.619  -4.730
  389    HA   GLU  55           HA       GLU  55 -10.483   1.698  -6.497
  390    HB2  GLU  55           HB2      GLU  55  -8.683   0.918  -4.216
  391    HB3  GLU  55           HB1      GLU  55  -8.796   2.471  -5.024
  392    HG2  GLU  55           HG2      GLU  55 -10.925   1.268  -3.269
  393    HG3  GLU  55           HG1      GLU  55  -9.767   2.498  -2.774
  394    H    SER  56           HN       SER  56 -10.372  -1.177  -7.116
  395    HA   SER  56           HA       SER  56  -7.549  -1.457  -7.889
  396    HB2  SER  56           HB2      SER  56  -9.488  -3.729  -7.404
  397    HB3  SER  56           HB1      SER  56  -7.737  -3.824  -7.582
  398    HG   SER  56           HG       SER  56  -7.499  -3.289  -5.552
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1   7.280 -14.475  -5.578
    2    H2   GLY   1           HT2      GLY   1   7.381 -13.927  -7.172
    3    H3   GLY   1           HT3      GLY   1   7.644 -15.559  -6.823
    4    HA2  GLY   1           HA1      GLY   1   5.455 -15.213  -7.795
    5    HA3  GLY   1           HA2      GLY   1   5.365 -15.846  -6.158
    6    H    ALA   2           HN       ALA   2   4.840 -14.393  -4.437
    7    HA   ALA   2           HA       ALA   2   3.881 -11.744  -5.111
    8    HB1  ALA   2           HB1      ALA   2   1.605 -12.153  -4.294
    9    HB2  ALA   2           HB2      ALA   2   1.980 -13.864  -4.101
   10    HB3  ALA   2           HB3      ALA   2   1.966 -13.139  -5.709
   11    H    MET   3           HN       MET   3   5.874 -13.079  -3.343
   12    HA   MET   3           HA       MET   3   4.915 -11.980  -0.791
   13    HB2  MET   3           HB2      MET   3   6.289 -14.598  -1.289
   14    HB3  MET   3           HB1      MET   3   6.488 -13.774   0.251
   15    HG2  MET   3           HG2      MET   3   4.078 -13.813   0.604
   16    HG3  MET   3           HG1      MET   3   3.853 -14.600  -0.957
   17    HE1  MET   3           HE1      MET   3   3.039 -17.332   1.808
   18    HE2  MET   3           HE2      MET   3   2.375 -16.392   0.472
   19    HE3  MET   3           HE3      MET   3   2.808 -15.593   1.983
   20    H    GLY   4           HN       GLY   4   6.076 -10.183  -2.076
   21    HA2  GLY   4           HA2      GLY   4   8.936 -10.177  -1.961
   22    HA3  GLY   4           HA1      GLY   4   7.904  -8.781  -2.239
   23    H    MET   5           HN       MET   5   9.294 -10.860   0.225
   24    HA   MET   5           HA       MET   5   8.470  -9.310   2.448
   25    HB2  MET   5           HB2      MET   5  10.269 -10.545   3.673
   26    HB3  MET   5           HB1      MET   5   9.126 -11.578   2.828
   27    HG2  MET   5           HG2      MET   5  10.742 -11.898   1.026
   28    HG3  MET   5           HG1      MET   5  11.883 -10.846   1.859
   29    HE1  MET   5           HE1      MET   5  10.473 -14.918   3.510
   30    HE2  MET   5           HE2      MET   5   9.839 -14.165   2.048
   31    HE3  MET   5           HE3      MET   5   9.489 -13.460   3.625
   32    H    ARG   6           HN       ARG   6   9.160  -7.413   3.126
   33    HA   ARG   6           HA       ARG   6  10.290  -5.455   3.249
   34    HB2  ARG   6           HB2      ARG   6  12.612  -7.356   2.991
   35    HB3  ARG   6           HB1      ARG   6  12.813  -5.638   3.289
   36    HG2  ARG   6           HG2      ARG   6  11.262  -7.495   5.076
   37    HG3  ARG   6           HG1      ARG   6  12.953  -7.061   5.318
   38    HD2  ARG   6           HD2      ARG   6  11.764  -5.615   6.724
   39    HD3  ARG   6           HD1      ARG   6  12.157  -4.639   5.314
   40    HE   ARG   6           HE       ARG   6   9.558  -5.923   5.272
   41   HH11  ARG   6          HH11      ARG   6  11.398  -3.030   5.998
   42   HH12  ARG   6          HH12      ARG   6  10.006  -1.999   6.018
   43   HH21  ARG   6          HH21      ARG   6   7.723  -4.562   5.311
   44   HH22  ARG   6          HH22      ARG   6   7.918  -2.868   5.626
   45    H    ASN   7           HN       ASN   7   9.429  -6.406   0.604
   46    HA   ASN   7           HA       ASN   7  11.507  -5.422  -1.174
   47    HB2  ASN   7           HB2      ASN   7  10.220  -7.449  -1.810
   48    HB3  ASN   7           HB1      ASN   7   8.762  -6.465  -1.884
   49   HD21  ASN   7          HD21      ASN   7  11.941  -5.405  -2.918
   50   HD22  ASN   7          HD22      ASN   7  11.549  -5.258  -4.597
   51    H    LEU   8           HN       LEU   8  11.382  -3.322  -0.194
   52    HA   LEU   8           HA       LEU   8   9.486  -1.646  -1.644
   53    HB2  LEU   8           HB2      LEU   8   9.451  -0.206   0.532
   54    HB3  LEU   8           HB1      LEU   8   8.360  -1.564   0.354
   55    HG   LEU   8           HG       LEU   8  10.083  -2.928   1.652
   56   HD11  LEU   8          HD11      LEU   8  11.077  -0.178   2.374
   57   HD12  LEU   8          HD12      LEU   8  11.960  -1.380   1.434
   58   HD13  LEU   8          HD13      LEU   8  11.569  -1.696   3.124
   59   HD21  LEU   8          HD21      LEU   8   9.229  -2.120   3.799
   60   HD22  LEU   8          HD22      LEU   8   7.956  -2.220   2.583
   61   HD23  LEU   8          HD23      LEU   8   8.647  -0.654   3.010
   62    H    ASP   9           HN       ASP   9  12.300  -2.337  -1.916
   63    HA   ASP   9           HA       ASP   9  13.794  -0.004  -1.065
   64    HB2  ASP   9           HB2      ASP   9  14.738  -2.373  -1.237
   65    HB3  ASP   9           HB1      ASP   9  14.751  -2.128  -2.978
   66    H    GLU  10           HN       GLU  10  12.254  -1.263  -3.899
   67    HA   GLU  10           HA       GLU  10  13.121   1.011  -5.506
   68    HB2  GLU  10           HB2      GLU  10  11.983  -0.104  -7.371
   69    HB3  GLU  10           HB1      GLU  10  13.137  -1.175  -6.595
   70    HG2  GLU  10           HG2      GLU  10  10.183  -1.231  -6.043
   71    HG3  GLU  10           HG1      GLU  10  10.973  -2.229  -7.258
   72    H    CYS  11           HN       CYS  11  11.115   0.820  -3.156
   73    HA   CYS  11           HA       CYS  11   8.873   2.197  -4.455
   74    HB2  CYS  11           HB2      CYS  11   8.349   0.256  -2.983
   75    HB3  CYS  11           HB1      CYS  11   9.081   1.112  -1.635
   76    H    GLU  12           HN       GLU  12   9.772   4.203  -4.734
   77    HA   GLU  12           HA       GLU  12  11.412   5.496  -2.841
   78    HB2  GLU  12           HB2      GLU  12   9.853   6.580  -5.180
   79    HB3  GLU  12           HB1      GLU  12  10.973   7.538  -4.224
   80    HG2  GLU  12           HG2      GLU  12  11.684   5.071  -5.796
   81    HG3  GLU  12           HG1      GLU  12  11.988   6.733  -6.290
   82    H    VAL  13           HN       VAL  13   7.971   5.406  -3.326
   83    HA   VAL  13           HA       VAL  13   7.373   7.692  -1.777
   84    HB   VAL  13           HB       VAL  13   5.806   6.820  -3.426
   85   HG11  VAL  13          HG11      VAL  13   6.218   4.441  -3.142
   86   HG12  VAL  13          HG12      VAL  13   4.503   4.818  -3.017
   87   HG13  VAL  13          HG13      VAL  13   5.439   4.491  -1.560
   88   HG21  VAL  13          HG21      VAL  13   3.762   6.990  -2.123
   89   HG22  VAL  13          HG22      VAL  13   4.952   8.179  -1.586
   90   HG23  VAL  13          HG23      VAL  13   4.678   6.715  -0.642
   91    H    CYS  14           HN       CYS  14   8.010   4.349  -0.967
   92    HA   CYS  14           HA       CYS  14   6.980   4.442   1.683
   93    HB2  CYS  14           HB2      CYS  14   8.632   2.609   0.117
   94    HB3  CYS  14           HB1      CYS  14   9.107   2.686   1.810
   95    H    ARG  15           HN       ARG  15  10.020   5.241   0.203
   96    HA   ARG  15           HA       ARG  15  11.456   5.736   2.606
   97    HB2  ARG  15           HB2      ARG  15  11.988   6.788  -0.173
   98    HB3  ARG  15           HB1      ARG  15  13.147   6.699   1.148
   99    HG2  ARG  15           HG2      ARG  15  13.154   4.324   1.090
  100    HG3  ARG  15           HG1      ARG  15  11.793   4.290  -0.031
  101    HD2  ARG  15           HD2      ARG  15  13.779   3.847  -1.275
  102    HD3  ARG  15           HD1      ARG  15  13.234   5.471  -1.690
  103    HE   ARG  15           HE       ARG  15  15.094   5.599   0.421
  104   HH11  ARG  15          HH11      ARG  15  14.898   5.031  -3.031
  105   HH12  ARG  15          HH12      ARG  15  16.558   5.475  -3.317
  106   HH21  ARG  15          HH21      ARG  15  17.259   6.216   0.032
  107   HH22  ARG  15          HH22      ARG  15  17.892   6.143  -1.582
  108    H    ASP  16           HN       ASP  16   9.460   7.618   0.483
  109    HA   ASP  16           HA       ASP  16   9.953  10.162   1.626
  110    HB2  ASP  16           HB2      ASP  16   8.963   9.990  -0.570
  111    HB3  ASP  16           HB1      ASP  16   7.602   9.074   0.061
  112    H    GLY  17           HN       GLY  17   8.347   7.458   2.835
  113    HA2  GLY  17           HA2      GLY  17   7.353   7.270   4.955
  114    HA3  GLY  17           HA1      GLY  17   7.181   9.021   5.004
  115    H    GLY  18           HN       GLY  18   6.193   7.259   2.203
  116    HA2  GLY  18           HA2      GLY  18   3.599   8.314   2.204
  117    HA3  GLY  18           HA1      GLY  18   4.165   6.996   1.200
  118    H    GLU  19           HN       GLU  19   1.606   7.411   2.508
  119    HA   GLU  19           HA       GLU  19   1.548   5.360   4.573
  120    HB2  GLU  19           HB2      GLU  19  -0.606   7.213   3.547
  121    HB3  GLU  19           HB1      GLU  19  -0.799   6.097   4.893
  122    HG2  GLU  19           HG2      GLU  19   1.011   7.302   6.081
  123    HG3  GLU  19           HG1      GLU  19   1.070   8.452   4.749
  124    H    LEU  20           HN       LEU  20   0.656   3.418   4.326
  125    HA   LEU  20           HA       LEU  20  -0.024   2.543   1.656
  126    HB2  LEU  20           HB2      LEU  20   0.422   1.200   4.292
  127    HB3  LEU  20           HB1      LEU  20  -0.407   0.335   3.013
  128    HG   LEU  20           HG       LEU  20   2.308   1.574   2.591
  129   HD11  LEU  20          HD11      LEU  20   1.619  -1.157   3.658
  130   HD12  LEU  20          HD12      LEU  20   2.620   0.076   4.423
  131   HD13  LEU  20          HD13      LEU  20   3.186  -0.739   2.966
  132   HD21  LEU  20          HD21      LEU  20   1.111   0.987   0.571
  133   HD22  LEU  20          HD22      LEU  20   0.764  -0.619   1.207
  134   HD23  LEU  20          HD23      LEU  20   2.421  -0.164   0.831
  135    H    PHE  21           HN       PHE  21  -2.037   2.034   0.924
  136    HA   PHE  21           HA       PHE  21  -4.260   2.629   2.763
  137    HB2  PHE  21           HB2      PHE  21  -4.343   2.594  -0.270
  138    HB3  PHE  21           HB1      PHE  21  -5.554   3.268   0.827
  139    HD1  PHE  21           HD1      PHE  21  -4.627   5.141   2.452
  140    HD2  PHE  21           HD2      PHE  21  -2.831   4.039  -1.252
  141    HE1  PHE  21           HE1      PHE  21  -3.554   7.349   2.313
  142    HE2  PHE  21           HE2      PHE  21  -1.752   6.238  -1.386
  143    HZ   PHE  21           HZ       PHE  21  -1.966   7.828   0.479
  144    H    CYS  22           HN       CYS  22  -2.892   0.171   2.744
  145    HA   CYS  22           HA       CYS  22  -5.064  -1.646   2.017
  146    HB2  CYS  22           HB2      CYS  22  -2.162  -1.892   1.253
  147    HB3  CYS  22           HB1      CYS  22  -3.189  -3.315   1.397
  148    H    CYS  23           HN       CYS  23  -4.874  -3.729   3.148
  149    HA   CYS  23           HA       CYS  23  -3.918  -3.350   5.862
  150    HB2  CYS  23           HB2      CYS  23  -5.180  -5.293   6.417
  151    HB3  CYS  23           HB1      CYS  23  -6.162  -4.424   5.238
  152    H    ASP  24           HN       ASP  24  -2.780  -5.394   6.822
  153    HA   ASP  24           HA       ASP  24  -0.209  -5.424   5.847
  154    HB2  ASP  24           HB2      ASP  24  -1.698  -7.202   7.708
  155    HB3  ASP  24           HB1      ASP  24  -0.139  -7.760   7.114
  156    H    THR  25           HN       THR  25  -2.637  -7.973   5.330
  157    HA   THR  25           HA       THR  25  -1.001  -9.698   3.873
  158    HB   THR  25           HB       THR  25  -3.987  -9.349   3.590
  159    HG1  THR  25           HG1      THR  25  -2.856 -11.352   5.183
  160   HG21  THR  25          HG21      THR  25  -3.021 -10.736   1.820
  161   HG22  THR  25          HG22      THR  25  -3.968 -11.718   2.937
  162   HG23  THR  25          HG23      THR  25  -2.207 -11.726   3.030
  163    H    CYS  26           HN       CYS  26  -3.235  -7.188   2.652
  164    HA   CYS  26           HA       CYS  26  -2.664  -7.815  -0.072
  165    HB2  CYS  26           HB2      CYS  26  -3.972  -5.347   1.070
  166    HB3  CYS  26           HB1      CYS  26  -3.997  -5.829  -0.617
  167    H    SER  27           HN       SER  27  -1.420  -5.439   2.214
  168    HA   SER  27           HA       SER  27  -0.133  -3.752   0.371
  169    HB2  SER  27           HB2      SER  27   0.573  -4.352   3.249
  170    HB3  SER  27           HB1      SER  27   1.218  -3.010   2.309
  171    HG   SER  27           HG       SER  27  -0.759  -2.733   3.753
  172    H    ARG  28           HN       ARG  28   0.799  -6.812   1.744
  173    HA   ARG  28           HA       ARG  28   3.537  -6.574   0.898
  174    HB2  ARG  28           HB2      ARG  28   2.003  -8.964   1.926
  175    HB3  ARG  28           HB1      ARG  28   3.753  -8.854   1.765
  176    HG2  ARG  28           HG2      ARG  28   3.853  -7.139   3.440
  177    HG3  ARG  28           HG1      ARG  28   2.094  -7.059   3.517
  178    HD2  ARG  28           HD2      ARG  28   2.140  -9.484   4.228
  179    HD3  ARG  28           HD1      ARG  28   3.886  -9.310   4.402
  180    HE   ARG  28           HE       ARG  28   2.230  -7.387   5.828
  181   HH11  ARG  28          HH11      ARG  28   4.167 -10.293   5.945
  182   HH12  ARG  28          HH12      ARG  28   4.287 -10.303   7.671
  183   HH21  ARG  28          HH21      ARG  28   2.365  -7.391   8.113
  184   HH22  ARG  28          HH22      ARG  28   3.276  -8.642   8.906
  185    H    VAL  29           HN       VAL  29   0.577  -7.694  -0.449
  186    HA   VAL  29           HA       VAL  29   1.902  -9.317  -2.467
  187    HB   VAL  29           HB       VAL  29  -1.040  -8.796  -2.014
  188   HG11  VAL  29          HG11      VAL  29  -0.599  -9.329  -4.345
  189   HG12  VAL  29          HG12      VAL  29  -1.405 -10.678  -3.544
  190   HG13  VAL  29          HG13      VAL  29   0.327 -10.746  -3.857
  191   HG21  VAL  29          HG21      VAL  29   0.690 -11.166  -1.336
  192   HG22  VAL  29          HG22      VAL  29  -1.069 -11.125  -1.204
  193   HG23  VAL  29          HG23      VAL  29  -0.084 -10.064  -0.198
  194    H    PHE  30           HN       PHE  30  -0.083  -6.372  -2.260
  195    HA   PHE  30           HA       PHE  30   0.704  -5.754  -5.043
  196    HB2  PHE  30           HB2      PHE  30  -1.785  -4.767  -3.618
  197    HB3  PHE  30           HB1      PHE  30  -1.366  -4.507  -5.308
  198    HD1  PHE  30           HD1      PHE  30  -1.194  -6.631  -6.796
  199    HD2  PHE  30           HD2      PHE  30  -3.130  -6.519  -3.006
  200    HE1  PHE  30           HE1      PHE  30  -2.478  -8.640  -7.393
  201    HE2  PHE  30           HE2      PHE  30  -4.410  -8.530  -3.592
  202    HZ   PHE  30           HZ       PHE  30  -4.088  -9.593  -5.789
  203    H    HIS  31           HN       HIS  31   2.514  -5.078  -3.273
  204    HA   HIS  31           HA       HIS  31   2.175  -2.944  -1.560
  205    HB2  HIS  31           HB2      HIS  31   4.149  -4.446  -1.679
  206    HB3  HIS  31           HB1      HIS  31   4.668  -3.600  -3.131
  207    HD1  HIS  31           HD1      HIS  31   3.927  -2.734   0.518
  208    HD2  HIS  31           HD2      HIS  31   6.388  -1.606  -2.632
  209    HE1  HIS  31           HE1      HIS  31   5.575  -1.059   1.468
  210    H    GLU  32           HN       GLU  32   3.149  -2.823  -4.977
  211    HA   GLU  32           HA       GLU  32   3.737  -0.033  -4.900
  212    HB2  GLU  32           HB2      GLU  32   3.291  -1.901  -7.226
  213    HB3  GLU  32           HB1      GLU  32   3.820  -0.235  -7.389
  214    HG2  GLU  32           HG2      GLU  32   5.836  -0.749  -6.108
  215    HG3  GLU  32           HG1      GLU  32   5.306  -2.424  -5.954
  216    H    ASP  33           HN       ASP  33   0.963  -1.954  -5.849
  217    HA   ASP  33           HA       ASP  33  -0.513   0.261  -6.909
  218    HB2  ASP  33           HB2      ASP  33  -1.300  -2.547  -6.144
  219    HB3  ASP  33           HB1      ASP  33  -2.468  -1.373  -6.739
  220    H    CYS  34           HN       CYS  34  -0.004  -1.103  -3.794
  221    HA   CYS  34           HA       CYS  34  -2.367   0.044  -2.613
  222    HB2  CYS  34           HB2      CYS  34  -0.004  -1.485  -1.561
  223    HB3  CYS  34           HB1      CYS  34  -1.146  -0.711  -0.458
  224    H    HIS  35           HN       HIS  35   0.546   1.332  -3.556
  225    HA   HIS  35           HA       HIS  35   0.383   3.513  -1.595
  226    HB2  HIS  35           HB2      HIS  35   2.431   2.815  -3.699
  227    HB3  HIS  35           HB1      HIS  35   2.449   4.348  -2.831
  228    HD1  HIS  35           HD1      HIS  35   3.030   4.233  -0.248
  229    HD2  HIS  35           HD2      HIS  35   3.305   0.624  -2.298
  230    HE1  HIS  35           HE1      HIS  35   4.324   2.652   1.251
  231    H    ILE  36           HN       ILE  36  -1.256   2.698  -4.156
  232    HA   ILE  36           HA       ILE  36  -1.419   5.415  -5.271
  233    HB   ILE  36           HB       ILE  36  -1.787   2.806  -6.760
  234   HG12  ILE  36          HG12      ILE  36   0.415   4.874  -6.956
  235   HG13  ILE  36          HG11      ILE  36   0.568   3.279  -6.230
  236   HG21  ILE  36          HG21      ILE  36  -3.251   4.580  -7.592
  237   HG22  ILE  36          HG22      ILE  36  -2.000   4.170  -8.764
  238   HG23  ILE  36          HG23      ILE  36  -1.854   5.637  -7.796
  239   HD11  ILE  36          HD11      ILE  36   0.153   2.249  -8.402
  240   HD12  ILE  36          HD12      ILE  36   1.536   3.340  -8.456
  241   HD13  ILE  36          HD13      ILE  36  -0.013   3.846  -9.127
  242    HA   PRO  37           HA       PRO  37  -2.630   6.689  -6.198
  243    HB2  PRO  37           HB2      PRO  37  -4.754   8.427  -5.340
  244    HB3  PRO  37           HB1      PRO  37  -4.400   7.880  -6.986
  245    HG2  PRO  37           HG2      PRO  37  -6.648   7.166  -5.549
  246    HG3  PRO  37           HG1      PRO  37  -5.975   6.229  -6.896
  247    HD2  PRO  37           HD2      PRO  37  -5.667   5.803  -3.943
  248    HD3  PRO  37           HD1      PRO  37  -5.895   4.604  -5.240
  249    HA   PRO  38           HA       PRO  38  -0.802   8.188  -2.413
  250    HB2  PRO  38           HB2      PRO  38   0.351  10.449  -3.490
  251    HB3  PRO  38           HB1      PRO  38   1.073   8.838  -3.540
  252    HG2  PRO  38           HG2      PRO  38  -0.456  10.305  -5.647
  253    HG3  PRO  38           HG1      PRO  38   0.961   9.250  -5.820
  254    HD2  PRO  38           HD2      PRO  38  -1.543   8.409  -6.420
  255    HD3  PRO  38           HD1      PRO  38  -0.317   7.312  -5.746
  256    H    VAL  39           HN       VAL  39  -1.409   9.598  -0.845
  257    HA   VAL  39           HA       VAL  39  -3.950  10.658  -0.970
  258    HB   VAL  39           HB       VAL  39  -2.906  10.068   1.132
  259   HG11  VAL  39          HG11      VAL  39  -1.305  11.566   2.234
  260   HG12  VAL  39          HG12      VAL  39  -1.204  12.521   0.755
  261   HG13  VAL  39          HG13      VAL  39  -0.650  10.847   0.764
  262   HG21  VAL  39          HG21      VAL  39  -3.704  11.946   2.482
  263   HG22  VAL  39          HG22      VAL  39  -4.820  11.558   1.173
  264   HG23  VAL  39          HG23      VAL  39  -3.754  12.955   1.037
  265    H    GLU  40           HN       GLU  40  -4.764  12.306  -1.983
  266    HA   GLU  40           HA       GLU  40  -3.342  14.851  -2.042
  267    HB2  GLU  40           HB2      GLU  40  -2.850  13.543  -4.165
  268    HB3  GLU  40           HB1      GLU  40  -4.558  13.695  -4.553
  269    HG2  GLU  40           HG2      GLU  40  -3.321  15.388  -5.713
  270    HG3  GLU  40           HG1      GLU  40  -4.327  16.144  -4.475
  271    H    ALA  41           HN       ALA  41  -6.293  13.064  -2.859
  272    HA   ALA  41           HA       ALA  41  -7.878  15.465  -2.301
  273    HB1  ALA  41           HB1      ALA  41  -8.716  12.846  -3.543
  274    HB2  ALA  41           HB2      ALA  41  -8.362  14.338  -4.414
  275    HB3  ALA  41           HB3      ALA  41  -9.747  14.260  -3.324
  276    H    GLU  42           HN       GLU  42  -8.410  11.993  -1.764
  277    HA   GLU  42           HA       GLU  42  -8.532  12.361   1.087
  278    HB2  GLU  42           HB2      GLU  42 -10.828  11.374   1.255
  279    HB3  GLU  42           HB1      GLU  42 -10.778  13.006   0.604
  280    HG2  GLU  42           HG2      GLU  42 -11.117  12.203  -1.616
  281    HG3  GLU  42           HG1      GLU  42 -10.947  10.529  -1.087
  282    H    ARG  43           HN       ARG  43  -7.739  10.603   2.045
  283    HA   ARG  43           HA       ARG  43  -8.017   7.985   0.767
  284    HB2  ARG  43           HB2      ARG  43  -5.404   9.284   1.537
  285    HB3  ARG  43           HB1      ARG  43  -5.571   7.555   1.295
  286    HG2  ARG  43           HG2      ARG  43  -6.244   9.566  -0.829
  287    HG3  ARG  43           HG1      ARG  43  -4.631   8.884  -0.628
  288    HD2  ARG  43           HD2      ARG  43  -5.640   7.554  -2.276
  289    HD3  ARG  43           HD1      ARG  43  -5.758   6.601  -0.799
  290    HE   ARG  43           HE       ARG  43  -8.084   8.211  -1.265
  291   HH11  ARG  43          HH11      ARG  43  -6.503   5.189  -2.063
  292   HH12  ARG  43          HH12      ARG  43  -7.965   4.403  -2.564
  293   HH21  ARG  43          HH21      ARG  43 -10.014   7.175  -1.918
  294   HH22  ARG  43          HH22      ARG  43  -9.969   5.528  -2.458
  295    H    THR  44           HN       THR  44  -8.156   6.318   2.219
  296    HA   THR  44           HA       THR  44  -7.881   7.035   5.061
  297    HB   THR  44           HB       THR  44  -9.418   5.096   5.487
  298    HG1  THR  44           HG1      THR  44  -9.019   4.099   3.389
  299   HG21  THR  44          HG21      THR  44 -11.464   6.264   4.768
  300   HG22  THR  44          HG22      THR  44 -10.495   7.292   3.713
  301   HG23  THR  44          HG23      THR  44 -10.286   7.378   5.462
  302    HA   PRO  45           HA       PRO  45  -4.393   4.180   4.395
  303    HB2  PRO  45           HB2      PRO  45  -3.465   5.186   6.984
  304    HB3  PRO  45           HB1      PRO  45  -2.682   5.272   5.404
  305    HG2  PRO  45           HG2      PRO  45  -3.715   7.451   6.634
  306    HG3  PRO  45           HG1      PRO  45  -3.682   7.275   4.869
  307    HD2  PRO  45           HD2      PRO  45  -5.962   6.872   6.777
  308    HD3  PRO  45           HD1      PRO  45  -5.958   7.623   5.164
  309    H    TRP  46           HN       TRP  46  -6.544   4.471   7.111
  310    HA   TRP  46           HA       TRP  46  -5.633   1.932   8.238
  311    HB2  TRP  46           HB2      TRP  46  -7.277   2.435  10.059
  312    HB3  TRP  46           HB1      TRP  46  -6.049   3.682   9.862
  313    HD1  TRP  46           HD1      TRP  46  -9.790   3.051   9.322
  314    HE1  TRP  46           HE1      TRP  46 -10.978   5.309   9.034
  315    HE3  TRP  46           HE3      TRP  46  -5.692   6.113   9.145
  316    HZ2  TRP  46           HZ2      TRP  46 -10.278   8.024   8.774
  317    HZ3  TRP  46           HZ3      TRP  46  -6.047   8.534   8.875
  318    HH2  TRP  46           HH2      TRP  46  -8.287   9.465   8.691
  319    H    ASN  47           HN       ASN  47  -7.081   2.243   5.641
  320    HA   ASN  47           HA       ASN  47  -9.164   0.254   6.135
  321    HB2  ASN  47           HB2      ASN  47 -10.204   2.572   6.037
  322    HB3  ASN  47           HB1      ASN  47  -9.634   2.676   4.376
  323   HD21  ASN  47          HD21      ASN  47 -10.946  -0.185   5.983
  324   HD22  ASN  47          HD22      ASN  47 -12.360  -0.306   4.992
  325    H    CYS  48           HN       CYS  48  -9.202  -1.300   4.505
  326    HA   CYS  48           HA       CYS  48  -6.982  -1.044   2.634
  327    HB2  CYS  48           HB2      CYS  48  -7.214  -3.070   4.121
  328    HB3  CYS  48           HB1      CYS  48  -8.657  -3.503   3.208
  329    H    ILE  49           HN       ILE  49  -7.299  -0.514   0.582
  330    HA   ILE  49           HA       ILE  49  -9.970  -0.479  -0.509
  331    HB   ILE  49           HB       ILE  49  -8.858   0.435  -2.575
  332   HG12  ILE  49          HG12      ILE  49  -6.407   0.576  -0.816
  333   HG13  ILE  49          HG11      ILE  49  -6.614  -0.581  -2.127
  334   HG21  ILE  49          HG21      ILE  49  -9.864   1.910  -0.942
  335   HG22  ILE  49          HG22      ILE  49  -8.384   2.633  -1.569
  336   HG23  ILE  49          HG23      ILE  49  -8.392   1.886   0.027
  337   HD11  ILE  49          HD11      ILE  49  -6.739   1.257  -3.724
  338   HD12  ILE  49          HD12      ILE  49  -5.237   1.313  -2.799
  339   HD13  ILE  49          HD13      ILE  49  -6.557   2.417  -2.410
  340    H    PHE  50           HN       PHE  50  -7.212  -2.556  -0.673
  341    HA   PHE  50           HA       PHE  50  -7.987  -3.714  -3.196
  342    HB2  PHE  50           HB2      PHE  50  -5.618  -3.908  -1.494
  343    HB3  PHE  50           HB1      PHE  50  -6.095  -5.441  -2.233
  344    HD1  PHE  50           HD1      PHE  50  -6.084  -5.733  -4.623
  345    HD2  PHE  50           HD2      PHE  50  -4.930  -2.025  -2.882
  346    HE1  PHE  50           HE1      PHE  50  -5.150  -5.013  -6.779
  347    HE2  PHE  50           HE2      PHE  50  -3.995  -1.302  -5.031
  348    HZ   PHE  50           HZ       PHE  50  -4.104  -2.795  -6.986
  349    H    CYS  51           HN       CYS  51  -8.496  -4.429   0.166
  350    HA   CYS  51           HA       CYS  51  -9.142  -7.146  -0.029
  351    HB2  CYS  51           HB2      CYS  51  -9.691  -4.976   1.887
  352    HB3  CYS  51           HB1      CYS  51 -10.843  -6.306   1.917
  353    H    ARG  52           HN       ARG  52 -10.965  -4.333  -0.989
  354    HA   ARG  52           HA       ARG  52 -13.390  -5.910  -1.313
  355    HB2  ARG  52           HB2      ARG  52 -14.499  -3.853  -1.874
  356    HB3  ARG  52           HB1      ARG  52 -13.513  -3.580  -0.445
  357    HG2  ARG  52           HG2      ARG  52 -11.752  -2.645  -1.994
  358    HG3  ARG  52           HG1      ARG  52 -12.982  -2.680  -3.258
  359    HD2  ARG  52           HD2      ARG  52 -12.881  -0.478  -2.246
  360    HD3  ARG  52           HD1      ARG  52 -14.422  -1.249  -1.868
  361    HE   ARG  52           HE       ARG  52 -13.271  -1.860   0.323
  362   HH11  ARG  52          HH11      ARG  52 -12.584   1.063  -1.477
  363   HH12  ARG  52          HH12      ARG  52 -12.090   1.954  -0.073
  364   HH21  ARG  52          HH21      ARG  52 -12.634  -0.678   2.163
  365   HH22  ARG  52          HH22      ARG  52 -12.107   0.966   1.992
  366    H    MET  53           HN       MET  53 -10.648  -5.667  -2.960
  367    HA   MET  53           HA       MET  53 -11.915  -5.725  -5.618
  368    HB2  MET  53           HB2      MET  53  -9.021  -5.227  -4.878
  369    HB3  MET  53           HB1      MET  53  -9.666  -5.248  -6.510
  370    HG2  MET  53           HG2      MET  53 -11.030  -3.304  -6.022
  371    HG3  MET  53           HG1      MET  53 -10.447  -3.294  -4.358
  372    HE1  MET  53           HE1      MET  53  -9.683  -0.779  -4.511
  373    HE2  MET  53           HE2      MET  53 -10.327  -0.711  -6.153
  374    HE3  MET  53           HE3      MET  53  -8.694  -0.133  -5.820
  375    H    LYS  54           HN       LYS  54 -11.884  -7.885  -3.707
  376    HA   LYS  54           HA       LYS  54  -9.845  -9.750  -4.185
  377    HB2  LYS  54           HB2      LYS  54 -11.396  -9.873  -2.257
  378    HB3  LYS  54           HB1      LYS  54 -12.715 -10.245  -3.357
  379    HG2  LYS  54           HG2      LYS  54 -11.583 -12.321  -4.007
  380    HG3  LYS  54           HG1      LYS  54 -10.288 -11.962  -2.865
  381    HD2  LYS  54           HD2      LYS  54 -11.929 -11.975  -1.031
  382    HD3  LYS  54           HD1      LYS  54 -13.195 -12.392  -2.185
  383    HE2  LYS  54           HE2      LYS  54 -10.752 -14.050  -1.565
  384    HE3  LYS  54           HE1      LYS  54 -12.384 -14.360  -0.979
  385    HZ1  LYS  54           HZ1      LYS  54 -11.992 -15.758  -2.840
  386    HZ2  LYS  54           HZ2      LYS  54 -11.433 -14.478  -3.790
  387    HZ3  LYS  54           HZ3      LYS  54 -13.066 -14.558  -3.353
  388    H    GLU  55           HN       GLU  55  -9.447 -11.045  -5.850
  389    HA   GLU  55           HA       GLU  55 -11.607 -11.734  -7.701
  390    HB2  GLU  55           HB2      GLU  55 -10.474  -9.797  -8.673
  391    HB3  GLU  55           HB1      GLU  55  -8.925 -10.614  -8.531
  392    HG2  GLU  55           HG2      GLU  55  -9.649 -12.298 -10.124
  393    HG3  GLU  55           HG1      GLU  55 -11.230 -11.527 -10.235
  394    H    SER  56           HN       SER  56 -11.665 -13.857  -7.295
  395    HA   SER  56           HA       SER  56  -9.133 -15.347  -7.427
  396    HB2  SER  56           HB2      SER  56 -11.590 -16.115  -5.830
  397    HB3  SER  56           HB1      SER  56 -10.014 -16.906  -5.803
  398    HG   SER  56           HG       SER  56  -9.133 -15.045  -4.879
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1  11.046 -10.553  -1.301
    2    H2   GLY   1           HT2      GLY   1  10.254  -9.352  -0.414
    3    H3   GLY   1           HT3      GLY   1  10.629 -10.829   0.312
    4    HA2  GLY   1           HA1      GLY   1  12.614  -8.858  -0.664
    5    HA3  GLY   1           HA2      GLY   1  12.146  -9.070   1.019
    6    H    ALA   2           HN       ALA   2  14.782  -9.325   0.221
    7    HA   ALA   2           HA       ALA   2  15.547 -11.993  -0.330
    8    HB1  ALA   2           HB1      ALA   2  17.052 -10.124  -0.737
    9    HB2  ALA   2           HB2      ALA   2  17.789 -11.277   0.376
   10    HB3  ALA   2           HB3      ALA   2  17.106  -9.773   0.990
   11    H    MET   3           HN       MET   3  15.016 -10.183   2.623
   12    HA   MET   3           HA       MET   3  14.650 -12.625   4.103
   13    HB2  MET   3           HB2      MET   3  17.128 -12.228   4.185
   14    HB3  MET   3           HB1      MET   3  16.806 -10.705   5.002
   15    HG2  MET   3           HG2      MET   3  17.414 -12.443   6.586
   16    HG3  MET   3           HG1      MET   3  15.757 -11.900   6.849
   17    HE1  MET   3           HE1      MET   3  15.253 -14.026   8.331
   18    HE2  MET   3           HE2      MET   3  16.912 -14.582   8.101
   19    HE3  MET   3           HE3      MET   3  15.564 -15.682   7.812
   20    H    GLY   4           HN       GLY   4  12.540 -11.680   4.188
   21    HA2  GLY   4           HA2      GLY   4  11.682 -10.561   6.453
   22    HA3  GLY   4           HA1      GLY   4  12.224  -9.144   5.565
   23    H    MET   5           HN       MET   5   9.686  -9.046   6.174
   24    HA   MET   5           HA       MET   5   8.280  -9.828   3.708
   25    HB2  MET   5           HB2      MET   5   7.214  -9.803   6.538
   26    HB3  MET   5           HB1      MET   5   6.199  -9.982   5.112
   27    HG2  MET   5           HG2      MET   5   7.364 -12.043   4.528
   28    HG3  MET   5           HG1      MET   5   8.410 -11.860   5.933
   29    HE1  MET   5           HE1      MET   5   6.447 -10.852   8.191
   30    HE2  MET   5           HE2      MET   5   7.625 -12.143   8.422
   31    HE3  MET   5           HE3      MET   5   5.947 -12.383   8.906
   32    H    ARG   6           HN       ARG   6   9.675  -7.411   4.162
   33    HA   ARG   6           HA       ARG   6   7.462  -5.518   3.866
   34    HB2  ARG   6           HB2      ARG   6   8.355  -5.465   6.240
   35    HB3  ARG   6           HB1      ARG   6   9.881  -4.913   5.568
   36    HG2  ARG   6           HG2      ARG   6   8.664  -3.029   6.400
   37    HG3  ARG   6           HG1      ARG   6   8.718  -2.941   4.640
   38    HD2  ARG   6           HD2      ARG   6   6.451  -3.743   4.479
   39    HD3  ARG   6           HD1      ARG   6   6.389  -4.031   6.217
   40    HE   ARG   6           HE       ARG   6   6.991  -1.307   5.606
   41   HH11  ARG   6          HH11      ARG   6   4.357  -3.608   5.846
   42   HH12  ARG   6          HH12      ARG   6   3.177  -2.400   6.223
   43   HH21  ARG   6          HH21      ARG   6   5.430   0.280   6.077
   44   HH22  ARG   6          HH22      ARG   6   3.777  -0.182   6.334
   45    H    ASN   7           HN       ASN   7   8.386  -6.241   1.668
   46    HA   ASN   7           HA       ASN   7  10.904  -5.101   0.883
   47    HB2  ASN   7           HB2      ASN   7  10.057  -7.135  -0.201
   48    HB3  ASN   7           HB1      ASN   7   8.669  -6.241  -0.810
   49   HD21  ASN   7          HD21      ASN   7  11.973  -4.999  -0.710
   50   HD22  ASN   7          HD22      ASN   7  12.188  -4.966  -2.427
   51    H    LEU   8           HN       LEU   8  10.748  -2.943   1.349
   52    HA   LEU   8           HA       LEU   8   8.984  -1.399  -0.426
   53    HB2  LEU   8           HB2      LEU   8   9.360   0.467   1.278
   54    HB3  LEU   8           HB1      LEU   8   8.280  -0.837   1.726
   55    HG   LEU   8           HG       LEU   8  10.247  -1.859   2.978
   56   HD11  LEU   8          HD11      LEU   8  12.034  -0.573   1.918
   57   HD12  LEU   8          HD12      LEU   8  12.025  -0.352   3.667
   58   HD13  LEU   8          HD13      LEU   8  11.381   0.908   2.616
   59   HD21  LEU   8          HD21      LEU   8   9.190   0.810   3.890
   60   HD22  LEU   8          HD22      LEU   8   9.895  -0.436   4.921
   61   HD23  LEU   8          HD23      LEU   8   8.377  -0.744   4.074
   62    H    ASP   9           HN       ASP   9  11.771  -2.559  -0.606
   63    HA   ASP   9           HA       ASP   9  13.655  -0.448  -0.485
   64    HB2  ASP   9           HB2      ASP   9  13.879  -3.020  -2.056
   65    HB3  ASP   9           HB1      ASP   9  15.198  -2.029  -1.442
   66    H    GLU  10           HN       GLU  10  11.681  -1.812  -3.014
   67    HA   GLU  10           HA       GLU  10  12.809   0.009  -4.999
   68    HB2  GLU  10           HB2      GLU  10  10.719  -2.154  -5.269
   69    HB3  GLU  10           HB1      GLU  10  11.374  -1.208  -6.599
   70    HG2  GLU  10           HG2      GLU  10  13.563  -2.133  -6.246
   71    HG3  GLU  10           HG1      GLU  10  13.008  -2.984  -4.806
   72    H    CYS  11           HN       CYS  11  10.773   0.420  -2.633
   73    HA   CYS  11           HA       CYS  11   8.705   1.854  -4.142
   74    HB2  CYS  11           HB2      CYS  11   8.011   0.104  -2.514
   75    HB3  CYS  11           HB1      CYS  11   8.777   1.030  -1.236
   76    H    GLU  12           HN       GLU  12   9.814   3.749  -4.583
   77    HA   GLU  12           HA       GLU  12  11.402   5.151  -2.718
   78    HB2  GLU  12           HB2      GLU  12  10.071   6.000  -5.280
   79    HB3  GLU  12           HB1      GLU  12  11.078   7.082  -4.330
   80    HG2  GLU  12           HG2      GLU  12  11.997   4.460  -5.484
   81    HG3  GLU  12           HG1      GLU  12  12.275   6.039  -6.210
   82    H    VAL  13           HN       VAL  13   7.991   5.065  -3.277
   83    HA   VAL  13           HA       VAL  13   7.432   7.530  -1.985
   84    HB   VAL  13           HB       VAL  13   5.801   6.687  -3.510
   85   HG11  VAL  13          HG11      VAL  13   4.546   4.662  -3.174
   86   HG12  VAL  13          HG12      VAL  13   5.452   4.313  -1.704
   87   HG13  VAL  13          HG13      VAL  13   6.266   4.303  -3.269
   88   HG21  VAL  13          HG21      VAL  13   4.981   7.971  -1.575
   89   HG22  VAL  13          HG22      VAL  13   4.675   6.451  -0.731
   90   HG23  VAL  13          HG23      VAL  13   3.782   6.837  -2.202
   91    H    CYS  14           HN       CYS  14   7.816   4.208  -0.864
   92    HA   CYS  14           HA       CYS  14   7.059   4.717   1.829
   93    HB2  CYS  14           HB2      CYS  14   8.466   2.568   0.392
   94    HB3  CYS  14           HB1      CYS  14   8.903   2.745   2.087
   95    H    ARG  15           HN       ARG  15   9.943   5.206  -0.010
   96    HA   ARG  15           HA       ARG  15  11.753   5.711   2.092
   97    HB2  ARG  15           HB2      ARG  15  12.363   5.297  -0.278
   98    HB3  ARG  15           HB1      ARG  15  11.698   6.865  -0.699
   99    HG2  ARG  15           HG2      ARG  15  13.399   7.939   0.708
  100    HG3  ARG  15           HG1      ARG  15  14.083   6.350   1.065
  101    HD2  ARG  15           HD2      ARG  15  14.428   5.993  -1.351
  102    HD3  ARG  15           HD1      ARG  15  13.828   7.619  -1.656
  103    HE   ARG  15           HE       ARG  15  15.963   7.759   0.162
  104   HH11  ARG  15          HH11      ARG  15  15.318   7.035  -3.207
  105   HH12  ARG  15          HH12      ARG  15  16.905   7.506  -3.738
  106   HH21  ARG  15          HH21      ARG  15  18.043   8.382  -0.534
  107   HH22  ARG  15          HH22      ARG  15  18.461   8.266  -2.213
  108    H    ASP  16           HN       ASP  16   9.529   7.734   0.294
  109    HA   ASP  16           HA       ASP  16  10.082  10.129   1.741
  110    HB2  ASP  16           HB2      ASP  16   9.151  10.229  -0.498
  111    HB3  ASP  16           HB1      ASP  16   7.733   9.322   0.011
  112    H    GLY  17           HN       GLY  17   8.520   7.321   2.643
  113    HA2  GLY  17           HA2      GLY  17   7.486   6.860   4.681
  114    HA3  GLY  17           HA1      GLY  17   7.391   8.590   4.992
  115    H    GLY  18           HN       GLY  18   6.263   7.232   2.011
  116    HA2  GLY  18           HA2      GLY  18   3.733   8.397   2.146
  117    HA3  GLY  18           HA1      GLY  18   4.197   7.109   1.052
  118    H    GLU  19           HN       GLU  19   1.666   7.431   2.184
  119    HA   GLU  19           HA       GLU  19   1.474   5.580   4.418
  120    HB2  GLU  19           HB2      GLU  19  -0.571   7.326   3.049
  121    HB3  GLU  19           HB1      GLU  19  -0.920   6.297   4.432
  122    HG2  GLU  19           HG2      GLU  19   0.741   7.579   5.750
  123    HG3  GLU  19           HG1      GLU  19   0.985   8.636   4.361
  124    H    LEU  20           HN       LEU  20   0.075   3.800   4.412
  125    HA   LEU  20           HA       LEU  20  -0.285   2.571   1.772
  126    HB2  LEU  20           HB2      LEU  20   0.090   1.481   4.535
  127    HB3  LEU  20           HB1      LEU  20  -0.666   0.496   3.300
  128    HG   LEU  20           HG       LEU  20   2.054   1.739   2.921
  129   HD11  LEU  20          HD11      LEU  20   1.359  -0.974   4.035
  130   HD12  LEU  20          HD12      LEU  20   2.169   0.335   4.895
  131   HD13  LEU  20          HD13      LEU  20   2.970  -0.461   3.539
  132   HD21  LEU  20          HD21      LEU  20   2.273  -0.084   1.268
  133   HD22  LEU  20          HD22      LEU  20   0.946   1.011   0.883
  134   HD23  LEU  20          HD23      LEU  20   0.610  -0.564   1.601
  135    H    PHE  21           HN       PHE  21  -2.274   1.980   1.056
  136    HA   PHE  21           HA       PHE  21  -4.547   2.574   2.840
  137    HB2  PHE  21           HB2      PHE  21  -4.539   2.531  -0.195
  138    HB3  PHE  21           HB1      PHE  21  -5.833   3.119   0.854
  139    HD1  PHE  21           HD1      PHE  21  -5.351   5.137   2.331
  140    HD2  PHE  21           HD2      PHE  21  -2.823   3.963  -0.894
  141    HE1  PHE  21           HE1      PHE  21  -4.418   7.404   2.237
  142    HE2  PHE  21           HE2      PHE  21  -1.881   6.226  -0.974
  143    HZ   PHE  21           HZ       PHE  21  -2.525   7.886   0.742
  144    H    CYS  22           HN       CYS  22  -3.106   0.164   2.870
  145    HA   CYS  22           HA       CYS  22  -5.195  -1.722   2.075
  146    HB2  CYS  22           HB2      CYS  22  -2.268  -1.858   1.395
  147    HB3  CYS  22           HB1      CYS  22  -3.230  -3.327   1.533
  148    H    CYS  23           HN       CYS  23  -4.958  -3.812   3.180
  149    HA   CYS  23           HA       CYS  23  -4.029  -3.508   5.906
  150    HB2  CYS  23           HB2      CYS  23  -5.152  -5.570   6.345
  151    HB3  CYS  23           HB1      CYS  23  -6.194  -4.695   5.224
  152    H    ASP  24           HN       ASP  24  -2.666  -5.458   6.782
  153    HA   ASP  24           HA       ASP  24  -0.168  -5.156   5.566
  154    HB2  ASP  24           HB2      ASP  24  -1.136  -7.126   7.622
  155    HB3  ASP  24           HB1      ASP  24   0.529  -7.118   7.050
  156    H    THR  25           HN       THR  25  -2.489  -7.794   5.277
  157    HA   THR  25           HA       THR  25  -0.842  -9.593   3.897
  158    HB   THR  25           HB       THR  25  -3.831  -9.272   3.622
  159    HG1  THR  25           HG1      THR  25  -2.398  -9.893   5.753
  160   HG21  THR  25          HG21      THR  25  -2.826 -10.703   1.897
  161   HG22  THR  25          HG22      THR  25  -3.813 -11.638   3.022
  162   HG23  THR  25          HG23      THR  25  -2.054 -11.669   3.154
  163    H    CYS  26           HN       CYS  26  -3.101  -7.133   2.625
  164    HA   CYS  26           HA       CYS  26  -2.471  -7.790  -0.091
  165    HB2  CYS  26           HB2      CYS  26  -3.873  -5.349   0.997
  166    HB3  CYS  26           HB1      CYS  26  -3.820  -5.824  -0.690
  167    H    SER  27           HN       SER  27  -1.267  -5.459   2.254
  168    HA   SER  27           HA       SER  27   0.053  -3.786   0.395
  169    HB2  SER  27           HB2      SER  27   1.390  -3.030   2.393
  170    HB3  SER  27           HB1      SER  27  -0.357  -2.922   2.593
  171    HG   SER  27           HG       SER  27   0.994  -5.235   3.443
  172    H    ARG  28           HN       ARG  28   0.839  -6.892   1.678
  173    HA   ARG  28           HA       ARG  28   3.599  -6.751   0.875
  174    HB2  ARG  28           HB2      ARG  28   1.834  -9.015   1.784
  175    HB3  ARG  28           HB1      ARG  28   3.509  -9.249   1.305
  176    HG2  ARG  28           HG2      ARG  28   4.228  -7.739   3.093
  177    HG3  ARG  28           HG1      ARG  28   2.542  -7.515   3.573
  178    HD2  ARG  28           HD2      ARG  28   3.718  -9.183   4.964
  179    HD3  ARG  28           HD1      ARG  28   2.342  -9.867   4.099
  180    HE   ARG  28           HE       ARG  28   4.920 -10.132   2.795
  181   HH11  ARG  28          HH11      ARG  28   2.531 -11.607   4.884
  182   HH12  ARG  28          HH12      ARG  28   3.071 -13.222   4.565
  183   HH21  ARG  28          HH21      ARG  28   5.627 -12.248   2.364
  184   HH22  ARG  28          HH22      ARG  28   4.841 -13.590   3.133
  185    H    VAL  29           HN       VAL  29   0.585  -7.687  -0.565
  186    HA   VAL  29           HA       VAL  29   1.906  -9.207  -2.664
  187    HB   VAL  29           HB       VAL  29  -1.044  -8.663  -2.324
  188   HG11  VAL  29          HG11      VAL  29   0.412 -10.681  -4.025
  189   HG12  VAL  29          HG12      VAL  29  -0.435  -9.250  -4.611
  190   HG13  VAL  29          HG13      VAL  29  -1.337 -10.559  -3.844
  191   HG21  VAL  29          HG21      VAL  29  -1.150 -10.979  -1.467
  192   HG22  VAL  29          HG22      VAL  29  -0.234  -9.899  -0.418
  193   HG23  VAL  29          HG23      VAL  29   0.612 -11.032  -1.473
  194    H    PHE  30           HN       PHE  30  -0.055  -6.261  -2.342
  195    HA   PHE  30           HA       PHE  30   0.804  -5.510  -5.069
  196    HB2  PHE  30           HB2      PHE  30  -1.768  -4.665  -3.703
  197    HB3  PHE  30           HB1      PHE  30  -1.285  -4.296  -5.356
  198    HD1  PHE  30           HD1      PHE  30  -0.938  -6.347  -6.930
  199    HD2  PHE  30           HD2      PHE  30  -3.114  -6.466  -3.274
  200    HE1  PHE  30           HE1      PHE  30  -2.121  -8.361  -7.697
  201    HE2  PHE  30           HE2      PHE  30  -4.293  -8.480  -4.032
  202    HZ   PHE  30           HZ       PHE  30  -3.797  -9.430  -6.248
  203    H    HIS  31           HN       HIS  31   2.493  -4.917  -3.146
  204    HA   HIS  31           HA       HIS  31   2.049  -2.873  -1.362
  205    HB2  HIS  31           HB2      HIS  31   4.057  -4.326  -1.432
  206    HB3  HIS  31           HB1      HIS  31   4.635  -3.420  -2.827
  207    HD1  HIS  31           HD1      HIS  31   3.551  -2.547   0.742
  208    HD2  HIS  31           HD2      HIS  31   6.394  -1.542  -2.113
  209    HE1  HIS  31           HE1      HIS  31   5.092  -0.859   1.835
  210    H    GLU  32           HN       GLU  32   3.236  -2.547  -4.699
  211    HA   GLU  32           HA       GLU  32   3.718   0.242  -4.464
  212    HB2  GLU  32           HB2      GLU  32   3.376  -1.487  -6.913
  213    HB3  GLU  32           HB1      GLU  32   3.892   0.192  -6.950
  214    HG2  GLU  32           HG2      GLU  32   5.830  -0.474  -5.498
  215    HG3  GLU  32           HG1      GLU  32   5.355  -2.151  -5.760
  216    H    ASP  33           HN       ASP  33   0.995  -1.651  -5.636
  217    HA   ASP  33           HA       ASP  33  -0.485   0.580  -6.620
  218    HB2  ASP  33           HB2      ASP  33  -1.284  -2.239  -5.898
  219    HB3  ASP  33           HB1      ASP  33  -2.434  -1.058  -6.509
  220    H    CYS  34           HN       CYS  34  -0.051  -0.922  -3.549
  221    HA   CYS  34           HA       CYS  34  -2.461   0.089  -2.371
  222    HB2  CYS  34           HB2      CYS  34  -0.049  -1.376  -1.348
  223    HB3  CYS  34           HB1      CYS  34  -1.229  -0.697  -0.225
  224    H    HIS  35           HN       HIS  35   0.307   1.619  -3.250
  225    HA   HIS  35           HA       HIS  35   0.128   3.593  -1.090
  226    HB2  HIS  35           HB2      HIS  35   2.132   3.167  -3.301
  227    HB3  HIS  35           HB1      HIS  35   2.107   4.636  -2.324
  228    HD1  HIS  35           HD1      HIS  35   2.841   4.395   0.187
  229    HD2  HIS  35           HD2      HIS  35   3.014   0.880  -2.017
  230    HE1  HIS  35           HE1      HIS  35   4.109   2.730   1.607
  231    H    ILE  36           HN       ILE  36  -1.337   2.932  -3.927
  232    HA   ILE  36           HA       ILE  36  -1.774   5.766  -4.606
  233    HB   ILE  36           HB       ILE  36  -1.907   3.402  -6.490
  234   HG12  ILE  36          HG12      ILE  36   0.247   5.517  -6.274
  235   HG13  ILE  36          HG11      ILE  36   0.402   3.862  -5.702
  236   HG21  ILE  36          HG21      ILE  36  -3.357   5.263  -7.123
  237   HG22  ILE  36          HG22      ILE  36  -2.021   5.076  -8.257
  238   HG23  ILE  36          HG23      ILE  36  -1.980   6.363  -7.054
  239   HD11  ILE  36          HD11      ILE  36   0.167   3.038  -7.979
  240   HD12  ILE  36          HD12      ILE  36   1.501   4.184  -7.850
  241   HD13  ILE  36          HD13      ILE  36  -0.031   4.691  -8.564
  242    HA   PRO  37           HA       PRO  37  -3.079   7.039  -5.389
  243    HB2  PRO  37           HB2      PRO  37  -5.458   8.418  -4.608
  244    HB3  PRO  37           HB1      PRO  37  -4.930   8.034  -6.253
  245    HG2  PRO  37           HG2      PRO  37  -7.166   6.966  -5.007
  246    HG3  PRO  37           HG1      PRO  37  -6.335   6.247  -6.401
  247    HD2  PRO  37           HD2      PRO  37  -6.108   5.559  -3.490
  248    HD3  PRO  37           HD1      PRO  37  -6.132   4.481  -4.906
  249    HA   PRO  38           HA       PRO  38  -1.773   8.297  -1.282
  250    HB2  PRO  38           HB2      PRO  38  -1.078  10.818  -2.683
  251    HB3  PRO  38           HB1      PRO  38  -0.062   9.760  -1.697
  252    HG2  PRO  38           HG2      PRO  38   0.205   9.813  -4.353
  253    HG3  PRO  38           HG1      PRO  38   0.345   8.291  -3.449
  254    HD2  PRO  38           HD2      PRO  38  -1.958   9.325  -5.072
  255    HD3  PRO  38           HD1      PRO  38  -1.315   7.671  -4.950
  256    H    VAL  39           HN       VAL  39  -2.241   9.998   0.262
  257    HA   VAL  39           HA       VAL  39  -4.965  10.738   0.225
  258    HB   VAL  39           HB       VAL  39  -2.770  11.659   2.081
  259   HG11  VAL  39          HG11      VAL  39  -4.559  12.283   3.616
  260   HG12  VAL  39          HG12      VAL  39  -5.760  11.827   2.407
  261   HG13  VAL  39          HG13      VAL  39  -4.680  13.187   2.105
  262   HG21  VAL  39          HG21      VAL  39  -3.069   9.262   2.169
  263   HG22  VAL  39          HG22      VAL  39  -4.809   9.458   2.353
  264   HG23  VAL  39          HG23      VAL  39  -3.722   9.997   3.629
  265    H    GLU  40           HN       GLU  40  -5.354  12.028  -1.549
  266    HA   GLU  40           HA       GLU  40  -4.375  14.791  -1.268
  267    HB2  GLU  40           HB2      GLU  40  -5.433  13.496  -3.792
  268    HB3  GLU  40           HB1      GLU  40  -4.726  15.098  -3.648
  269    HG2  GLU  40           HG2      GLU  40  -2.572  14.091  -3.064
  270    HG3  GLU  40           HG1      GLU  40  -3.286  12.488  -3.232
  271    H    ALA  41           HN       ALA  41  -7.115  12.678  -1.854
  272    HA   ALA  41           HA       ALA  41  -8.881  14.519  -0.547
  273    HB1  ALA  41           HB1      ALA  41 -10.457  14.775  -2.386
  274    HB2  ALA  41           HB2      ALA  41  -9.373  13.885  -3.453
  275    HB3  ALA  41           HB3      ALA  41  -8.886  15.453  -2.812
  276    H    GLU  42           HN       GLU  42  -9.980  13.250   0.739
  277    HA   GLU  42           HA       GLU  42 -11.217  11.555   1.586
  278    HB2  GLU  42           HB2      GLU  42 -12.067  11.218  -1.291
  279    HB3  GLU  42           HB1      GLU  42 -12.926  10.607   0.119
  280    HG2  GLU  42           HG2      GLU  42 -13.216  12.927   0.903
  281    HG3  GLU  42           HG1      GLU  42 -12.433  13.494  -0.570
  282    H    ARG  43           HN       ARG  43  -8.799  10.700   1.603
  283    HA   ARG  43           HA       ARG  43  -8.938   7.935   0.581
  284    HB2  ARG  43           HB2      ARG  43  -6.521   9.658   1.142
  285    HB3  ARG  43           HB1      ARG  43  -6.432   7.931   0.835
  286    HG2  ARG  43           HG2      ARG  43  -7.601   9.914  -1.101
  287    HG3  ARG  43           HG1      ARG  43  -5.918   9.387  -1.128
  288    HD2  ARG  43           HD2      ARG  43  -7.075   8.063  -2.724
  289    HD3  ARG  43           HD1      ARG  43  -6.781   7.028  -1.329
  290    HE   ARG  43           HE       ARG  43  -9.347   8.318  -1.252
  291   HH11  ARG  43          HH11      ARG  43  -7.579   5.569  -2.498
  292   HH12  ARG  43          HH12      ARG  43  -8.996   4.601  -2.745
  293   HH21  ARG  43          HH21      ARG  43 -11.210   7.041  -1.531
  294   HH22  ARG  43          HH22      ARG  43 -11.066   5.434  -2.173
  295    H    THR  44           HN       THR  44  -8.849   6.313   2.051
  296    HA   THR  44           HA       THR  44  -8.478   7.121   4.858
  297    HB   THR  44           HB       THR  44 -10.147   5.386   5.464
  298    HG1  THR  44           HG1      THR  44  -9.789   4.378   3.202
  299   HG21  THR  44          HG21      THR  44 -11.145   7.465   3.509
  300   HG22  THR  44          HG22      THR  44 -10.838   7.726   5.224
  301   HG23  THR  44          HG23      THR  44 -12.125   6.633   4.715
  302    HA   PRO  45           HA       PRO  45  -5.233   3.979   4.327
  303    HB2  PRO  45           HB2      PRO  45  -4.438   4.931   6.999
  304    HB3  PRO  45           HB1      PRO  45  -3.500   4.863   5.504
  305    HG2  PRO  45           HG2      PRO  45  -4.357   7.196   6.527
  306    HG3  PRO  45           HG1      PRO  45  -4.252   6.920   4.777
  307    HD2  PRO  45           HD2      PRO  45  -6.660   6.870   6.565
  308    HD3  PRO  45           HD1      PRO  45  -6.488   7.539   4.925
  309    H    TRP  46           HN       TRP  46  -7.583   4.402   6.844
  310    HA   TRP  46           HA       TRP  46  -6.905   1.857   8.092
  311    HB2  TRP  46           HB2      TRP  46  -8.723   2.419   9.703
  312    HB3  TRP  46           HB1      TRP  46  -7.463   3.644   9.623
  313    HD1  TRP  46           HD1      TRP  46 -11.155   3.086   8.876
  314    HE1  TRP  46           HE1      TRP  46 -12.266   5.355   8.412
  315    HE3  TRP  46           HE3      TRP  46  -6.969   6.015   8.681
  316    HZ2  TRP  46           HZ2      TRP  46 -11.476   8.030   8.007
  317    HZ3  TRP  46           HZ3      TRP  46  -7.237   8.421   8.239
  318    HH2  TRP  46           HH2      TRP  46  -9.436   9.403   7.906
  319    H    ASN  47           HN       ASN  47  -8.033   2.157   5.341
  320    HA   ASN  47           HA       ASN  47  -9.958  -0.012   5.630
  321    HB2  ASN  47           HB2      ASN  47 -11.379   1.967   5.307
  322    HB3  ASN  47           HB1      ASN  47 -10.436   2.433   3.897
  323   HD21  ASN  47          HD21      ASN  47 -12.666   0.009   5.157
  324   HD22  ASN  47          HD22      ASN  47 -13.213  -0.547   3.609
  325    H    CYS  48           HN       CYS  48  -9.601  -1.611   4.108
  326    HA   CYS  48           HA       CYS  48  -7.218  -1.158   2.499
  327    HB2  CYS  48           HB2      CYS  48  -7.412  -3.183   3.986
  328    HB3  CYS  48           HB1      CYS  48  -8.716  -3.757   2.954
  329    H    ILE  49           HN       ILE  49  -7.346  -0.685   0.412
  330    HA   ILE  49           HA       ILE  49  -9.907  -0.625  -0.864
  331    HB   ILE  49           HB       ILE  49  -8.614   0.195  -2.880
  332   HG12  ILE  49          HG12      ILE  49  -6.336   0.364  -0.904
  333   HG13  ILE  49          HG11      ILE  49  -6.427  -0.815  -2.209
  334   HG21  ILE  49          HG21      ILE  49  -8.413   1.695  -0.273
  335   HG22  ILE  49          HG22      ILE  49  -9.755   1.727  -1.415
  336   HG23  ILE  49          HG23      ILE  49  -8.196   2.417  -1.866
  337   HD11  ILE  49          HD11      ILE  49  -4.985   1.060  -2.785
  338   HD12  ILE  49          HD12      ILE  49  -6.325   2.178  -2.533
  339   HD13  ILE  49          HD13      ILE  49  -6.395   0.999  -3.842
  340    H    PHE  50           HN       PHE  50  -7.207  -2.801  -0.906
  341    HA   PHE  50           HA       PHE  50  -8.061  -4.026  -3.383
  342    HB2  PHE  50           HB2      PHE  50  -5.722  -4.428  -1.587
  343    HB3  PHE  50           HB1      PHE  50  -6.238  -5.788  -2.591
  344    HD1  PHE  50           HD2      PHE  50  -4.973  -2.334  -2.638
  345    HD2  PHE  50           HD1      PHE  50  -6.015  -5.739  -4.964
  346    HE1  PHE  50           HE2      PHE  50  -3.899  -1.318  -4.597
  347    HE2  PHE  50           HE1      PHE  50  -4.942  -4.729  -6.933
  348    HZ   PHE  50           HZ       PHE  50  -3.884  -2.515  -6.752
  349    H    CYS  51           HN       CYS  51  -8.409  -4.599   0.047
  350    HA   CYS  51           HA       CYS  51  -9.481  -7.206  -0.141
  351    HB2  CYS  51           HB2      CYS  51  -9.589  -5.047   1.914
  352    HB3  CYS  51           HB1      CYS  51 -10.774  -6.339   2.024
  353    H    ARG  52           HN       ARG  52 -10.991  -4.001  -0.346
  354    HA   ARG  52           HA       ARG  52 -13.617  -5.089  -0.646
  355    HB2  ARG  52           HB2      ARG  52 -14.322  -2.797  -1.036
  356    HB3  ARG  52           HB1      ARG  52 -13.241  -2.873   0.345
  357    HG2  ARG  52           HG2      ARG  52 -11.389  -2.191  -1.228
  358    HG3  ARG  52           HG1      ARG  52 -12.650  -1.850  -2.413
  359    HD2  ARG  52           HD2      ARG  52 -12.409  -0.612   0.327
  360    HD3  ARG  52           HD1      ARG  52 -11.997   0.167  -1.200
  361    HE   ARG  52           HE       ARG  52 -14.577  -0.525  -1.566
  362   HH11  ARG  52          HH11      ARG  52 -12.924   1.156   1.022
  363   HH12  ARG  52          HH12      ARG  52 -14.286   2.157   1.411
  364   HH21  ARG  52          HH21      ARG  52 -16.381   0.787  -1.046
  365   HH22  ARG  52          HH22      ARG  52 -16.252   1.943   0.243
  366    H    MET  53           HN       MET  53 -11.121  -5.324  -2.633
  367    HA   MET  53           HA       MET  53 -12.655  -4.915  -5.099
  368    HB2  MET  53           HB2      MET  53  -9.723  -5.424  -4.599
  369    HB3  MET  53           HB1      MET  53 -10.435  -5.541  -6.203
  370    HG2  MET  53           HG2      MET  53 -11.082  -3.226  -6.141
  371    HG3  MET  53           HG1      MET  53 -10.532  -3.082  -4.473
  372    HE1  MET  53           HE1      MET  53  -7.712  -3.734  -8.076
  373    HE2  MET  53           HE2      MET  53  -9.467  -3.619  -8.204
  374    HE3  MET  53           HE3      MET  53  -8.729  -5.018  -7.425
  375    H    LYS  54           HN       LYS  54 -11.882  -7.247  -2.833
  376    HA   LYS  54           HA       LYS  54 -11.805  -9.628  -4.241
  377    HB2  LYS  54           HB2      LYS  54 -11.650  -9.345  -1.733
  378    HB3  LYS  54           HB1      LYS  54 -13.398  -9.158  -1.711
  379    HG2  LYS  54           HG2      LYS  54 -12.975 -11.394  -1.130
  380    HG3  LYS  54           HG1      LYS  54 -13.530 -11.433  -2.803
  381    HD2  LYS  54           HD2      LYS  54 -11.656 -12.916  -2.597
  382    HD3  LYS  54           HD1      LYS  54 -11.141 -11.504  -3.522
  383    HE2  LYS  54           HE2      LYS  54 -10.130 -10.557  -1.500
  384    HE3  LYS  54           HE1      LYS  54 -10.645 -11.969  -0.580
  385    HZ1  LYS  54           HZ1      LYS  54  -8.355 -12.198  -1.202
  386    HZ2  LYS  54           HZ2      LYS  54  -8.714 -11.938  -2.832
  387    HZ3  LYS  54           HZ3      LYS  54  -9.264 -13.336  -2.060
  388    H    GLU  55           HN       GLU  55 -14.627  -7.761  -3.182
  389    HA   GLU  55           HA       GLU  55 -16.515  -9.368  -4.583
  390    HB2  GLU  55           HB2      GLU  55 -17.144  -8.009  -2.633
  391    HB3  GLU  55           HB1      GLU  55 -16.770  -6.546  -3.530
  392    HG2  GLU  55           HG2      GLU  55 -18.542  -7.104  -5.137
  393    HG3  GLU  55           HG1      GLU  55 -18.935  -8.531  -4.179
  394    H    SER  56           HN       SER  56 -15.624  -9.505  -6.664
  395    HA   SER  56           HA       SER  56 -15.434  -7.059  -8.233
  396    HB2  SER  56           HB2      SER  56 -14.903  -9.918  -9.083
  397    HB3  SER  56           HB1      SER  56 -14.449  -8.453  -9.955
  398    HG   SER  56           HG       SER  56 -13.571  -8.666  -7.323
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1   9.485  -1.545  13.521
    2    H2   GLY   1           HT2      GLY   1   8.473  -2.589  14.382
    3    H3   GLY   1           HT3      GLY   1   8.411  -2.553  12.693
    4    HA2  GLY   1           HA1      GLY   1  10.709  -3.462  14.326
    5    HA3  GLY   1           HA2      GLY   1   9.594  -4.505  13.456
    6    H    ALA   2           HN       ALA   2  12.490  -2.803  13.307
    7    HA   ALA   2           HA       ALA   2  12.532  -2.303  10.488
    8    HB1  ALA   2           HB1      ALA   2  13.851  -0.980  12.109
    9    HB2  ALA   2           HB2      ALA   2  14.834  -1.655  10.809
   10    HB3  ALA   2           HB3      ALA   2  14.855  -2.399  12.408
   11    H    MET   3           HN       MET   3  13.263  -5.003  12.504
   12    HA   MET   3           HA       MET   3  14.741  -6.330  10.351
   13    HB2  MET   3           HB2      MET   3  14.325  -7.068  13.251
   14    HB3  MET   3           HB1      MET   3  15.123  -8.119  12.090
   15    HG2  MET   3           HG2      MET   3  16.842  -6.439  11.722
   16    HG3  MET   3           HG1      MET   3  16.032  -5.351  12.846
   17    HE1  MET   3           HE1      MET   3  16.485  -9.268  13.207
   18    HE2  MET   3           HE2      MET   3  18.014  -9.334  14.082
   19    HE3  MET   3           HE3      MET   3  17.971  -8.725  12.427
   20    H    GLY   4           HN       GLY   4  12.464  -6.157   9.310
   21    HA2  GLY   4           HA2      GLY   4  11.218  -8.784   9.683
   22    HA3  GLY   4           HA1      GLY   4  10.192  -7.357   9.745
   23    H    MET   5           HN       MET   5   9.258  -8.758   7.932
   24    HA   MET   5           HA       MET   5  10.636  -8.716   5.414
   25    HB2  MET   5           HB2      MET   5   9.064 -10.523   5.982
   26    HB3  MET   5           HB1      MET   5   7.753  -9.358   6.076
   27    HG2  MET   5           HG2      MET   5   8.065  -8.847   3.690
   28    HG3  MET   5           HG1      MET   5   9.324 -10.077   3.610
   29    HE1  MET   5           HE1      MET   5   5.521  -9.381   4.280
   30    HE2  MET   5           HE2      MET   5   6.006 -10.278   5.719
   31    HE3  MET   5           HE3      MET   5   4.904 -11.010   4.555
   32    H    ARG   6           HN       ARG   6  11.059  -6.485   5.149
   33    HA   ARG   6           HA       ARG   6   8.722  -4.988   4.166
   34    HB2  ARG   6           HB2      ARG   6  11.038  -3.685   5.591
   35    HB3  ARG   6           HB1      ARG   6   9.515  -2.951   5.121
   36    HG2  ARG   6           HG2      ARG   6   8.346  -4.288   6.793
   37    HG3  ARG   6           HG1      ARG   6   9.876  -5.044   7.254
   38    HD2  ARG   6           HD2      ARG   6   9.091  -2.148   7.531
   39    HD3  ARG   6           HD1      ARG   6   9.447  -3.297   8.823
   40    HE   ARG   6           HE       ARG   6  11.722  -3.164   7.253
   41   HH11  ARG   6          HH11      ARG   6   9.836  -0.967   9.213
   42   HH12  ARG   6          HH12      ARG   6  11.187   0.051   9.589
   43   HH21  ARG   6          HH21      ARG   6  13.490  -1.806   7.713
   44   HH22  ARG   6          HH22      ARG   6  13.256  -0.415   8.725
   45    H    ASN   7           HN       ASN   7   9.181  -5.281   1.996
   46    HA   ASN   7           HA       ASN   7  11.852  -4.554   1.064
   47    HB2  ASN   7           HB2      ASN   7  10.736  -6.539   0.063
   48    HB3  ASN   7           HB1      ASN   7   9.482  -5.476  -0.572
   49   HD21  ASN   7          HD21      ASN   7   9.955  -5.965  -2.722
   50   HD22  ASN   7          HD22      ASN   7  11.396  -5.405  -3.504
   51    H    LEU   8           HN       LEU   8  11.368  -2.390   1.974
   52    HA   LEU   8           HA       LEU   8   9.724  -0.759   0.185
   53    HB2  LEU   8           HB2      LEU   8   9.596   0.894   1.880
   54    HB3  LEU   8           HB1      LEU   8   9.301  -0.646   2.656
   55    HG   LEU   8           HG       LEU   8  11.920   0.863   2.755
   56   HD11  LEU   8          HD11      LEU   8  10.199   2.073   3.943
   57   HD12  LEU   8          HD12      LEU   8  11.301   1.317   5.094
   58   HD13  LEU   8          HD13      LEU   8   9.715   0.606   4.793
   59   HD21  LEU   8          HD21      LEU   8  12.430  -0.711   4.604
   60   HD22  LEU   8          HD22      LEU   8  12.294  -1.495   3.031
   61   HD23  LEU   8          HD23      LEU   8  10.971  -1.612   4.191
   62    H    ASP   9           HN       ASP   9  12.675  -1.816   0.167
   63    HA   ASP   9           HA       ASP   9  14.258   0.552  -0.035
   64    HB2  ASP   9           HB2      ASP   9  14.778  -2.278  -0.966
   65    HB3  ASP   9           HB1      ASP   9  15.970  -0.983  -1.013
   66    H    GLU  10           HN       GLU  10  12.389  -1.395  -2.209
   67    HA   GLU  10           HA       GLU  10  13.275   0.109  -4.540
   68    HB2  GLU  10           HB2      GLU  10  11.208  -2.086  -4.304
   69    HB3  GLU  10           HB1      GLU  10  11.776  -1.376  -5.807
   70    HG2  GLU  10           HG2      GLU  10  14.015  -2.224  -5.384
   71    HG3  GLU  10           HG1      GLU  10  13.474  -2.910  -3.852
   72    H    CYS  11           HN       CYS  11  11.251   0.694  -2.091
   73    HA   CYS  11           HA       CYS  11   9.147   1.891  -3.741
   74    HB2  CYS  11           HB2      CYS  11   8.443   0.256  -2.006
   75    HB3  CYS  11           HB1      CYS  11   9.107   1.325  -0.780
   76    H    GLU  12           HN       GLU  12  10.032   3.840  -4.274
   77    HA   GLU  12           HA       GLU  12  11.431   5.520  -2.485
   78    HB2  GLU  12           HB2      GLU  12  10.027   6.033  -5.093
   79    HB3  GLU  12           HB1      GLU  12  10.769   7.335  -4.174
   80    HG2  GLU  12           HG2      GLU  12  12.188   4.901  -5.228
   81    HG3  GLU  12           HG1      GLU  12  12.244   6.519  -5.926
   82    H    VAL  13           HN       VAL  13   8.065   4.915  -2.991
   83    HA   VAL  13           HA       VAL  13   7.141   7.379  -1.923
   84    HB   VAL  13           HB       VAL  13   5.703   4.744  -2.189
   85   HG11  VAL  13          HG11      VAL  13   4.750   7.513  -1.510
   86   HG12  VAL  13          HG12      VAL  13   4.506   6.015  -0.608
   87   HG13  VAL  13          HG13      VAL  13   3.675   6.267  -2.140
   88   HG21  VAL  13          HG21      VAL  13   5.735   7.177  -3.966
   89   HG22  VAL  13          HG22      VAL  13   4.731   5.746  -4.199
   90   HG23  VAL  13          HG23      VAL  13   6.486   5.622  -4.319
   91    H    CYS  14           HN       CYS  14   7.462   4.096  -0.538
   92    HA   CYS  14           HA       CYS  14   6.717   4.811   2.090
   93    HB2  CYS  14           HB2      CYS  14   8.346   2.596   0.929
   94    HB3  CYS  14           HB1      CYS  14   8.389   2.852   2.668
   95    H    ARG  15           HN       ARG  15   9.663   5.095   0.301
   96    HA   ARG  15           HA       ARG  15  11.410   5.678   2.448
   97    HB2  ARG  15           HB2      ARG  15  12.143   4.921   0.222
   98    HB3  ARG  15           HB1      ARG  15  11.580   6.432  -0.470
   99    HG2  ARG  15           HG2      ARG  15  13.243   7.654   0.804
  100    HG3  ARG  15           HG1      ARG  15  13.801   6.147   1.539
  101    HD2  ARG  15           HD2      ARG  15  14.386   5.289  -0.673
  102    HD3  ARG  15           HD1      ARG  15  13.824   6.789  -1.407
  103    HE   ARG  15           HE       ARG  15  15.764   7.393   0.523
  104   HH11  ARG  15          HH11      ARG  15  15.469   5.910  -2.644
  105   HH12  ARG  15          HH12      ARG  15  17.111   6.275  -3.093
  106   HH21  ARG  15          HH21      ARG  15  17.897   7.880  -0.074
  107   HH22  ARG  15          HH22      ARG  15  18.484   7.406  -1.639
  108    H    ASP  16           HN       ASP  16   9.508   7.706   0.260
  109    HA   ASP  16           HA       ASP  16  10.231  10.137   1.587
  110    HB2  ASP  16           HB2      ASP  16   8.232   9.418  -0.528
  111    HB3  ASP  16           HB1      ASP  16   8.157  10.996   0.249
  112    H    GLY  17           HN       GLY  17   8.474   7.685   2.749
  113    HA2  GLY  17           HA2      GLY  17   7.264   7.649   4.743
  114    HA3  GLY  17           HA1      GLY  17   7.176   9.404   4.687
  115    H    GLY  18           HN       GLY  18   6.224   7.480   1.969
  116    HA2  GLY  18           HA2      GLY  18   3.645   8.534   1.762
  117    HA3  GLY  18           HA1      GLY  18   4.204   7.076   0.969
  118    H    GLU  19           HN       GLU  19   1.611   7.377   1.807
  119    HA   GLU  19           HA       GLU  19   1.371   5.884   4.317
  120    HB2  GLU  19           HB2      GLU  19  -0.576   7.529   2.712
  121    HB3  GLU  19           HB1      GLU  19  -1.074   6.534   4.074
  122    HG2  GLU  19           HG2      GLU  19   1.081   8.589   4.383
  123    HG3  GLU  19           HG1      GLU  19  -0.621   9.047   4.447
  124    H    LEU  20           HN       LEU  20   0.220   3.985   4.452
  125    HA   LEU  20           HA       LEU  20  -0.282   2.612   1.906
  126    HB2  LEU  20           HB2      LEU  20   0.418   1.638   4.654
  127    HB3  LEU  20           HB1      LEU  20  -0.337   0.565   3.494
  128    HG   LEU  20           HG       LEU  20   2.254   2.015   2.940
  129   HD11  LEU  20          HD11      LEU  20   2.538   0.559   4.883
  130   HD12  LEU  20          HD12      LEU  20   3.375  -0.092   3.473
  131   HD13  LEU  20          HD13      LEU  20   1.836  -0.786   3.984
  132   HD21  LEU  20          HD21      LEU  20   2.502   0.230   1.243
  133   HD22  LEU  20          HD22      LEU  20   1.102   1.260   0.946
  134   HD23  LEU  20          HD23      LEU  20   0.884  -0.345   1.643
  135    H    PHE  21           HN       PHE  21  -2.312   2.141   1.340
  136    HA   PHE  21           HA       PHE  21  -4.415   2.451   3.386
  137    HB2  PHE  21           HB2      PHE  21  -4.728   2.637   0.375
  138    HB3  PHE  21           HB1      PHE  21  -5.945   3.033   1.588
  139    HD1  PHE  21           HD1      PHE  21  -5.232   4.908   3.301
  140    HD2  PHE  21           HD2      PHE  21  -3.477   4.351  -0.546
  141    HE1  PHE  21           HE1      PHE  21  -4.466   7.242   3.312
  142    HE2  PHE  21           HE2      PHE  21  -2.712   6.684  -0.532
  143    HZ   PHE  21           HZ       PHE  21  -3.178   8.126   1.401
  144    H    CYS  22           HN       CYS  22  -2.879   0.089   3.048
  145    HA   CYS  22           HA       CYS  22  -4.916  -1.784   2.055
  146    HB2  CYS  22           HB2      CYS  22  -1.912  -2.046   1.707
  147    HB3  CYS  22           HB1      CYS  22  -3.126  -3.189   1.131
  148    H    CYS  23           HN       CYS  23  -4.871  -3.879   3.099
  149    HA   CYS  23           HA       CYS  23  -3.982  -3.747   5.844
  150    HB2  CYS  23           HB2      CYS  23  -5.196  -5.771   6.191
  151    HB3  CYS  23           HB1      CYS  23  -6.172  -4.825   5.071
  152    H    ASP  24           HN       ASP  24  -2.776  -5.722   6.729
  153    HA   ASP  24           HA       ASP  24  -0.197  -5.649   5.776
  154    HB2  ASP  24           HB2      ASP  24  -1.518  -7.871   7.335
  155    HB3  ASP  24           HB1      ASP  24   0.221  -7.684   7.137
  156    H    THR  25           HN       THR  25  -2.678  -8.031   5.011
  157    HA   THR  25           HA       THR  25  -1.030  -9.782   3.542
  158    HB   THR  25           HB       THR  25  -3.998  -9.368   3.199
  159    HG1  THR  25           HG1      THR  25  -2.581 -11.029   5.039
  160   HG21  THR  25          HG21      THR  25  -2.969 -10.784   1.487
  161   HG22  THR  25          HG22      THR  25  -3.997 -11.734   2.560
  162   HG23  THR  25          HG23      THR  25  -2.244 -11.784   2.746
  163    H    CYS  26           HN       CYS  26  -3.262  -7.206   2.447
  164    HA   CYS  26           HA       CYS  26  -2.671  -7.678  -0.302
  165    HB2  CYS  26           HB2      CYS  26  -3.989  -5.298   1.004
  166    HB3  CYS  26           HB1      CYS  26  -3.921  -5.582  -0.728
  167    H    SER  27           HN       SER  27  -1.352  -5.503   2.136
  168    HA   SER  27           HA       SER  27   0.117  -3.850   0.374
  169    HB2  SER  27           HB2      SER  27   0.759  -4.614   3.233
  170    HB3  SER  27           HB1      SER  27   1.423  -3.237   2.354
  171    HG   SER  27           HG       SER  27  -0.270  -2.499   3.584
  172    H    ARG  28           HN       ARG  28   0.696  -7.006   1.746
  173    HA   ARG  28           HA       ARG  28   3.437  -7.204   1.041
  174    HB2  ARG  28           HB2      ARG  28   2.459  -8.621   2.759
  175    HB3  ARG  28           HB1      ARG  28   1.351  -9.323   1.590
  176    HG2  ARG  28           HG2      ARG  28   3.282 -10.271   0.383
  177    HG3  ARG  28           HG1      ARG  28   4.343  -9.640   1.643
  178    HD2  ARG  28           HD2      ARG  28   3.116 -10.974   3.311
  179    HD3  ARG  28           HD1      ARG  28   2.113 -11.636   2.022
  180    HE   ARG  28           HE       ARG  28   4.622 -12.216   1.200
  181   HH11  ARG  28          HH11      ARG  28   2.886 -12.793   4.184
  182   HH12  ARG  28          HH12      ARG  28   3.793 -14.217   4.587
  183   HH21  ARG  28          HH21      ARG  28   5.820 -14.089   1.725
  184   HH22  ARG  28          HH22      ARG  28   5.457 -14.960   3.180
  185    H    VAL  29           HN       VAL  29   0.436  -7.885  -0.632
  186    HA   VAL  29           HA       VAL  29   1.840  -9.253  -2.787
  187    HB   VAL  29           HB       VAL  29  -1.121  -8.721  -2.513
  188   HG11  VAL  29          HG11      VAL  29  -1.370 -10.470  -4.198
  189   HG12  VAL  29          HG12      VAL  29   0.381 -10.626  -4.305
  190   HG13  VAL  29          HG13      VAL  29  -0.402  -9.132  -4.817
  191   HG21  VAL  29          HG21      VAL  29  -1.249 -11.115  -1.864
  192   HG22  VAL  29          HG22      VAL  29  -0.414 -10.108  -0.683
  193   HG23  VAL  29          HG23      VAL  29   0.512 -11.143  -1.771
  194    H    PHE  30           HN       PHE  30  -0.103  -6.331  -2.277
  195    HA   PHE  30           HA       PHE  30   0.657  -5.447  -4.983
  196    HB2  PHE  30           HB2      PHE  30  -1.824  -4.677  -3.422
  197    HB3  PHE  30           HB1      PHE  30  -1.406  -4.119  -5.035
  198    HD1  PHE  30           HD1      PHE  30  -1.055  -6.026  -6.803
  199    HD2  PHE  30           HD2      PHE  30  -3.287  -6.456  -3.202
  200    HE1  PHE  30           HE1      PHE  30  -2.270  -7.919  -7.788
  201    HE2  PHE  30           HE2      PHE  30  -4.501  -8.353  -4.182
  202    HZ   PHE  30           HZ       PHE  30  -4.046  -9.076  -6.432
  203    H    HIS  31           HN       HIS  31   2.475  -4.944  -3.059
  204    HA   HIS  31           HA       HIS  31   2.103  -2.639  -1.513
  205    HB2  HIS  31           HB2      HIS  31   3.982  -4.293  -1.292
  206    HB3  HIS  31           HB1      HIS  31   4.710  -3.573  -2.722
  207    HD1  HIS  31           HD1      HIS  31   3.772  -2.613   0.841
  208    HD2  HIS  31           HD2      HIS  31   6.295  -1.435  -2.239
  209    HE1  HIS  31           HE1      HIS  31   5.341  -0.871   1.829
  210    H    GLU  32           HN       GLU  32   3.469  -3.015  -4.765
  211    HA   GLU  32           HA       GLU  32   4.169  -0.315  -5.149
  212    HB2  GLU  32           HB2      GLU  32   3.500  -2.483  -7.143
  213    HB3  GLU  32           HB1      GLU  32   4.156  -0.915  -7.584
  214    HG2  GLU  32           HG2      GLU  32   5.563  -2.728  -5.661
  215    HG3  GLU  32           HG1      GLU  32   5.772  -2.876  -7.404
  216    H    ASP  33           HN       ASP  33   1.288  -2.156  -5.966
  217    HA   ASP  33           HA       ASP  33  -0.067  -0.019  -7.272
  218    HB2  ASP  33           HB2      ASP  33  -0.951  -2.686  -6.214
  219    HB3  ASP  33           HB1      ASP  33  -2.124  -1.526  -6.825
  220    H    CYS  34           HN       CYS  34   0.293  -0.971  -3.974
  221    HA   CYS  34           HA       CYS  34  -1.994   0.367  -2.940
  222    HB2  CYS  34           HB2      CYS  34  -0.507  -1.413  -1.767
  223    HB3  CYS  34           HB1      CYS  34   0.560  -0.062  -1.392
  224    H    HIS  35           HN       HIS  35   1.090   1.418  -4.034
  225    HA   HIS  35           HA       HIS  35   0.740   4.043  -2.767
  226    HB2  HIS  35           HB2      HIS  35   3.138   2.874  -4.189
  227    HB3  HIS  35           HB1      HIS  35   3.079   4.459  -3.427
  228    HD1  HIS  35           HD1      HIS  35   3.007   4.461  -0.747
  229    HD2  HIS  35           HD2      HIS  35   3.536   0.755  -2.549
  230    HE1  HIS  35           HE1      HIS  35   3.872   2.906   1.056
  231    H    ILE  36           HN       ILE  36   0.621   2.377  -5.766
  232    HA   ILE  36           HA       ILE  36   0.166   4.903  -7.189
  233    HB   ILE  36           HB       ILE  36   1.706   2.564  -8.319
  234   HG12  ILE  36          HG12      ILE  36   2.760   5.252  -7.413
  235   HG13  ILE  36          HG11      ILE  36   2.963   3.742  -6.533
  236   HG21  ILE  36          HG21      ILE  36   2.214   4.086 -10.165
  237   HG22  ILE  36          HG22      ILE  36   1.234   5.340  -9.405
  238   HG23  ILE  36          HG23      ILE  36   0.475   3.858  -9.984
  239   HD11  ILE  36          HD11      ILE  36   4.270   2.832  -8.374
  240   HD12  ILE  36          HD12      ILE  36   4.968   4.342  -7.785
  241   HD13  ILE  36          HD13      ILE  36   4.040   4.325  -9.285
  242    HA   PRO  37           HA       PRO  37  -1.265   5.799  -7.756
  243    HB2  PRO  37           HB2      PRO  37  -4.003   6.188  -8.374
  244    HB3  PRO  37           HB1      PRO  37  -2.626   6.477  -9.448
  245    HG2  PRO  37           HG2      PRO  37  -4.590   4.528  -9.812
  246    HG3  PRO  37           HG1      PRO  37  -2.999   4.548 -10.597
  247    HD2  PRO  37           HD2      PRO  37  -3.903   3.031  -8.172
  248    HD3  PRO  37           HD1      PRO  37  -2.836   2.507  -9.498
  249    HA   PRO  38           HA       PRO  38  -3.088   5.677  -3.671
  250    HB2  PRO  38           HB2      PRO  38  -2.651   8.522  -3.400
  251    HB3  PRO  38           HB1      PRO  38  -1.781   7.195  -2.628
  252    HG2  PRO  38           HG2      PRO  38  -0.682   8.837  -4.529
  253    HG3  PRO  38           HG1      PRO  38  -0.137   7.179  -4.210
  254    HD2  PRO  38           HD2      PRO  38  -1.893   8.211  -6.411
  255    HD3  PRO  38           HD1      PRO  38  -0.646   6.943  -6.454
  256    H    VAL  39           HN       VAL  39  -5.159   5.854  -3.017
  257    HA   VAL  39           HA       VAL  39  -7.029   7.491  -4.470
  258    HB   VAL  39           HB       VAL  39  -8.723   6.623  -2.939
  259   HG11  VAL  39          HG11      VAL  39  -8.553   4.250  -3.485
  260   HG12  VAL  39          HG12      VAL  39  -6.857   4.475  -3.913
  261   HG13  VAL  39          HG13      VAL  39  -8.116   5.268  -4.858
  262   HG21  VAL  39          HG21      VAL  39  -7.465   6.601  -0.880
  263   HG22  VAL  39          HG22      VAL  39  -6.425   5.317  -1.499
  264   HG23  VAL  39          HG23      VAL  39  -8.134   5.000  -1.191
  265    H    GLU  40           HN       GLU  40  -8.215   9.275  -3.594
  266    HA   GLU  40           HA       GLU  40  -6.832  10.546  -1.330
  267    HB2  GLU  40           HB2      GLU  40  -7.940  11.940  -3.768
  268    HB3  GLU  40           HB1      GLU  40  -7.112  12.709  -2.421
  269    HG2  GLU  40           HG2      GLU  40  -5.096  11.338  -2.997
  270    HG3  GLU  40           HG1      GLU  40  -5.946  10.819  -4.451
  271    H    ALA  41           HN       ALA  41  -9.879   9.836  -2.810
  272    HA   ALA  41           HA       ALA  41 -11.363  11.693  -1.184
  273    HB1  ALA  41           HB1      ALA  41 -12.393   9.431  -2.889
  274    HB2  ALA  41           HB2      ALA  41 -12.141  11.088  -3.435
  275    HB3  ALA  41           HB3      ALA  41 -13.348  10.741  -2.196
  276    H    GLU  42           HN       GLU  42 -10.648   8.259  -1.172
  277    HA   GLU  42           HA       GLU  42 -11.807   8.097   1.530
  278    HB2  GLU  42           HB2      GLU  42 -11.760   5.939  -0.589
  279    HB3  GLU  42           HB1      GLU  42 -12.345   5.735   1.055
  280    HG2  GLU  42           HG2      GLU  42 -14.106   7.355   0.653
  281    HG3  GLU  42           HG1      GLU  42 -13.508   7.611  -0.986
  282    H    ARG  43           HN       ARG  43  -9.270   8.891   1.242
  283    HA   ARG  43           HA       ARG  43  -7.433   6.680   1.229
  284    HB2  ARG  43           HB2      ARG  43  -5.741   8.445   1.803
  285    HB3  ARG  43           HB1      ARG  43  -6.605   8.689   0.294
  286    HG2  ARG  43           HG2      ARG  43  -7.885  10.442   1.183
  287    HG3  ARG  43           HG1      ARG  43  -7.446  10.029   2.842
  288    HD2  ARG  43           HD2      ARG  43  -5.515  11.008   0.742
  289    HD3  ARG  43           HD1      ARG  43  -6.259  12.030   1.971
  290    HE   ARG  43           HE       ARG  43  -5.100  10.068   3.425
  291   HH11  ARG  43          HH11      ARG  43  -3.890  12.209   0.930
  292   HH12  ARG  43          HH12      ARG  43  -2.278  12.245   1.570
  293   HH21  ARG  43          HH21      ARG  43  -2.974  10.127   4.273
  294   HH22  ARG  43          HH22      ARG  43  -1.757  11.060   3.457
  295    H    THR  44           HN       THR  44  -8.549   5.569   2.975
  296    HA   THR  44           HA       THR  44  -7.863   6.603   5.638
  297    HB   THR  44           HB       THR  44  -9.530   4.961   6.485
  298    HG1  THR  44           HG1      THR  44  -9.306   3.621   4.485
  299   HG21  THR  44          HG21      THR  44 -11.521   6.155   5.698
  300   HG22  THR  44          HG22      THR  44 -10.589   6.838   4.365
  301   HG23  THR  44          HG23      THR  44 -10.202   7.279   6.028
  302    HA   PRO  45           HA       PRO  45  -4.649   3.419   5.267
  303    HB2  PRO  45           HB2      PRO  45  -3.834   4.481   7.895
  304    HB3  PRO  45           HB1      PRO  45  -2.904   4.346   6.397
  305    HG2  PRO  45           HG2      PRO  45  -3.748   6.724   7.305
  306    HG3  PRO  45           HG1      PRO  45  -3.692   6.357   5.570
  307    HD2  PRO  45           HD2      PRO  45  -6.051   6.374   7.428
  308    HD3  PRO  45           HD1      PRO  45  -5.924   6.987   5.762
  309    H    TRP  46           HN       TRP  46  -6.931   3.930   7.836
  310    HA   TRP  46           HA       TRP  46  -6.236   1.423   9.150
  311    HB2  TRP  46           HB2      TRP  46  -8.038   2.031  10.761
  312    HB3  TRP  46           HB1      TRP  46  -6.786   3.258  10.628
  313    HD1  TRP  46           HD1      TRP  46 -10.485   2.659   9.894
  314    HE1  TRP  46           HE1      TRP  46 -11.609   4.917   9.393
  315    HE3  TRP  46           HE3      TRP  46  -6.311   5.610   9.671
  316    HZ2  TRP  46           HZ2      TRP  46 -10.830   7.593   8.963
  317    HZ3  TRP  46           HZ3      TRP  46  -6.593   8.012   9.209
  318    HH2  TRP  46           HH2      TRP  46  -8.799   8.978   8.859
  319    H    ASN  47           HN       ASN  47  -7.459   1.700   6.399
  320    HA   ASN  47           HA       ASN  47  -9.385  -0.454   6.725
  321    HB2  ASN  47           HB2      ASN  47 -10.785   1.593   6.702
  322    HB3  ASN  47           HB1      ASN  47 -10.035   2.083   5.190
  323   HD21  ASN  47          HD21      ASN  47 -12.248  -0.161   6.692
  324   HD22  ASN  47          HD22      ASN  47 -12.978  -0.719   5.224
  325    H    CYS  48           HN       CYS  48  -9.305  -1.881   4.973
  326    HA   CYS  48           HA       CYS  48  -7.155  -1.315   3.090
  327    HB2  CYS  48           HB2      CYS  48  -7.199  -3.504   4.274
  328    HB3  CYS  48           HB1      CYS  48  -8.723  -3.881   3.478
  329    H    ILE  49           HN       ILE  49  -7.565  -0.539   1.144
  330    HA   ILE  49           HA       ILE  49 -10.262  -0.490   0.136
  331    HB   ILE  49           HB       ILE  49  -9.231   0.648  -1.868
  332   HG12  ILE  49          HG12      ILE  49  -6.763   0.750  -0.135
  333   HG13  ILE  49          HG11      ILE  49  -6.939  -0.326  -1.519
  334   HG21  ILE  49          HG21      ILE  49  -8.789   1.856   0.860
  335   HG22  ILE  49          HG22      ILE  49 -10.268   1.925  -0.098
  336   HG23  ILE  49          HG23      ILE  49  -8.817   2.759  -0.653
  337   HD11  ILE  49          HD11      ILE  49  -5.658   1.658  -2.092
  338   HD12  ILE  49          HD12      ILE  49  -7.003   2.684  -1.591
  339   HD13  ILE  49          HD13      ILE  49  -7.180   1.617  -2.983
  340    H    PHE  50           HN       PHE  50  -7.487  -2.507  -0.296
  341    HA   PHE  50           HA       PHE  50  -8.276  -3.444  -2.904
  342    HB2  PHE  50           HB2      PHE  50  -6.061  -4.162  -1.024
  343    HB3  PHE  50           HB1      PHE  50  -6.491  -5.278  -2.320
  344    HD1  PHE  50           HD2      PHE  50  -5.272  -1.894  -1.556
  345    HD2  PHE  50           HD1      PHE  50  -5.959  -4.799  -4.586
  346    HE1  PHE  50           HE2      PHE  50  -3.923  -0.569  -3.125
  347    HE2  PHE  50           HE1      PHE  50  -4.607  -3.480  -6.161
  348    HZ   PHE  50           HZ       PHE  50  -3.644  -1.353  -5.469
  349    H    CYS  51           HN       CYS  51  -8.649  -4.558   0.414
  350    HA   CYS  51           HA       CYS  51  -9.703  -7.106  -0.222
  351    HB2  CYS  51           HB2      CYS  51  -9.843  -5.330   2.193
  352    HB3  CYS  51           HB1      CYS  51 -10.914  -6.720   2.095
  353    H    ARG  52           HN       ARG  52 -11.240  -3.980   0.396
  354    HA   ARG  52           HA       ARG  52 -13.860  -4.918  -0.215
  355    HB2  ARG  52           HB2      ARG  52 -13.683  -3.145   1.336
  356    HB3  ARG  52           HB1      ARG  52 -12.633  -2.218   0.282
  357    HG2  ARG  52           HG2      ARG  52 -14.437  -1.634  -1.138
  358    HG3  ARG  52           HG1      ARG  52 -15.520  -2.779  -0.338
  359    HD2  ARG  52           HD2      ARG  52 -15.727  -0.300   0.288
  360    HD3  ARG  52           HD1      ARG  52 -15.656  -1.477   1.597
  361    HE   ARG  52           HE       ARG  52 -13.522  -0.724   2.153
  362   HH11  ARG  52          HH11      ARG  52 -14.746   0.953  -0.668
  363   HH12  ARG  52          HH12      ARG  52 -13.580   2.231  -0.566
  364   HH21  ARG  52          HH21      ARG  52 -11.996   0.956   2.296
  365   HH22  ARG  52          HH22      ARG  52 -12.023   2.240   1.124
  366    H    MET  53           HN       MET  53 -11.223  -4.065  -2.117
  367    HA   MET  53           HA       MET  53 -12.622  -2.907  -4.339
  368    HB2  MET  53           HB2      MET  53 -10.175  -2.561  -3.905
  369    HB3  MET  53           HB1      MET  53  -9.906  -4.237  -4.364
  370    HG2  MET  53           HG2      MET  53  -9.404  -2.699  -6.187
  371    HG3  MET  53           HG1      MET  53 -10.728  -3.791  -6.593
  372    HE1  MET  53           HE1      MET  53 -11.583  -0.422  -8.457
  373    HE2  MET  53           HE2      MET  53 -11.259  -2.143  -8.655
  374    HE3  MET  53           HE3      MET  53  -9.971  -1.056  -8.138
  375    H    LYS  54           HN       LYS  54 -11.620  -6.100  -3.372
  376    HA   LYS  54           HA       LYS  54 -12.938  -7.228  -5.745
  377    HB2  LYS  54           HB2      LYS  54 -10.839  -8.370  -3.897
  378    HB3  LYS  54           HB1      LYS  54 -11.756  -9.377  -5.007
  379    HG2  LYS  54           HG2      LYS  54 -10.006  -7.056  -5.821
  380    HG3  LYS  54           HG1      LYS  54  -9.555  -8.761  -5.894
  381    HD2  LYS  54           HD2      LYS  54 -11.352  -9.191  -7.475
  382    HD3  LYS  54           HD1      LYS  54 -11.880  -7.513  -7.359
  383    HE2  LYS  54           HE2      LYS  54 -10.579  -7.879  -9.382
  384    HE3  LYS  54           HE1      LYS  54  -9.754  -6.771  -8.290
  385    HZ1  LYS  54           HZ1      LYS  54  -8.315  -8.551  -7.584
  386    HZ2  LYS  54           HZ2      LYS  54  -8.255  -8.413  -9.266
  387    HZ3  LYS  54           HZ3      LYS  54  -9.142  -9.662  -8.557
  388    H    GLU  55           HN       GLU  55 -14.639  -6.242  -4.042
  389    HA   GLU  55           HA       GLU  55 -15.648  -8.529  -2.490
  390    HB2  GLU  55           HB2      GLU  55 -14.812  -6.725  -1.025
  391    HB3  GLU  55           HB1      GLU  55 -15.890  -5.588  -1.818
  392    HG2  GLU  55           HG2      GLU  55 -16.880  -6.201   0.240
  393    HG3  GLU  55           HG1      GLU  55 -17.802  -6.990  -1.041
  394    H    SER  56           HN       SER  56 -17.670  -9.154  -3.042
  395    HA   SER  56           HA       SER  56 -19.078  -7.591  -5.045
  396    HB2  SER  56           HB2      SER  56 -18.833 -10.098  -5.230
  397    HB3  SER  56           HB1      SER  56 -19.889 -10.245  -3.830
  398    HG   SER  56           HG       SER  56 -21.303  -8.781  -5.286
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1  13.473  -3.174  13.885
    2    H2   GLY   1           HT2      GLY   1  14.921  -3.334  13.029
    3    H3   GLY   1           HT3      GLY   1  13.838  -4.631  13.106
    4    HA2  GLY   1           HA1      GLY   1  12.201  -3.387  11.852
    5    HA3  GLY   1           HA2      GLY   1  13.316  -2.029  11.781
    6    H    ALA   2           HN       ALA   2  12.069  -3.728   9.677
    7    HA   ALA   2           HA       ALA   2  12.574  -4.660   7.676
    8    HB1  ALA   2           HB1      ALA   2  13.676  -2.498   7.382
    9    HB2  ALA   2           HB2      ALA   2  14.528  -3.779   6.520
   10    HB3  ALA   2           HB3      ALA   2  15.167  -3.169   8.047
   11    H    MET   3           HN       MET   3  12.655  -6.680   9.136
   12    HA   MET   3           HA       MET   3  15.142  -8.091   8.487
   13    HB2  MET   3           HB2      MET   3  13.819  -8.046  11.205
   14    HB3  MET   3           HB1      MET   3  14.960  -9.290  10.720
   15    HG2  MET   3           HG2      MET   3  16.706  -7.641  10.452
   16    HG3  MET   3           HG1      MET   3  15.573  -6.340  10.811
   17    HE1  MET   3           HE1      MET   3  16.882  -9.519  13.895
   18    HE2  MET   3           HE2      MET   3  17.418  -9.500  12.215
   19    HE3  MET   3           HE3      MET   3  15.737  -9.863  12.601
   20    H    GLY   4           HN       GLY   4  12.747  -8.139   7.080
   21    HA2  GLY   4           HA2      GLY   4  12.255 -10.908   6.915
   22    HA3  GLY   4           HA1      GLY   4  10.948 -10.154   7.813
   23    H    MET   5           HN       MET   5   9.403  -9.016   6.737
   24    HA   MET   5           HA       MET   5   9.736  -8.815   3.821
   25    HB2  MET   5           HB2      MET   5   7.237  -9.436   5.405
   26    HB3  MET   5           HB1      MET   5   7.243  -9.069   3.686
   27    HG2  MET   5           HG2      MET   5   8.620 -11.024   3.253
   28    HG3  MET   5           HG1      MET   5   8.680 -11.381   4.978
   29    HE1  MET   5           HE1      MET   5   6.405 -14.230   3.527
   30    HE2  MET   5           HE2      MET   5   7.856 -13.863   4.460
   31    HE3  MET   5           HE3      MET   5   7.792 -13.477   2.740
   32    H    ARG   6           HN       ARG   6  10.697  -6.740   4.819
   33    HA   ARG   6           HA       ARG   6   8.564  -4.706   4.908
   34    HB2  ARG   6           HB2      ARG   6  10.043  -5.032   6.990
   35    HB3  ARG   6           HB1      ARG   6  11.344  -4.357   6.024
   36    HG2  ARG   6           HG2      ARG   6  10.629  -2.472   7.062
   37    HG3  ARG   6           HG1      ARG   6   9.595  -2.425   5.635
   38    HD2  ARG   6           HD2      ARG   6   8.857  -3.416   8.385
   39    HD3  ARG   6           HD1      ARG   6   8.268  -1.962   7.592
   40    HE   ARG   6           HE       ARG   6   7.658  -4.685   6.631
   41   HH11  ARG   6          HH11      ARG   6   6.697  -1.380   7.316
   42   HH12  ARG   6          HH12      ARG   6   5.045  -1.637   6.859
   43   HH21  ARG   6          HH21      ARG   6   5.474  -5.019   6.043
   44   HH22  ARG   6          HH22      ARG   6   4.350  -3.700   6.134
   45    H    ASN   7           HN       ASN   7   9.221  -5.505   2.468
   46    HA   ASN   7           HA       ASN   7  11.529  -4.196   1.392
   47    HB2  ASN   7           HB2      ASN   7  10.671  -6.228   0.349
   48    HB3  ASN   7           HB1      ASN   7   9.159  -5.412  -0.028
   49   HD21  ASN   7          HD21      ASN   7   9.285  -5.588  -2.231
   50   HD22  ASN   7          HD22      ASN   7  10.494  -4.805  -3.184
   51    H    LEU   8           HN       LEU   8  11.181  -2.062   2.126
   52    HA   LEU   8           HA       LEU   8   9.444  -0.568   0.291
   53    HB2  LEU   8           HB2      LEU   8   9.358   1.209   2.078
   54    HB3  LEU   8           HB1      LEU   8   8.462  -0.256   2.412
   55    HG   LEU   8           HG       LEU   8  10.532  -0.979   3.771
   56   HD11  LEU   8          HD11      LEU   8  11.870   0.807   4.696
   57   HD12  LEU   8          HD12      LEU   8  11.016   1.993   3.710
   58   HD13  LEU   8          HD13      LEU   8  12.033   0.777   2.940
   59   HD21  LEU   8          HD21      LEU   8   8.802   1.301   4.713
   60   HD22  LEU   8          HD22      LEU   8   9.696   0.184   5.744
   61   HD23  LEU   8          HD23      LEU   8   8.372  -0.409   4.742
   62    H    ASP   9           HN       ASP   9  12.348  -1.494   0.501
   63    HA   ASP   9           HA       ASP   9  13.877   0.942   0.592
   64    HB2  ASP   9           HB2      ASP   9  14.827  -1.226   1.312
   65    HB3  ASP   9           HB1      ASP   9  14.697  -1.817  -0.338
   66    H    GLU  10           HN       GLU  10  12.418  -1.078  -1.806
   67    HA   GLU  10           HA       GLU  10  13.578   0.404  -4.028
   68    HB2  GLU  10           HB2      GLU  10  11.552  -1.842  -3.992
   69    HB3  GLU  10           HB1      GLU  10  12.310  -1.175  -5.430
   70    HG2  GLU  10           HG2      GLU  10  13.874  -2.422  -3.196
   71    HG3  GLU  10           HG1      GLU  10  13.262  -3.338  -4.571
   72    H    CYS  11           HN       CYS  11  11.241   1.002  -1.912
   73    HA   CYS  11           HA       CYS  11   9.296   2.051  -3.842
   74    HB2  CYS  11           HB2      CYS  11   8.558   0.383  -2.100
   75    HB3  CYS  11           HB1      CYS  11   8.918   1.597  -0.886
   76    H    GLU  12           HN       GLU  12  10.152   4.029  -4.320
   77    HA   GLU  12           HA       GLU  12  11.526   5.649  -2.461
   78    HB2  GLU  12           HB2      GLU  12  10.342   6.275  -5.157
   79    HB3  GLU  12           HB1      GLU  12  11.286   7.426  -4.223
   80    HG2  GLU  12           HG2      GLU  12  12.248   4.763  -5.248
   81    HG3  GLU  12           HG1      GLU  12  12.655   6.348  -5.903
   82    H    VAL  13           HN       VAL  13   8.156   5.357  -3.274
   83    HA   VAL  13           HA       VAL  13   7.399   7.826  -2.083
   84    HB   VAL  13           HB       VAL  13   5.930   6.774  -3.698
   85   HG11  VAL  13          HG11      VAL  13   4.649   4.777  -3.151
   86   HG12  VAL  13          HG12      VAL  13   5.576   4.594  -1.663
   87   HG13  VAL  13          HG13      VAL  13   6.377   4.449  -3.227
   88   HG21  VAL  13          HG21      VAL  13   4.674   6.877  -0.963
   89   HG22  VAL  13          HG22      VAL  13   3.816   6.977  -2.501
   90   HG23  VAL  13          HG23      VAL  13   4.939   8.255  -2.032
   91    H    CYS  14           HN       CYS  14   7.566   4.470  -0.900
   92    HA   CYS  14           HA       CYS  14   6.740   5.038   1.741
   93    HB2  CYS  14           HB2      CYS  14   8.239   2.834   0.438
   94    HB3  CYS  14           HB1      CYS  14   8.390   2.986   2.182
   95    H    ARG  15           HN       ARG  15   9.777   5.303   0.078
   96    HA   ARG  15           HA       ARG  15  11.465   5.826   2.275
   97    HB2  ARG  15           HB2      ARG  15  12.287   5.277   0.027
   98    HB3  ARG  15           HB1      ARG  15  11.630   6.785  -0.585
   99    HG2  ARG  15           HG2      ARG  15  13.188   8.034   0.811
  100    HG3  ARG  15           HG1      ARG  15  13.854   6.520   1.426
  101    HD2  ARG  15           HD2      ARG  15  14.468   5.894  -0.883
  102    HD3  ARG  15           HD1      ARG  15  13.872   7.456  -1.438
  103    HE   ARG  15           HE       ARG  15  15.760   7.937   0.554
  104   HH11  ARG  15          HH11      ARG  15  15.617   6.609  -2.688
  105   HH12  ARG  15          HH12      ARG  15  17.272   7.011  -3.055
  106   HH21  ARG  15          HH21      ARG  15  17.913   8.499   0.058
  107   HH22  ARG  15          HH22      ARG  15  18.573   8.089  -1.497
  108    H    ASP  16           HN       ASP  16   9.501   7.892   0.229
  109    HA   ASP  16           HA       ASP  16  10.125  10.322   1.549
  110    HB2  ASP  16           HB2      ASP  16   9.258  10.292  -0.716
  111    HB3  ASP  16           HB1      ASP  16   7.766   9.538  -0.173
  112    H    GLY  17           HN       GLY  17   8.244   7.688   2.487
  113    HA2  GLY  17           HA2      GLY  17   7.367   7.526   4.692
  114    HA3  GLY  17           HA1      GLY  17   7.121   9.268   4.689
  115    H    GLY  18           HN       GLY  18   6.165   7.461   1.909
  116    HA2  GLY  18           HA2      GLY  18   3.535   8.320   1.872
  117    HA3  GLY  18           HA1      GLY  18   4.131   6.907   1.023
  118    H    GLU  19           HN       GLU  19   1.559   7.282   2.166
  119    HA   GLU  19           HA       GLU  19   1.552   5.584   4.553
  120    HB2  GLU  19           HB2      GLU  19  -0.641   7.234   3.286
  121    HB3  GLU  19           HB1      GLU  19  -0.814   6.304   4.768
  122    HG2  GLU  19           HG2      GLU  19   0.939   7.720   5.802
  123    HG3  GLU  19           HG1      GLU  19   0.987   8.681   4.326
  124    H    LEU  20           HN       LEU  20   0.453   3.660   4.636
  125    HA   LEU  20           HA       LEU  20  -0.253   2.498   2.038
  126    HB2  LEU  20           HB2      LEU  20   0.630   1.329   4.649
  127    HB3  LEU  20           HB1      LEU  20  -0.215   0.340   3.475
  128    HG   LEU  20           HG       LEU  20   2.324   1.836   2.817
  129   HD11  LEU  20          HD11      LEU  20   2.784   0.280   4.633
  130   HD12  LEU  20          HD12      LEU  20   3.475  -0.308   3.122
  131   HD13  LEU  20          HD13      LEU  20   1.984  -1.015   3.743
  132   HD21  LEU  20          HD21      LEU  20   1.014   1.193   0.881
  133   HD22  LEU  20          HD22      LEU  20   0.858  -0.452   1.495
  134   HD23  LEU  20          HD23      LEU  20   2.435   0.157   0.999
  135    H    PHE  21           HN       PHE  21  -2.309   2.222   1.540
  136    HA   PHE  21           HA       PHE  21  -4.290   2.242   3.719
  137    HB2  PHE  21           HB2      PHE  21  -4.648   2.908   0.783
  138    HB3  PHE  21           HB1      PHE  21  -5.925   2.957   2.000
  139    HD1  PHE  21           HD1      PHE  21  -5.612   4.545   3.981
  140    HD2  PHE  21           HD2      PHE  21  -3.289   4.778   0.414
  141    HE1  PHE  21           HE1      PHE  21  -4.993   6.854   4.534
  142    HE2  PHE  21           HE2      PHE  21  -2.675   7.088   0.968
  143    HZ   PHE  21           HZ       PHE  21  -3.525   8.131   3.032
  144    H    CYS  22           HN       CYS  22  -2.866  -0.050   3.179
  145    HA   CYS  22           HA       CYS  22  -4.947  -1.824   2.113
  146    HB2  CYS  22           HB2      CYS  22  -1.948  -2.061   1.713
  147    HB3  CYS  22           HB1      CYS  22  -3.128  -3.273   1.216
  148    H    CYS  23           HN       CYS  23  -4.977  -3.927   3.119
  149    HA   CYS  23           HA       CYS  23  -4.145  -3.854   5.883
  150    HB2  CYS  23           HB2      CYS  23  -5.412  -5.860   6.176
  151    HB3  CYS  23           HB1      CYS  23  -6.348  -4.855   5.075
  152    H    ASP  24           HN       ASP  24  -2.982  -5.866   6.772
  153    HA   ASP  24           HA       ASP  24  -0.384  -5.766   5.859
  154    HB2  ASP  24           HB2      ASP  24  -1.695  -8.015   7.398
  155    HB3  ASP  24           HB1      ASP  24   0.041  -7.797   7.219
  156    H    THR  25           HN       THR  25  -2.844  -8.165   5.068
  157    HA   THR  25           HA       THR  25  -1.197  -9.897   3.598
  158    HB   THR  25           HB       THR  25  -4.150  -9.425   3.184
  159    HG1  THR  25           HG1      THR  25  -3.145 -11.483   4.808
  160   HG21  THR  25          HG21      THR  25  -4.164 -11.766   2.457
  161   HG22  THR  25          HG22      THR  25  -2.417 -11.849   2.682
  162   HG23  THR  25          HG23      THR  25  -3.098 -10.794   1.443
  163    H    CYS  26           HN       CYS  26  -3.329  -7.253   2.467
  164    HA   CYS  26           HA       CYS  26  -2.661  -7.707  -0.271
  165    HB2  CYS  26           HB2      CYS  26  -3.989  -5.318   1.005
  166    HB3  CYS  26           HB1      CYS  26  -3.890  -5.614  -0.723
  167    H    SER  27           HN       SER  27  -1.410  -5.576   2.234
  168    HA   SER  27           HA       SER  27   0.021  -3.824   0.549
  169    HB2  SER  27           HB2      SER  27   0.665  -4.668   3.386
  170    HB3  SER  27           HB1      SER  27   1.302  -3.248   2.559
  171    HG   SER  27           HG       SER  27  -0.434  -2.639   3.839
  172    H    ARG  28           HN       ARG  28   0.694  -7.027   1.741
  173    HA   ARG  28           HA       ARG  28   3.441  -7.018   0.908
  174    HB2  ARG  28           HB2      ARG  28   1.548  -9.170   1.823
  175    HB3  ARG  28           HB1      ARG  28   3.181  -9.532   1.281
  176    HG2  ARG  28           HG2      ARG  28   4.128  -8.258   3.062
  177    HG3  ARG  28           HG1      ARG  28   2.543  -7.636   3.528
  178    HD2  ARG  28           HD2      ARG  28   3.391  -9.484   4.974
  179    HD3  ARG  28           HD1      ARG  28   1.822  -9.799   4.234
  180    HE   ARG  28           HE       ARG  28   4.049 -10.820   2.723
  181   HH11  ARG  28          HH11      ARG  28   1.824 -11.487   5.341
  182   HH12  ARG  28          HH12      ARG  28   1.944 -13.210   5.164
  183   HH21  ARG  28          HH21      ARG  28   4.196 -13.074   2.487
  184   HH22  ARG  28          HH22      ARG  28   3.288 -14.112   3.542
  185    H    VAL  29           HN       VAL  29   0.373  -8.058  -0.450
  186    HA   VAL  29           HA       VAL  29   1.629  -9.464  -2.628
  187    HB   VAL  29           HB       VAL  29  -1.284  -8.728  -2.295
  188   HG11  VAL  29          HG11      VAL  29   0.042 -10.756  -4.090
  189   HG12  VAL  29          HG12      VAL  29  -0.695  -9.241  -4.606
  190   HG13  VAL  29          HG13      VAL  29  -1.695 -10.518  -3.914
  191   HG21  VAL  29          HG21      VAL  29  -0.556 -10.123  -0.454
  192   HG22  VAL  29          HG22      VAL  29   0.176 -11.264  -1.579
  193   HG23  VAL  29          HG23      VAL  29  -1.573 -11.055  -1.549
  194    H    PHE  30           HN       PHE  30  -0.134  -6.416  -2.217
  195    HA   PHE  30           HA       PHE  30   0.736  -5.647  -4.928
  196    HB2  PHE  30           HB2      PHE  30  -1.803  -4.763  -3.528
  197    HB3  PHE  30           HB1      PHE  30  -1.307  -4.331  -5.157
  198    HD1  PHE  30           HD1      PHE  30  -0.891  -6.428  -6.749
  199    HD2  PHE  30           HD2      PHE  30  -3.344  -6.416  -3.271
  200    HE1  PHE  30           HE1      PHE  30  -2.141  -8.352  -7.627
  201    HE2  PHE  30           HE2      PHE  30  -4.593  -8.343  -4.138
  202    HZ   PHE  30           HZ       PHE  30  -3.995  -9.315  -6.322
  203    H    HIS  31           HN       HIS  31   2.508  -5.059  -3.013
  204    HA   HIS  31           HA       HIS  31   2.055  -2.757  -1.486
  205    HB2  HIS  31           HB2      HIS  31   3.962  -4.309  -1.157
  206    HB3  HIS  31           HB1      HIS  31   4.690  -3.691  -2.637
  207    HD1  HIS  31           HD1      HIS  31   3.743  -2.482   0.847
  208    HD2  HIS  31           HD2      HIS  31   6.246  -1.487  -2.313
  209    HE1  HIS  31           HE1      HIS  31   5.259  -0.632   1.692
  210    H    GLU  32           HN       GLU  32   3.486  -3.087  -4.723
  211    HA   GLU  32           HA       GLU  32   4.148  -0.340  -4.991
  212    HB2  GLU  32           HB2      GLU  32   3.754  -2.510  -7.053
  213    HB3  GLU  32           HB1      GLU  32   4.329  -0.895  -7.438
  214    HG2  GLU  32           HG2      GLU  32   6.303  -1.226  -6.101
  215    HG3  GLU  32           HG1      GLU  32   5.711  -2.795  -5.555
  216    H    ASP  33           HN       ASP  33   1.369  -2.270  -5.814
  217    HA   ASP  33           HA       ASP  33   0.046  -0.245  -7.337
  218    HB2  ASP  33           HB2      ASP  33  -1.113  -2.724  -6.048
  219    HB3  ASP  33           HB1      ASP  33  -1.880  -1.759  -7.300
  220    H    CYS  34           HN       CYS  34   0.307  -1.036  -3.993
  221    HA   CYS  34           HA       CYS  34  -2.127   0.146  -3.093
  222    HB2  CYS  34           HB2      CYS  34  -0.690  -1.544  -1.812
  223    HB3  CYS  34           HB1      CYS  34   0.395  -0.200  -1.461
  224    H    HIS  35           HN       HIS  35   0.795   1.474  -4.198
  225    HA   HIS  35           HA       HIS  35   0.393   3.965  -2.702
  226    HB2  HIS  35           HB2      HIS  35   2.722   3.025  -4.382
  227    HB3  HIS  35           HB1      HIS  35   2.648   4.575  -3.545
  228    HD1  HIS  35           HD1      HIS  35   2.721   4.451  -0.862
  229    HD2  HIS  35           HD2      HIS  35   3.372   0.860  -2.851
  230    HE1  HIS  35           HE1      HIS  35   3.727   2.868   0.833
  231    H    ILE  36           HN       ILE  36  -0.786   2.718  -5.402
  232    HA   ILE  36           HA       ILE  36  -0.701   5.265  -6.873
  233    HB   ILE  36           HB       ILE  36  -0.753   2.500  -8.097
  234   HG12  ILE  36          HG12      ILE  36   1.468   4.559  -8.053
  235   HG13  ILE  36          HG11      ILE  36   1.436   3.073  -7.111
  236   HG21  ILE  36          HG21      ILE  36  -0.475   3.670 -10.234
  237   HG22  ILE  36          HG22      ILE  36  -0.593   5.218  -9.395
  238   HG23  ILE  36          HG23      ILE  36  -1.976   4.124  -9.427
  239   HD11  ILE  36          HD11      ILE  36   1.503   3.250 -10.115
  240   HD12  ILE  36          HD12      ILE  36   1.482   1.762  -9.167
  241   HD13  ILE  36          HD13      ILE  36   2.863   2.854  -9.063
  242    HA   PRO  37           HA       PRO  37  -1.702   6.526  -7.917
  243    HB2  PRO  37           HB2      PRO  37  -3.919   8.286  -7.614
  244    HB3  PRO  37           HB1      PRO  37  -3.308   7.597  -9.123
  245    HG2  PRO  37           HG2      PRO  37  -5.777   7.035  -7.952
  246    HG3  PRO  37           HG1      PRO  37  -4.984   6.072  -9.209
  247    HD2  PRO  37           HD2      PRO  37  -5.107   5.617  -6.258
  248    HD3  PRO  37           HD1      PRO  37  -5.102   4.433  -7.586
  249    HA   PRO  38           HA       PRO  38  -0.766   8.786  -4.151
  250    HB2  PRO  38           HB2      PRO  38  -1.497  11.292  -5.581
  251    HB3  PRO  38           HB1      PRO  38  -0.024  10.894  -4.691
  252    HG2  PRO  38           HG2      PRO  38  -0.044  10.935  -7.365
  253    HG3  PRO  38           HG1      PRO  38   0.901   9.731  -6.466
  254    HD2  PRO  38           HD2      PRO  38  -1.682   9.405  -7.936
  255    HD3  PRO  38           HD1      PRO  38  -0.347   8.249  -7.726
  256    H    VAL  39           HN       VAL  39  -1.994   9.175  -2.399
  257    HA   VAL  39           HA       VAL  39  -4.812   9.125  -2.699
  258    HB   VAL  39           HB       VAL  39  -3.771   7.969  -0.849
  259   HG11  VAL  39          HG11      VAL  39  -2.937  10.703   0.082
  260   HG12  VAL  39          HG12      VAL  39  -1.901   9.330  -0.310
  261   HG13  VAL  39          HG13      VAL  39  -2.935   9.276   1.114
  262   HG21  VAL  39          HG21      VAL  39  -5.528  10.206   0.136
  263   HG22  VAL  39          HG22      VAL  39  -5.274   8.648   0.921
  264   HG23  VAL  39          HG23      VAL  39  -6.092   8.726  -0.639
  265    H    GLU  40           HN       GLU  40  -6.050  10.748  -3.153
  266    HA   GLU  40           HA       GLU  40  -5.764  13.272  -1.750
  267    HB2  GLU  40           HB2      GLU  40  -4.478  13.502  -3.892
  268    HB3  GLU  40           HB1      GLU  40  -5.960  13.159  -4.769
  269    HG2  GLU  40           HG2      GLU  40  -6.979  15.155  -3.684
  270    HG3  GLU  40           HG1      GLU  40  -5.393  15.531  -3.012
  271    H    ALA  41           HN       ALA  41  -7.623  12.061  -0.813
  272    HA   ALA  41           HA       ALA  41 -10.108  12.994  -1.790
  273    HB1  ALA  41           HB1      ALA  41 -11.155  10.840  -2.325
  274    HB2  ALA  41           HB2      ALA  41  -9.597  10.038  -2.123
  275    HB3  ALA  41           HB3      ALA  41  -9.825  11.204  -3.425
  276    H    GLU  42           HN       GLU  42  -8.935  10.099  -0.115
  277    HA   GLU  42           HA       GLU  42  -9.882  11.074   2.428
  278    HB2  GLU  42           HB2      GLU  42 -11.228   8.974   2.803
  279    HB3  GLU  42           HB1      GLU  42 -11.927  10.124   1.673
  280    HG2  GLU  42           HG2      GLU  42 -11.011   8.776  -0.189
  281    HG3  GLU  42           HG1      GLU  42 -10.469   7.585   0.991
  282    H    ARG  43           HN       ARG  43  -8.452  10.458   3.951
  283    HA   ARG  43           HA       ARG  43  -6.645   8.239   3.275
  284    HB2  ARG  43           HB2      ARG  43  -6.195  10.481   5.251
  285    HB3  ARG  43           HB1      ARG  43  -5.038   9.233   4.813
  286    HG2  ARG  43           HG2      ARG  43  -5.265  10.123   2.426
  287    HG3  ARG  43           HG1      ARG  43  -6.031  11.528   3.167
  288    HD2  ARG  43           HD2      ARG  43  -4.021  11.815   4.589
  289    HD3  ARG  43           HD1      ARG  43  -3.261  10.478   3.726
  290    HE   ARG  43           HE       ARG  43  -4.208  12.733   2.143
  291   HH11  ARG  43          HH11      ARG  43  -1.490  11.018   3.561
  292   HH12  ARG  43          HH12      ARG  43  -0.317  11.861   2.593
  293   HH21  ARG  43          HH21      ARG  43  -2.665  13.822   0.873
  294   HH22  ARG  43          HH22      ARG  43  -0.979  13.452   1.071
  295    H    THR  44           HN       THR  44  -7.584   6.467   4.093
  296    HA   THR  44           HA       THR  44  -8.064   6.450   6.992
  297    HB   THR  44           HB       THR  44  -9.759   4.639   6.558
  298    HG1  THR  44           HG1      THR  44  -9.029   4.160   4.393
  299   HG21  THR  44          HG21      THR  44 -11.543   6.165   5.887
  300   HG22  THR  44          HG22      THR  44 -10.348   7.311   5.276
  301   HG23  THR  44          HG23      THR  44 -10.434   6.964   7.003
  302    HA   PRO  45           HA       PRO  45  -4.622   3.545   6.014
  303    HB2  PRO  45           HB2      PRO  45  -3.930   4.052   8.836
  304    HB3  PRO  45           HB1      PRO  45  -2.937   4.231   7.383
  305    HG2  PRO  45           HG2      PRO  45  -3.848   6.367   8.729
  306    HG3  PRO  45           HG1      PRO  45  -3.705   6.369   6.960
  307    HD2  PRO  45           HD2      PRO  45  -6.149   5.998   8.663
  308    HD3  PRO  45           HD1      PRO  45  -5.954   6.945   7.169
  309    H    TRP  46           HN       TRP  46  -7.079   3.531   8.433
  310    HA   TRP  46           HA       TRP  46  -6.455   0.801   9.256
  311    HB2  TRP  46           HB2      TRP  46  -8.351   1.104  10.855
  312    HB3  TRP  46           HB1      TRP  46  -7.080   2.305  11.051
  313    HD1  TRP  46           HD1      TRP  46 -10.720   1.950   9.931
  314    HE1  TRP  46           HE1      TRP  46 -11.786   4.288   9.833
  315    HE3  TRP  46           HE3      TRP  46  -6.532   4.787  10.701
  316    HZ2  TRP  46           HZ2      TRP  46 -10.963   6.973  10.054
  317    HZ3  TRP  46           HZ3      TRP  46  -6.765   7.238  10.743
  318    HH2  TRP  46           HH2      TRP  46  -8.925   8.302  10.423
  319    H    ASN  47           HN       ASN  47  -7.469   1.610   6.546
  320    HA   ASN  47           HA       ASN  47  -9.635  -0.345   6.407
  321    HB2  ASN  47           HB2      ASN  47 -10.708   1.898   6.514
  322    HB3  ASN  47           HB1      ASN  47  -9.769   2.397   5.112
  323   HD21  ASN  47          HD21      ASN  47 -11.248  -0.767   5.555
  324   HD22  ASN  47          HD22      ASN  47 -12.383  -0.610   4.262
  325    H    CYS  48           HN       CYS  48  -9.307  -1.731   4.734
  326    HA   CYS  48           HA       CYS  48  -7.023  -1.190   3.023
  327    HB2  CYS  48           HB2      CYS  48  -7.253  -3.395   4.153
  328    HB3  CYS  48           HB1      CYS  48  -8.728  -3.689   3.237
  329    H    ILE  49           HN       ILE  49  -7.225  -0.381   1.051
  330    HA   ILE  49           HA       ILE  49  -9.814  -0.038  -0.122
  331    HB   ILE  49           HB       ILE  49  -8.561   0.963  -2.060
  332   HG12  ILE  49          HG12      ILE  49  -6.165   0.699  -0.238
  333   HG13  ILE  49          HG11      ILE  49  -6.431  -0.300  -1.663
  334   HG21  ILE  49          HG21      ILE  49  -8.027   2.097   0.682
  335   HG22  ILE  49          HG22      ILE  49  -9.489   2.320  -0.272
  336   HG23  ILE  49          HG23      ILE  49  -7.960   2.996  -0.830
  337   HD11  ILE  49          HD11      ILE  49  -4.875   1.504  -2.129
  338   HD12  ILE  49          HD12      ILE  49  -6.080   2.690  -1.630
  339   HD13  ILE  49          HD13      ILE  49  -6.356   1.705  -3.065
  340    H    PHE  50           HN       PHE  50  -7.259  -2.359  -0.497
  341    HA   PHE  50           HA       PHE  50  -8.146  -3.206  -3.110
  342    HB2  PHE  50           HB2      PHE  50  -5.951  -4.058  -1.278
  343    HB3  PHE  50           HB1      PHE  50  -6.520  -5.208  -2.491
  344    HD1  PHE  50           HD2      PHE  50  -5.046  -1.868  -1.989
  345    HD2  PHE  50           HD1      PHE  50  -6.007  -4.922  -4.787
  346    HE1  PHE  50           HE2      PHE  50  -3.648  -0.756  -3.675
  347    HE2  PHE  50           HE1      PHE  50  -4.605  -3.820  -6.476
  348    HZ   PHE  50           HZ       PHE  50  -3.534  -1.685  -5.979
  349    H    CYS  51           HN       CYS  51  -8.712  -4.174   0.201
  350    HA   CYS  51           HA       CYS  51  -9.791  -6.727  -0.421
  351    HB2  CYS  51           HB2      CYS  51  -9.726  -4.981   1.985
  352    HB3  CYS  51           HB1      CYS  51 -10.955  -6.238   1.933
  353    H    ARG  52           HN       ARG  52 -11.351  -3.582   0.280
  354    HA   ARG  52           HA       ARG  52 -13.884  -4.744  -0.542
  355    HB2  ARG  52           HB2      ARG  52 -14.876  -2.610   0.227
  356    HB3  ARG  52           HB1      ARG  52 -13.978  -3.455   1.475
  357    HG2  ARG  52           HG2      ARG  52 -12.103  -1.949   1.190
  358    HG3  ARG  52           HG1      ARG  52 -12.945  -1.122  -0.125
  359    HD2  ARG  52           HD2      ARG  52 -13.094   0.097   2.007
  360    HD3  ARG  52           HD1      ARG  52 -14.677  -0.389   1.401
  361    HE   ARG  52           HE       ARG  52 -13.564  -2.282   3.245
  362   HH11  ARG  52          HH11      ARG  52 -15.309   0.738   2.996
  363   HH12  ARG  52          HH12      ARG  52 -16.091   0.568   4.534
  364   HH21  ARG  52          HH21      ARG  52 -14.575  -2.504   5.291
  365   HH22  ARG  52          HH22      ARG  52 -15.657  -1.265   5.846
  366    H    MET  53           HN       MET  53 -11.397  -3.508  -2.130
  367    HA   MET  53           HA       MET  53 -11.025  -2.637  -4.175
  368    HB2  MET  53           HB2      MET  53 -13.801  -3.726  -4.597
  369    HB3  MET  53           HB1      MET  53 -12.826  -3.052  -5.895
  370    HG2  MET  53           HG2      MET  53 -12.114  -5.424  -4.186
  371    HG3  MET  53           HG1      MET  53 -12.681  -5.472  -5.854
  372    HE1  MET  53           HE1      MET  53 -11.284  -4.433  -7.902
  373    HE2  MET  53           HE2      MET  53  -9.680  -3.725  -7.728
  374    HE3  MET  53           HE3      MET  53 -11.083  -2.904  -7.046
  375    H    LYS  54           HN       LYS  54 -11.485  -0.648  -2.499
  376    HA   LYS  54           HA       LYS  54 -13.489   1.173  -3.340
  377    HB2  LYS  54           HB2      LYS  54 -12.343   1.467  -1.189
  378    HB3  LYS  54           HB1      LYS  54 -10.815   1.719  -2.022
  379    HG2  LYS  54           HG2      LYS  54 -11.751   3.753  -3.071
  380    HG3  LYS  54           HG1      LYS  54 -13.231   3.523  -2.143
  381    HD2  LYS  54           HD2      LYS  54 -10.504   3.843  -0.901
  382    HD3  LYS  54           HD1      LYS  54 -11.623   5.178  -1.169
  383    HE2  LYS  54           HE2      LYS  54 -12.362   2.726   0.404
  384    HE3  LYS  54           HE1      LYS  54 -11.621   4.141   1.146
  385    HZ1  LYS  54           HZ1      LYS  54 -14.138   4.245  -0.423
  386    HZ2  LYS  54           HZ2      LYS  54 -13.472   5.471   0.544
  387    HZ3  LYS  54           HZ3      LYS  54 -14.090   4.069   1.256
  388    H    GLU  55           HN       GLU  55 -13.551   1.362  -5.522
  389    HA   GLU  55           HA       GLU  55 -11.252   2.693  -6.770
  390    HB2  GLU  55           HB2      GLU  55 -11.350   0.302  -7.446
  391    HB3  GLU  55           HB1      GLU  55 -12.965   0.574  -8.081
  392    HG2  GLU  55           HG2      GLU  55 -11.324   0.580  -9.859
  393    HG3  GLU  55           HG1      GLU  55 -12.064   2.172  -9.689
  394    H    SER  56           HN       SER  56 -11.960   4.695  -7.105
  395    HA   SER  56           HA       SER  56 -14.512   5.037  -8.489
  396    HB2  SER  56           HB2      SER  56 -14.899   7.083  -7.033
  397    HB3  SER  56           HB1      SER  56 -15.087   5.526  -6.227
  398    HG   SER  56           HG       SER  56 -12.665   6.997  -6.201
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1   4.913 -12.189  -4.760
    2    H2   GLY   1           HT2      GLY   1   4.052 -11.268  -5.884
    3    H3   GLY   1           HT3      GLY   1   3.399 -12.710  -5.298
    4    HA2  GLY   1           HA1      GLY   1   3.901 -10.252  -3.720
    5    HA3  GLY   1           HA2      GLY   1   2.329 -10.833  -4.250
    6    H    ALA   2           HN       ALA   2   3.968 -10.481  -1.588
    7    HA   ALA   2           HA       ALA   2   3.937 -11.388   0.486
    8    HB1  ALA   2           HB1      ALA   2   1.711 -13.113  -0.593
    9    HB2  ALA   2           HB2      ALA   2   1.517 -11.514   0.123
   10    HB3  ALA   2           HB3      ALA   2   2.094 -12.858   1.109
   11    H    MET   3           HN       MET   3   5.856 -12.340  -1.235
   12    HA   MET   3           HA       MET   3   6.450 -14.859   0.065
   13    HB2  MET   3           HB2      MET   3   5.200 -15.431  -2.050
   14    HB3  MET   3           HB1      MET   3   6.504 -14.680  -2.957
   15    HG2  MET   3           HG2      MET   3   8.075 -16.319  -2.131
   16    HG3  MET   3           HG1      MET   3   6.833 -17.032  -1.103
   17    HE1  MET   3           HE1      MET   3   4.841 -18.495  -1.960
   18    HE2  MET   3           HE2      MET   3   4.405 -18.659  -3.660
   19    HE3  MET   3           HE3      MET   3   4.268 -17.094  -2.862
   20    H    GLY   4           HN       GLY   4   7.332 -11.926  -0.415
   21    HA2  GLY   4           HA2      GLY   4  10.123 -12.492  -1.186
   22    HA3  GLY   4           HA1      GLY   4   9.346 -10.923  -1.336
   23    H    MET   5           HN       MET   5  11.210 -10.117  -0.149
   24    HA   MET   5           HA       MET   5  10.908 -10.541   2.748
   25    HB2  MET   5           HB2      MET   5  13.465 -10.112   1.190
   26    HB3  MET   5           HB1      MET   5  13.360 -10.066   2.944
   27    HG2  MET   5           HG2      MET   5  12.635 -12.392   2.974
   28    HG3  MET   5           HG1      MET   5  12.703 -12.445   1.214
   29    HE1  MET   5           HE1      MET   5  14.158 -14.560   3.066
   30    HE2  MET   5           HE2      MET   5  15.732 -14.690   2.282
   31    HE3  MET   5           HE3      MET   5  14.267 -14.597   1.307
   32    H    ARG   6           HN       ARG   6   9.355  -8.730   2.173
   33    HA   ARG   6           HA       ARG   6   8.720  -6.566   2.279
   34    HB2  ARG   6           HB2      ARG   6  11.380  -6.374   3.668
   35    HB3  ARG   6           HB1      ARG   6  10.305  -4.995   3.504
   36    HG2  ARG   6           HG2      ARG   6   8.566  -6.220   4.731
   37    HG3  ARG   6           HG1      ARG   6   9.674  -7.582   4.914
   38    HD2  ARG   6           HD2      ARG   6  11.194  -6.233   6.205
   39    HD3  ARG   6           HD1      ARG   6  10.223  -4.794   5.913
   40    HE   ARG   6           HE       ARG   6   8.501  -6.507   7.136
   41   HH11  ARG   6          HH11      ARG   6  11.667  -5.243   7.922
   42   HH12  ARG   6          HH12      ARG   6  11.409  -5.298   9.635
   43   HH21  ARG   6          HH21      ARG   6   8.150  -6.566   9.403
   44   HH22  ARG   6          HH22      ARG   6   9.408  -6.050  10.477
   45    H    ASN   7           HN       ASN   7   8.570  -6.072   0.153
   46    HA   ASN   7           HA       ASN   7  10.908  -5.372  -1.405
   47    HB2  ASN   7           HB2      ASN   7   8.873  -6.639  -2.283
   48    HB3  ASN   7           HB1      ASN   7   8.016  -5.105  -2.238
   49   HD21  ASN   7          HD21      ASN   7  10.649  -6.866  -3.723
   50   HD22  ASN   7          HD22      ASN   7  10.781  -5.870  -5.128
   51    H    LEU   8           HN       LEU   8   9.477  -3.795   0.921
   52    HA   LEU   8           HA       LEU   8   8.784  -1.289  -0.181
   53    HB2  LEU   8           HB2      LEU   8   8.901  -0.465   2.150
   54    HB3  LEU   8           HB1      LEU   8   7.903  -1.890   1.949
   55    HG   LEU   8           HG       LEU   8  10.146  -3.119   2.675
   56   HD11  LEU   8          HD11      LEU   8  10.370  -0.433   4.025
   57   HD12  LEU   8          HD12      LEU   8  11.467  -1.058   2.796
   58   HD13  LEU   8          HD13      LEU   8  11.352  -1.859   4.364
   59   HD21  LEU   8          HD21      LEU   8   8.244  -1.744   4.566
   60   HD22  LEU   8          HD22      LEU   8   9.289  -3.104   4.971
   61   HD23  LEU   8          HD23      LEU   8   7.997  -3.306   3.789
   62    H    ASP   9           HN       ASP   9  11.787  -2.745   0.233
   63    HA   ASP   9           HA       ASP   9  13.364  -0.394   0.642
   64    HB2  ASP   9           HB2      ASP   9  14.284  -2.638   1.082
   65    HB3  ASP   9           HB1      ASP   9  14.140  -3.033  -0.627
   66    H    GLU  10           HN       GLU  10  12.079  -2.115  -2.088
   67    HA   GLU  10           HA       GLU  10  13.221  -0.225  -3.979
   68    HB2  GLU  10           HB2      GLU  10  11.455  -2.635  -4.415
   69    HB3  GLU  10           HB1      GLU  10  12.182  -1.664  -5.689
   70    HG2  GLU  10           HG2      GLU  10  14.401  -2.275  -4.926
   71    HG3  GLU  10           HG1      GLU  10  13.705  -3.202  -3.599
   72    H    CYS  11           HN       CYS  11  10.977   0.132  -1.906
   73    HA   CYS  11           HA       CYS  11   8.961   1.324  -3.679
   74    HB2  CYS  11           HB2      CYS  11   8.139  -0.292  -1.991
   75    HB3  CYS  11           HB1      CYS  11   8.822   0.709  -0.721
   76    H    GLU  12           HN       GLU  12   9.948   3.224  -4.187
   77    HA   GLU  12           HA       GLU  12  11.558   4.712  -2.422
   78    HB2  GLU  12           HB2      GLU  12  10.139   5.734  -4.880
   79    HB3  GLU  12           HB1      GLU  12  11.601   6.386  -4.146
   80    HG2  GLU  12           HG2      GLU  12  12.759   4.260  -4.675
   81    HG3  GLU  12           HG1      GLU  12  11.308   3.722  -5.517
   82    H    VAL  13           HN       VAL  13   8.148   4.730  -3.113
   83    HA   VAL  13           HA       VAL  13   7.604   7.239  -1.929
   84    HB   VAL  13           HB       VAL  13   6.046   6.317  -3.516
   85   HG11  VAL  13          HG11      VAL  13   5.546   4.113  -1.535
   86   HG12  VAL  13          HG12      VAL  13   6.397   3.952  -3.071
   87   HG13  VAL  13          HG13      VAL  13   4.685   4.367  -3.052
   88   HG21  VAL  13          HG21      VAL  13   4.748   6.344  -0.804
   89   HG22  VAL  13          HG22      VAL  13   3.973   6.674  -2.354
   90   HG23  VAL  13          HG23      VAL  13   5.186   7.785  -1.720
   91    H    CYS  14           HN       CYS  14   8.024   4.015  -0.650
   92    HA   CYS  14           HA       CYS  14   6.876   4.521   1.911
   93    HB2  CYS  14           HB2      CYS  14   8.457   2.388   0.689
   94    HB3  CYS  14           HB1      CYS  14   8.867   2.663   2.376
   95    H    ARG  15           HN       ARG  15   9.961   5.114   0.440
   96    HA   ARG  15           HA       ARG  15  11.363   5.772   2.834
   97    HB2  ARG  15           HB2      ARG  15  11.911   6.418  -0.060
   98    HB3  ARG  15           HB1      ARG  15  13.003   6.836   1.254
   99    HG2  ARG  15           HG2      ARG  15  13.357   4.526   1.778
  100    HG3  ARG  15           HG1      ARG  15  12.121   4.032   0.620
  101    HD2  ARG  15           HD2      ARG  15  13.445   4.811  -1.214
  102    HD3  ARG  15           HD1      ARG  15  14.619   5.537  -0.121
  103    HE   ARG  15           HE       ARG  15  14.573   2.865   0.525
  104   HH11  ARG  15          HH11      ARG  15  15.189   4.721  -2.381
  105   HH12  ARG  15          HH12      ARG  15  16.371   3.609  -2.996
  106   HH21  ARG  15          HH21      ARG  15  16.140   1.401  -0.280
  107   HH22  ARG  15          HH22      ARG  15  16.914   1.721  -1.798
  108    H    ASP  16           HN       ASP  16   9.472   7.555   0.500
  109    HA   ASP  16           HA       ASP  16   9.999  10.116   1.687
  110    HB2  ASP  16           HB2      ASP  16   8.075   9.135  -0.401
  111    HB3  ASP  16           HB1      ASP  16   7.929  10.761   0.258
  112    H    GLY  17           HN       GLY  17   8.434   7.580   2.913
  113    HA2  GLY  17           HA2      GLY  17   7.031   7.376   4.729
  114    HA3  GLY  17           HA1      GLY  17   7.056   9.132   4.867
  115    H    GLY  18           HN       GLY  18   6.133   7.528   1.928
  116    HA2  GLY  18           HA2      GLY  18   3.734   8.931   1.639
  117    HA3  GLY  18           HA1      GLY  18   4.176   7.487   0.750
  118    H    GLU  19           HN       GLU  19   1.582   8.158   1.546
  119    HA   GLU  19           HA       GLU  19   0.901   6.674   3.912
  120    HB2  GLU  19           HB2      GLU  19  -0.762   8.051   1.801
  121    HB3  GLU  19           HB1      GLU  19  -1.469   7.169   3.146
  122    HG2  GLU  19           HG2      GLU  19  -1.455   9.527   3.625
  123    HG3  GLU  19           HG1      GLU  19  -0.354   8.693   4.716
  124    H    LEU  20           HN       LEU  20  -0.498   4.847   3.942
  125    HA   LEU  20           HA       LEU  20  -0.416   3.200   1.506
  126    HB2  LEU  20           HB2      LEU  20   1.407   2.552   3.018
  127    HB3  LEU  20           HB1      LEU  20   0.258   2.318   4.317
  128    HG   LEU  20           HG       LEU  20  -0.795   0.486   2.961
  129   HD11  LEU  20          HD11      LEU  20   1.657   0.855   1.239
  130   HD12  LEU  20          HD12      LEU  20  -0.004   1.183   0.750
  131   HD13  LEU  20          HD13      LEU  20   0.499  -0.466   1.122
  132   HD21  LEU  20          HD21      LEU  20   0.778   0.008   4.762
  133   HD22  LEU  20          HD22      LEU  20   2.128   0.175   3.637
  134   HD23  LEU  20          HD23      LEU  20   0.971  -1.139   3.435
  135    H    PHE  21           HN       PHE  21  -2.351   2.245   1.043
  136    HA   PHE  21           HA       PHE  21  -4.442   2.491   3.119
  137    HB2  PHE  21           HB2      PHE  21  -4.758   2.648   0.109
  138    HB3  PHE  21           HB1      PHE  21  -6.070   2.765   1.280
  139    HD1  PHE  21           HD1      PHE  21  -6.025   4.696   2.939
  140    HD2  PHE  21           HD2      PHE  21  -3.538   4.555  -0.524
  141    HE1  PHE  21           HE1      PHE  21  -5.678   7.122   3.086
  142    HE2  PHE  21           HE2      PHE  21  -3.198   6.983  -0.374
  143    HZ   PHE  21           HZ       PHE  21  -4.267   8.268   1.430
  144    H    CYS  22           HN       CYS  22  -2.839   0.194   2.961
  145    HA   CYS  22           HA       CYS  22  -4.874  -1.778   2.230
  146    HB2  CYS  22           HB2      CYS  22  -1.997  -1.778   1.336
  147    HB3  CYS  22           HB1      CYS  22  -2.932  -3.269   1.432
  148    H    CYS  23           HN       CYS  23  -4.605  -3.837   3.239
  149    HA   CYS  23           HA       CYS  23  -3.580  -3.646   5.936
  150    HB2  CYS  23           HB2      CYS  23  -4.707  -5.724   6.328
  151    HB3  CYS  23           HB1      CYS  23  -5.775  -4.779   5.289
  152    H    ASP  24           HN       ASP  24  -2.334  -5.707   6.713
  153    HA   ASP  24           HA       ASP  24   0.189  -5.673   5.564
  154    HB2  ASP  24           HB2      ASP  24  -0.238  -6.460   7.857
  155    HB3  ASP  24           HB1      ASP  24  -1.032  -7.895   7.216
  156    H    THR  25           HN       THR  25  -2.432  -8.006   5.068
  157    HA   THR  25           HA       THR  25  -0.969  -9.859   3.562
  158    HB   THR  25           HB       THR  25  -3.936  -9.333   3.434
  159    HG1  THR  25           HG1      THR  25  -2.288 -10.483   5.384
  160   HG21  THR  25          HG21      THR  25  -3.118 -10.851   1.693
  161   HG22  THR  25          HG22      THR  25  -4.081 -11.722   2.886
  162   HG23  THR  25          HG23      THR  25  -2.321 -11.836   2.919
  163    H    CYS  26           HN       CYS  26  -3.167  -7.244   2.458
  164    HA   CYS  26           HA       CYS  26  -2.659  -7.814  -0.296
  165    HB2  CYS  26           HB2      CYS  26  -3.835  -5.314   0.927
  166    HB3  CYS  26           HB1      CYS  26  -3.875  -5.734  -0.777
  167    H    SER  27           HN       SER  27  -1.231  -5.641   2.072
  168    HA   SER  27           HA       SER  27   0.199  -4.005   0.275
  169    HB2  SER  27           HB2      SER  27  -0.102  -3.409   2.644
  170    HB3  SER  27           HB1      SER  27   0.892  -4.781   3.123
  171    HG   SER  27           HG       SER  27   2.485  -3.425   2.964
  172    H    ARG  28           HN       ARG  28   0.805  -7.194   1.578
  173    HA   ARG  28           HA       ARG  28   3.522  -7.346   0.753
  174    HB2  ARG  28           HB2      ARG  28   1.479  -9.480   1.361
  175    HB3  ARG  28           HB1      ARG  28   3.153  -9.828   0.975
  176    HG2  ARG  28           HG2      ARG  28   3.865  -8.573   2.951
  177    HG3  ARG  28           HG1      ARG  28   2.173  -8.255   3.347
  178    HD2  ARG  28           HD2      ARG  28   1.803 -10.723   3.399
  179    HD3  ARG  28           HD1      ARG  28   3.539 -10.935   3.196
  180    HE   ARG  28           HE       ARG  28   2.329  -9.560   5.518
  181   HH11  ARG  28          HH11      ARG  28   4.705 -11.748   4.123
  182   HH12  ARG  28          HH12      ARG  28   5.418 -12.142   5.655
  183   HH21  ARG  28          HH21      ARG  28   3.288 -10.058   7.510
  184   HH22  ARG  28          HH22      ARG  28   4.619 -11.172   7.582
  185    H    VAL  29           HN       VAL  29   0.469  -7.829  -0.842
  186    HA   VAL  29           HA       VAL  29   1.715  -9.287  -3.032
  187    HB   VAL  29           HB       VAL  29  -1.201  -8.593  -2.682
  188   HG11  VAL  29          HG11      VAL  29  -1.581 -10.379  -4.308
  189   HG12  VAL  29          HG12      VAL  29   0.160 -10.610  -4.462
  190   HG13  VAL  29          HG13      VAL  29  -0.577  -9.097  -4.988
  191   HG21  VAL  29          HG21      VAL  29  -0.511  -9.974  -0.832
  192   HG22  VAL  29          HG22      VAL  29   0.298 -11.094  -1.927
  193   HG23  VAL  29          HG23      VAL  29  -1.458 -10.945  -1.958
  194    H    PHE  30           HN       PHE  30  -0.075  -6.257  -2.497
  195    HA   PHE  30           HA       PHE  30   0.782  -5.396  -5.190
  196    HB2  PHE  30           HB2      PHE  30  -1.787  -4.608  -3.790
  197    HB3  PHE  30           HB1      PHE  30  -1.276  -4.096  -5.392
  198    HD1  PHE  30           HD1      PHE  30  -0.865  -6.060  -7.108
  199    HD2  PHE  30           HD2      PHE  30  -3.241  -6.355  -3.583
  200    HE1  PHE  30           HE1      PHE  30  -2.066  -7.973  -8.078
  201    HE2  PHE  30           HE2      PHE  30  -4.442  -8.268  -4.549
  202    HZ   PHE  30           HZ       PHE  30  -3.854  -9.081  -6.801
  203    H    HIS  31           HN       HIS  31   2.422  -4.941  -3.095
  204    HA   HIS  31           HA       HIS  31   1.978  -2.881  -1.345
  205    HB2  HIS  31           HB2      HIS  31   3.958  -4.418  -1.403
  206    HB3  HIS  31           HB1      HIS  31   4.620  -3.427  -2.700
  207    HD1  HIS  31           HD1      HIS  31   3.190  -2.587   0.758
  208    HD2  HIS  31           HD2      HIS  31   6.468  -1.804  -1.679
  209    HE1  HIS  31           HE1      HIS  31   4.686  -0.993   2.056
  210    H    GLU  32           HN       GLU  32   3.286  -2.596  -4.625
  211    HA   GLU  32           HA       GLU  32   3.895   0.172  -4.419
  212    HB2  GLU  32           HB2      GLU  32   3.340  -1.373  -6.947
  213    HB3  GLU  32           HB1      GLU  32   4.338   0.063  -6.769
  214    HG2  GLU  32           HG2      GLU  32   6.063  -1.118  -5.745
  215    HG3  GLU  32           HG1      GLU  32   5.019  -2.486  -5.356
  216    H    ASP  33           HN       ASP  33   1.234  -1.668  -5.791
  217    HA   ASP  33           HA       ASP  33  -0.202   0.512  -6.875
  218    HB2  ASP  33           HB2      ASP  33  -1.163  -2.232  -6.026
  219    HB3  ASP  33           HB1      ASP  33  -2.075  -1.109  -7.025
  220    H    CYS  34           HN       CYS  34   0.044  -0.892  -3.736
  221    HA   CYS  34           HA       CYS  34  -2.359   0.258  -2.680
  222    HB2  CYS  34           HB2      CYS  34  -0.015  -1.215  -1.502
  223    HB3  CYS  34           HB1      CYS  34  -1.206  -0.440  -0.460
  224    H    HIS  35           HN       HIS  35   0.636   1.554  -3.453
  225    HA   HIS  35           HA       HIS  35   0.337   3.721  -1.487
  226    HB2  HIS  35           HB2      HIS  35   2.634   2.967  -3.295
  227    HB3  HIS  35           HB1      HIS  35   2.575   4.483  -2.404
  228    HD1  HIS  35           HD1      HIS  35   2.939   4.339   0.194
  229    HD2  HIS  35           HD2      HIS  35   3.139   0.708  -1.812
  230    HE1  HIS  35           HE1      HIS  35   4.043   2.705   1.782
  231    H    ILE  36           HN       ILE  36   0.468   3.037  -4.944
  232    HA   ILE  36           HA       ILE  36  -0.603   5.701  -5.464
  233    HB   ILE  36           HB       ILE  36   0.919   5.745  -7.558
  234   HG12  ILE  36          HG12      ILE  36   3.251   4.767  -6.822
  235   HG13  ILE  36          HG11      ILE  36   2.268   3.671  -5.865
  236   HG21  ILE  36          HG21      ILE  36   1.985   6.301  -4.797
  237   HG22  ILE  36          HG22      ILE  36   1.060   7.396  -5.826
  238   HG23  ILE  36          HG23      ILE  36   2.690   6.916  -6.292
  239   HD11  ILE  36          HD11      ILE  36   2.167   4.008  -8.854
  240   HD12  ILE  36          HD12      ILE  36   1.120   2.944  -7.913
  241   HD13  ILE  36          HD13      ILE  36   2.860   2.651  -7.967
  242    HA   PRO  37           HA       PRO  37  -1.420   6.858  -6.871
  243    HB2  PRO  37           HB2      PRO  37  -4.221   6.943  -7.648
  244    HB3  PRO  37           HB1      PRO  37  -2.840   7.731  -8.426
  245    HG2  PRO  37           HG2      PRO  37  -4.241   5.682  -9.561
  246    HG3  PRO  37           HG1      PRO  37  -2.530   6.006  -9.903
  247    HD2  PRO  37           HD2      PRO  37  -3.748   3.957  -8.080
  248    HD3  PRO  37           HD1      PRO  37  -2.355   3.807  -9.178
  249    HA   PRO  38           HA       PRO  38  -3.360   6.227  -2.901
  250    HB2  PRO  38           HB2      PRO  38  -3.170   8.772  -1.965
  251    HB3  PRO  38           HB1      PRO  38  -1.799   7.657  -2.006
  252    HG2  PRO  38           HG2      PRO  38  -2.510   9.866  -3.898
  253    HG3  PRO  38           HG1      PRO  38  -0.917   9.399  -3.271
  254    HD2  PRO  38           HD2      PRO  38  -1.791   8.704  -5.758
  255    HD3  PRO  38           HD1      PRO  38  -0.669   7.698  -4.815
  256    H    VAL  39           HN       VAL  39  -5.477   6.175  -2.408
  257    HA   VAL  39           HA       VAL  39  -7.363   7.545  -4.035
  258    HB   VAL  39           HB       VAL  39  -9.074   6.579  -2.471
  259   HG11  VAL  39          HG11      VAL  39  -7.035   4.682  -3.624
  260   HG12  VAL  39          HG12      VAL  39  -8.417   5.382  -4.468
  261   HG13  VAL  39          HG13      VAL  39  -8.674   4.244  -3.145
  262   HG21  VAL  39          HG21      VAL  39  -6.665   5.320  -1.168
  263   HG22  VAL  39          HG22      VAL  39  -8.351   4.938  -0.819
  264   HG23  VAL  39          HG23      VAL  39  -7.713   6.539  -0.445
  265    H    GLU  40           HN       GLU  40  -8.194   9.499  -3.783
  266    HA   GLU  40           HA       GLU  40  -7.328  11.075  -1.511
  267    HB2  GLU  40           HB2      GLU  40  -8.881  11.883  -3.976
  268    HB3  GLU  40           HB1      GLU  40  -8.210  12.983  -2.785
  269    HG2  GLU  40           HG2      GLU  40  -5.976  12.381  -3.388
  270    HG3  GLU  40           HG1      GLU  40  -6.561  11.094  -4.445
  271    H    ALA  41           HN       ALA  41 -10.307   9.764  -2.800
  272    HA   ALA  41           HA       ALA  41 -11.921  11.298  -0.938
  273    HB1  ALA  41           HB1      ALA  41 -12.762   9.224  -2.959
  274    HB2  ALA  41           HB2      ALA  41 -12.753  10.968  -3.211
  275    HB3  ALA  41           HB3      ALA  41 -13.841  10.256  -2.021
  276    H    GLU  42           HN       GLU  42 -10.976   7.958  -1.519
  277    HA   GLU  42           HA       GLU  42 -12.352   7.142   0.936
  278    HB2  GLU  42           HB2      GLU  42 -11.144   5.476  -1.280
  279    HB3  GLU  42           HB1      GLU  42 -12.003   4.841   0.115
  280    HG2  GLU  42           HG2      GLU  42 -14.041   5.943  -0.603
  281    HG3  GLU  42           HG1      GLU  42 -13.188   6.663  -1.969
  282    H    ARG  43           HN       ARG  43 -10.055   8.692   1.170
  283    HA   ARG  43           HA       ARG  43  -7.770   7.050   1.659
  284    HB2  ARG  43           HB2      ARG  43  -6.856   9.145   2.728
  285    HB3  ARG  43           HB1      ARG  43  -7.314   9.282   1.038
  286    HG2  ARG  43           HG2      ARG  43  -9.366  10.405   1.648
  287    HG3  ARG  43           HG1      ARG  43  -8.993  10.204   3.362
  288    HD2  ARG  43           HD2      ARG  43  -6.972  11.568   3.068
  289    HD3  ARG  43           HD1      ARG  43  -7.365  11.768   1.362
  290    HE   ARG  43           HE       ARG  43  -9.567  12.649   2.799
  291   HH11  ARG  43          HH11      ARG  43  -6.199  13.530   2.409
  292   HH12  ARG  43          HH12      ARG  43  -6.464  15.210   2.744
  293   HH21  ARG  43          HH21      ARG  43  -9.920  14.872   3.250
  294   HH22  ARG  43          HH22      ARG  43  -8.580  15.977   3.217
  295    H    THR  44           HN       THR  44  -8.956   5.517   2.988
  296    HA   THR  44           HA       THR  44  -9.105   6.381   5.795
  297    HB   THR  44           HB       THR  44 -10.602   4.368   6.089
  298    HG1  THR  44           HG1      THR  44  -9.909   3.411   4.018
  299   HG21  THR  44          HG21      THR  44 -11.524   6.622   5.949
  300   HG22  THR  44          HG22      THR  44 -12.578   5.482   5.114
  301   HG23  THR  44          HG23      THR  44 -11.511   6.536   4.188
  302    HA   PRO  45           HA       PRO  45  -5.411   3.747   5.778
  303    HB2  PRO  45           HB2      PRO  45  -5.162   4.725   8.547
  304    HB3  PRO  45           HB1      PRO  45  -4.018   4.842   7.205
  305    HG2  PRO  45           HG2      PRO  45  -5.350   6.993   8.092
  306    HG3  PRO  45           HG1      PRO  45  -4.986   6.767   6.371
  307    HD2  PRO  45           HD2      PRO  45  -7.560   6.295   7.839
  308    HD3  PRO  45           HD1      PRO  45  -7.292   7.043   6.245
  309    H    TRP  46           HN       TRP  46  -8.048   3.770   8.068
  310    HA   TRP  46           HA       TRP  46  -7.162   1.295   9.312
  311    HB2  TRP  46           HB2      TRP  46  -9.129   1.536  10.762
  312    HB3  TRP  46           HB1      TRP  46  -8.188   3.022  10.733
  313    HD1  TRP  46           HD1      TRP  46 -11.565   1.586   9.685
  314    HE1  TRP  46           HE1      TRP  46 -13.144   3.519   9.072
  315    HE3  TRP  46           HE3      TRP  46  -8.217   5.451   9.822
  316    HZ2  TRP  46           HZ2      TRP  46 -13.000   6.303   8.701
  317    HZ3  TRP  46           HZ3      TRP  46  -9.028   7.723   9.321
  318    HH2  TRP  46           HH2      TRP  46 -11.363   8.137   8.771
  319    H    ASN  47           HN       ASN  47  -8.402   1.853   6.445
  320    HA   ASN  47           HA       ASN  47 -10.002  -0.612   6.455
  321    HB2  ASN  47           HB2      ASN  47 -11.544   1.320   6.288
  322    HB3  ASN  47           HB1      ASN  47 -10.654   1.904   4.889
  323   HD21  ASN  47          HD21      ASN  47 -12.893  -0.493   6.063
  324   HD22  ASN  47          HD22      ASN  47 -13.366  -1.094   4.508
  325    H    CYS  48           HN       CYS  48  -9.520  -2.004   4.788
  326    HA   CYS  48           HA       CYS  48  -7.288  -1.188   3.084
  327    HB2  CYS  48           HB2      CYS  48  -7.117  -3.296   4.397
  328    HB3  CYS  48           HB1      CYS  48  -8.500  -3.935   3.518
  329    H    ILE  49           HN       ILE  49  -7.645  -0.601   1.032
  330    HA   ILE  49           HA       ILE  49 -10.319  -0.755  -0.010
  331    HB   ILE  49           HB       ILE  49  -9.372   0.412  -2.020
  332   HG12  ILE  49          HG12      ILE  49  -6.873   0.650  -0.343
  333   HG13  ILE  49          HG11      ILE  49  -7.029  -0.448  -1.711
  334   HG21  ILE  49          HG21      ILE  49  -8.919   1.677   0.681
  335   HG22  ILE  49          HG22      ILE  49 -10.426   1.658  -0.234
  336   HG23  ILE  49          HG23      ILE  49  -9.034   2.554  -0.843
  337   HD11  ILE  49          HD11      ILE  49  -7.264   2.552  -1.827
  338   HD12  ILE  49          HD12      ILE  49  -7.376   1.447  -3.197
  339   HD13  ILE  49          HD13      ILE  49  -5.858   1.606  -2.314
  340    H    PHE  50           HN       PHE  50  -7.427  -2.586  -0.388
  341    HA   PHE  50           HA       PHE  50  -8.242  -3.735  -2.907
  342    HB2  PHE  50           HB2      PHE  50  -5.859  -4.061  -1.157
  343    HB3  PHE  50           HB1      PHE  50  -6.289  -5.408  -2.215
  344    HD1  PHE  50           HD2      PHE  50  -5.454  -1.807  -2.165
  345    HD2  PHE  50           HD1      PHE  50  -5.861  -5.316  -4.534
  346    HE1  PHE  50           HE2      PHE  50  -4.363  -0.660  -4.047
  347    HE2  PHE  50           HE1      PHE  50  -4.767  -4.178  -6.418
  348    HZ   PHE  50           HZ       PHE  50  -4.100  -1.841  -6.221
  349    H    CYS  51           HN       CYS  51  -8.545  -4.491   0.475
  350    HA   CYS  51           HA       CYS  51  -9.273  -7.203   0.231
  351    HB2  CYS  51           HB2      CYS  51  -9.557  -5.105   2.303
  352    HB3  CYS  51           HB1      CYS  51 -10.658  -6.469   2.420
  353    H    ARG  52           HN       ARG  52 -11.066  -4.252  -0.316
  354    HA   ARG  52           HA       ARG  52 -13.515  -5.814  -0.661
  355    HB2  ARG  52           HB2      ARG  52 -14.724  -3.729  -0.734
  356    HB3  ARG  52           HB1      ARG  52 -13.667  -3.724   0.667
  357    HG2  ARG  52           HG2      ARG  52 -12.145  -2.227  -0.384
  358    HG3  ARG  52           HG1      ARG  52 -12.968  -2.390  -1.936
  359    HD2  ARG  52           HD2      ARG  52 -14.136  -1.179   0.568
  360    HD3  ARG  52           HD1      ARG  52 -13.548  -0.286  -0.833
  361    HE   ARG  52           HE       ARG  52 -15.498  -2.142  -1.661
  362   HH11  ARG  52          HH11      ARG  52 -15.188   0.864   0.094
  363   HH12  ARG  52          HH12      ARG  52 -16.800   1.393  -0.271
  364   HH21  ARG  52          HH21      ARG  52 -17.613  -1.455  -2.158
  365   HH22  ARG  52          HH22      ARG  52 -18.183   0.069  -1.555
  366    H    MET  53           HN       MET  53 -10.935  -5.148  -2.412
  367    HA   MET  53           HA       MET  53 -12.288  -4.436  -4.893
  368    HB2  MET  53           HB2      MET  53 -10.197  -3.300  -4.471
  369    HB3  MET  53           HB1      MET  53  -9.372  -4.829  -4.211
  370    HG2  MET  53           HG2      MET  53  -8.872  -3.801  -6.391
  371    HG3  MET  53           HG1      MET  53  -9.582  -5.408  -6.524
  372    HE1  MET  53           HE1      MET  53 -11.682  -2.259  -5.559
  373    HE2  MET  53           HE2      MET  53 -12.118  -1.600  -7.135
  374    HE3  MET  53           HE3      MET  53 -10.441  -1.544  -6.590
  375    H    LYS  54           HN       LYS  54 -10.481  -7.094  -3.446
  376    HA   LYS  54           HA       LYS  54 -10.174  -9.258  -4.014
  377    HB2  LYS  54           HB2      LYS  54 -12.623  -9.327  -3.821
  378    HB3  LYS  54           HB1      LYS  54 -12.771  -8.861  -5.507
  379    HG2  LYS  54           HG2      LYS  54 -11.695 -10.933  -6.193
  380    HG3  LYS  54           HG1      LYS  54 -11.517 -11.410  -4.502
  381    HD2  LYS  54           HD2      LYS  54 -13.938 -11.418  -4.240
  382    HD3  LYS  54           HD1      LYS  54 -14.132 -10.896  -5.914
  383    HE2  LYS  54           HE2      LYS  54 -12.866 -13.475  -5.000
  384    HE3  LYS  54           HE1      LYS  54 -14.485 -13.303  -5.676
  385    HZ1  LYS  54           HZ1      LYS  54 -12.873 -14.042  -7.330
  386    HZ2  LYS  54           HZ2      LYS  54 -11.964 -12.639  -7.097
  387    HZ3  LYS  54           HZ3      LYS  54 -13.522 -12.538  -7.741
  388    H    GLU  55           HN       GLU  55  -8.313  -8.974  -5.198
  389    HA   GLU  55           HA       GLU  55  -8.639  -9.259  -8.089
  390    HB2  GLU  55           HB2      GLU  55  -8.199  -6.874  -7.649
  391    HB3  GLU  55           HB1      GLU  55  -6.729  -7.310  -6.790
  392    HG2  GLU  55           HG2      GLU  55  -6.261  -6.522  -9.045
  393    HG3  GLU  55           HG1      GLU  55  -5.773  -8.204  -8.832
  394    H    SER  56           HN       SER  56  -7.660 -11.055  -8.646
  395    HA   SER  56           HA       SER  56  -4.974 -11.620  -7.753
  396    HB2  SER  56           HB2      SER  56  -6.436 -12.679  -6.021
  397    HB3  SER  56           HB1      SER  56  -7.181 -13.646  -7.290
  398    HG   SER  56           HG       SER  56  -5.599 -14.980  -7.022
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1   4.531 -13.174  12.393
    2    H2   GLY   1           HT2      GLY   1   3.821 -12.519  13.777
    3    H3   GLY   1           HT3      GLY   1   4.806 -11.557  12.794
    4    HA2  GLY   1           HA1      GLY   1   2.194 -12.722  12.018
    5    HA3  GLY   1           HA2      GLY   1   2.476 -11.040  12.439
    6    H    ALA   2           HN       ALA   2   2.894  -9.681  10.824
    7    HA   ALA   2           HA       ALA   2   4.052 -10.751   8.347
    8    HB1  ALA   2           HB1      ALA   2   1.581  -9.022   8.493
    9    HB2  ALA   2           HB2      ALA   2   1.645 -10.717   8.006
   10    HB3  ALA   2           HB3      ALA   2   2.421  -9.484   7.017
   11    H    MET   3           HN       MET   3   4.864  -8.973  10.687
   12    HA   MET   3           HA       MET   3   5.307  -6.423   9.320
   13    HB2  MET   3           HB2      MET   3   4.436  -6.493  11.678
   14    HB3  MET   3           HB1      MET   3   5.977  -7.176  12.173
   15    HG2  MET   3           HG2      MET   3   6.032  -4.859  12.671
   16    HG3  MET   3           HG1      MET   3   7.083  -5.119  11.280
   17    HE1  MET   3           HE1      MET   3   7.087  -2.532  10.728
   18    HE2  MET   3           HE2      MET   3   6.063  -2.238  12.133
   19    HE3  MET   3           HE3      MET   3   5.621  -1.563  10.565
   20    H    GLY   4           HN       GLY   4   6.832  -9.344   9.654
   21    HA2  GLY   4           HA2      GLY   4   9.514  -8.408  10.150
   22    HA3  GLY   4           HA1      GLY   4   9.044 -10.046   9.724
   23    H    MET   5           HN       MET   5   7.935  -9.915   7.332
   24    HA   MET   5           HA       MET   5  10.138  -8.920   5.680
   25    HB2  MET   5           HB2      MET   5   9.673 -11.309   5.475
   26    HB3  MET   5           HB1      MET   5   8.001 -10.966   5.052
   27    HG2  MET   5           HG2      MET   5   9.382 -11.544   3.104
   28    HG3  MET   5           HG1      MET   5   8.677  -9.934   2.988
   29    HE1  MET   5           HE1      MET   5  11.813 -11.090   5.116
   30    HE2  MET   5           HE2      MET   5  13.110 -10.774   3.965
   31    HE3  MET   5           HE3      MET   5  11.916 -12.024   3.626
   32    H    ARG   6           HN       ARG   6   9.415  -6.772   5.717
   33    HA   ARG   6           HA       ARG   6   7.107  -6.254   3.966
   34    HB2  ARG   6           HB2      ARG   6   8.404  -4.486   6.052
   35    HB3  ARG   6           HB1      ARG   6   7.152  -3.947   4.942
   36    HG2  ARG   6           HG2      ARG   6   5.565  -5.470   5.900
   37    HG3  ARG   6           HG1      ARG   6   6.814  -6.198   6.912
   38    HD2  ARG   6           HD2      ARG   6   5.390  -4.623   8.158
   39    HD3  ARG   6           HD1      ARG   6   7.079  -4.128   8.134
   40    HE   ARG   6           HE       ARG   6   6.467  -2.487   6.434
   41   HH11  ARG   6          HH11      ARG   6   3.855  -3.898   8.299
   42   HH12  ARG   6          HH12      ARG   6   2.816  -2.520   8.111
   43   HH21  ARG   6          HH21      ARG   6   5.097  -0.675   6.195
   44   HH22  ARG   6          HH22      ARG   6   3.518  -0.698   6.916
   45    H    ASN   7           HN       ASN   7   8.376  -6.639   2.110
   46    HA   ASN   7           HA       ASN   7  10.827  -5.291   1.621
   47    HB2  ASN   7           HB2      ASN   7  10.109  -7.426   0.503
   48    HB3  ASN   7           HB1      ASN   7   8.962  -6.479  -0.441
   49   HD21  ASN   7          HD21      ASN   7   9.730  -5.135  -2.088
   50   HD22  ASN   7          HD22      ASN   7  11.364  -5.220  -2.658
   51    H    LEU   8           HN       LEU   8  10.674  -3.138   1.837
   52    HA   LEU   8           HA       LEU   8   8.931  -1.724  -0.058
   53    HB2  LEU   8           HB2      LEU   8   8.890   0.121   1.720
   54    HB3  LEU   8           HB1      LEU   8   7.906  -1.299   2.001
   55    HG   LEU   8           HG       LEU   8   9.889  -2.141   3.423
   56   HD11  LEU   8          HD11      LEU   8  10.511   0.806   3.371
   57   HD12  LEU   8          HD12      LEU   8  11.520  -0.482   2.711
   58   HD13  LEU   8          HD13      LEU   8  11.234  -0.387   4.449
   59   HD21  LEU   8          HD21      LEU   8   9.031  -0.963   5.384
   60   HD22  LEU   8          HD22      LEU   8   7.725  -1.502   4.330
   61   HD23  LEU   8          HD23      LEU   8   8.211   0.192   4.332
   62    H    ASP   9           HN       ASP   9  11.724  -2.622  -0.144
   63    HA   ASP   9           HA       ASP   9  13.400  -0.333   0.254
   64    HB2  ASP   9           HB2      ASP   9  14.258  -2.598   0.589
   65    HB3  ASP   9           HB1      ASP   9  13.966  -2.973  -1.104
   66    H    GLU  10           HN       GLU  10  11.930  -1.931  -2.516
   67    HA   GLU  10           HA       GLU  10  13.089  -0.004  -4.363
   68    HB2  GLU  10           HB2      GLU  10  11.255  -2.364  -4.770
   69    HB3  GLU  10           HB1      GLU  10  11.734  -1.285  -6.069
   70    HG2  GLU  10           HG2      GLU  10  13.738  -2.720  -4.370
   71    HG3  GLU  10           HG1      GLU  10  13.034  -3.443  -5.816
   72    H    CYS  11           HN       CYS  11  10.910   0.419  -2.213
   73    HA   CYS  11           HA       CYS  11   8.826   1.594  -3.907
   74    HB2  CYS  11           HB2      CYS  11   8.090  -0.013  -2.210
   75    HB3  CYS  11           HB1      CYS  11   8.853   0.949  -0.958
   76    H    GLU  12           HN       GLU  12   9.726   3.513  -4.479
   77    HA   GLU  12           HA       GLU  12  11.315   5.144  -2.859
   78    HB2  GLU  12           HB2      GLU  12   9.585   5.935  -5.202
   79    HB3  GLU  12           HB1      GLU  12  10.905   6.886  -4.535
   80    HG2  GLU  12           HG2      GLU  12  11.220   4.144  -5.731
   81    HG3  GLU  12           HG1      GLU  12  11.494   5.652  -6.600
   82    H    VAL  13           HN       VAL  13   7.848   4.955  -3.277
   83    HA   VAL  13           HA       VAL  13   7.281   7.432  -2.050
   84    HB   VAL  13           HB       VAL  13   5.641   6.488  -3.506
   85   HG11  VAL  13          HG11      VAL  13   5.394   4.207  -1.568
   86   HG12  VAL  13          HG12      VAL  13   6.121   4.130  -3.174
   87   HG13  VAL  13          HG13      VAL  13   4.400   4.466  -2.998
   88   HG21  VAL  13          HG21      VAL  13   3.649   6.712  -2.184
   89   HG22  VAL  13          HG22      VAL  13   4.856   7.863  -1.605
   90   HG23  VAL  13          HG23      VAL  13   4.552   6.373  -0.710
   91    H    CYS  14           HN       CYS  14   7.747   4.182  -0.764
   92    HA   CYS  14           HA       CYS  14   6.868   4.730   1.870
   93    HB2  CYS  14           HB2      CYS  14   8.500   2.656   0.576
   94    HB3  CYS  14           HB1      CYS  14   8.912   2.958   2.258
   95    H    ARG  15           HN       ARG  15   9.821   5.315   0.155
   96    HA   ARG  15           HA       ARG  15  11.374   6.111   2.412
   97    HB2  ARG  15           HB2      ARG  15  11.771   6.801  -0.501
   98    HB3  ARG  15           HB1      ARG  15  12.983   6.907   0.769
   99    HG2  ARG  15           HG2      ARG  15  12.994   4.519   1.035
  100    HG3  ARG  15           HG1      ARG  15  11.655   4.352  -0.100
  101    HD2  ARG  15           HD2      ARG  15  13.714   3.808  -1.220
  102    HD3  ARG  15           HD1      ARG  15  13.087   5.325  -1.864
  103    HE   ARG  15           HE       ARG  15  14.958   5.715   0.264
  104   HH11  ARG  15          HH11      ARG  15  14.609   5.190  -3.183
  105   HH12  ARG  15          HH12      ARG  15  16.182   5.831  -3.559
  106   HH21  ARG  15          HH21      ARG  15  17.017   6.563  -0.232
  107   HH22  ARG  15          HH22      ARG  15  17.553   6.600  -1.882
  108    H    ASP  16           HN       ASP  16   9.392   7.765   0.034
  109    HA   ASP  16           HA       ASP  16   9.903  10.390   1.040
  110    HB2  ASP  16           HB2      ASP  16   7.817   9.262  -0.813
  111    HB3  ASP  16           HB1      ASP  16   7.778  10.945  -0.302
  112    H    GLY  17           HN       GLY  17   8.444   7.934   2.553
  113    HA2  GLY  17           HA2      GLY  17   7.348   7.991   4.597
  114    HA3  GLY  17           HA1      GLY  17   7.159   9.728   4.411
  115    H    GLY  18           HN       GLY  18   6.130   7.671   1.836
  116    HA2  GLY  18           HA2      GLY  18   3.452   8.594   1.963
  117    HA3  GLY  18           HA1      GLY  18   4.052   7.304   0.938
  118    H    GLU  19           HN       GLU  19   1.547   7.370   2.259
  119    HA   GLU  19           HA       GLU  19   1.868   5.465   4.465
  120    HB2  GLU  19           HB2      GLU  19  -0.473   7.173   3.620
  121    HB3  GLU  19           HB1      GLU  19  -0.537   6.008   4.938
  122    HG2  GLU  19           HG2      GLU  19   1.331   7.273   6.028
  123    HG3  GLU  19           HG1      GLU  19   1.164   8.488   4.764
  124    H    LEU  20           HN       LEU  20   0.508   3.631   4.607
  125    HA   LEU  20           HA       LEU  20  -0.021   2.423   2.004
  126    HB2  LEU  20           HB2      LEU  20   0.393   1.363   4.769
  127    HB3  LEU  20           HB1      LEU  20  -0.458   0.384   3.591
  128    HG   LEU  20           HG       LEU  20   2.311   1.483   3.105
  129   HD11  LEU  20          HD11      LEU  20   3.131  -0.745   3.705
  130   HD12  LEU  20          HD12      LEU  20   1.502  -1.216   4.190
  131   HD13  LEU  20          HD13      LEU  20   2.358   0.045   5.078
  132   HD21  LEU  20          HD21      LEU  20   2.381  -0.301   1.421
  133   HD22  LEU  20          HD22      LEU  20   1.066   0.829   1.105
  134   HD23  LEU  20          HD23      LEU  20   0.724  -0.746   1.821
  135    H    PHE  21           HN       PHE  21  -2.022   1.911   1.293
  136    HA   PHE  21           HA       PHE  21  -4.269   2.400   3.138
  137    HB2  PHE  21           HB2      PHE  21  -4.156   2.684   0.115
  138    HB3  PHE  21           HB1      PHE  21  -5.615   2.877   1.087
  139    HD1  PHE  21           HD2      PHE  21  -2.357   4.326   0.241
  140    HD2  PHE  21           HD1      PHE  21  -5.979   4.854   2.415
  141    HE1  PHE  21           HE2      PHE  21  -1.823   6.702   0.558
  142    HE2  PHE  21           HE1      PHE  21  -5.453   7.229   2.723
  143    HZ   PHE  21           HZ       PHE  21  -3.333   8.128   1.929
  144    H    CYS  22           HN       CYS  22  -2.797  -0.005   2.975
  145    HA   CYS  22           HA       CYS  22  -4.914  -1.830   2.099
  146    HB2  CYS  22           HB2      CYS  22  -2.017  -1.899   1.367
  147    HB3  CYS  22           HB1      CYS  22  -2.880  -3.420   1.576
  148    H    CYS  23           HN       CYS  23  -4.931  -3.846   3.172
  149    HA   CYS  23           HA       CYS  23  -3.970  -3.744   5.895
  150    HB2  CYS  23           HB2      CYS  23  -5.328  -5.680   6.259
  151    HB3  CYS  23           HB1      CYS  23  -6.251  -4.641   5.176
  152    H    ASP  24           HN       ASP  24  -2.885  -5.875   6.714
  153    HA   ASP  24           HA       ASP  24  -0.323  -5.931   5.681
  154    HB2  ASP  24           HB2      ASP  24  -1.799  -7.933   7.376
  155    HB3  ASP  24           HB1      ASP  24  -0.119  -8.177   6.913
  156    H    THR  25           HN       THR  25  -2.920  -8.270   5.078
  157    HA   THR  25           HA       THR  25  -1.409 -10.088   3.588
  158    HB   THR  25           HB       THR  25  -4.366  -9.548   3.325
  159    HG1  THR  25           HG1      THR  25  -4.459 -10.245   5.313
  160   HG21  THR  25          HG21      THR  25  -4.491 -11.922   2.716
  161   HG22  THR  25          HG22      THR  25  -2.735 -12.042   2.822
  162   HG23  THR  25          HG23      THR  25  -3.476 -11.022   1.590
  163    H    CYS  26           HN       CYS  26  -3.418  -7.356   2.458
  164    HA   CYS  26           HA       CYS  26  -2.856  -7.908  -0.292
  165    HB2  CYS  26           HB2      CYS  26  -3.962  -5.394   0.966
  166    HB3  CYS  26           HB1      CYS  26  -3.953  -5.750  -0.753
  167    H    SER  27           HN       SER  27  -1.442  -5.784   2.137
  168    HA   SER  27           HA       SER  27  -0.038  -4.083   0.388
  169    HB2  SER  27           HB2      SER  27  -0.425  -3.491   2.720
  170    HB3  SER  27           HB1      SER  27   0.553  -4.855   3.255
  171    HG   SER  27           HG       SER  27   2.138  -3.492   3.187
  172    H    ARG  28           HN       ARG  28   0.735  -7.225   1.740
  173    HA   ARG  28           HA       ARG  28   3.491  -7.149   1.024
  174    HB2  ARG  28           HB2      ARG  28   1.658  -9.428   1.769
  175    HB3  ARG  28           HB1      ARG  28   3.385  -9.622   1.489
  176    HG2  ARG  28           HG2      ARG  28   3.913  -8.210   3.345
  177    HG3  ARG  28           HG1      ARG  28   2.219  -7.770   3.556
  178    HD2  ARG  28           HD2      ARG  28   2.791  -9.390   5.216
  179    HD3  ARG  28           HD1      ARG  28   1.721 -10.158   4.048
  180    HE   ARG  28           HE       ARG  28   4.441 -10.595   3.367
  181   HH11  ARG  28          HH11      ARG  28   1.936 -11.629   5.583
  182   HH12  ARG  28          HH12      ARG  28   2.662 -13.176   5.882
  183   HH21  ARG  28          HH21      ARG  28   5.394 -12.633   3.753
  184   HH22  ARG  28          HH22      ARG  28   4.623 -13.753   4.835
  185    H    VAL  29           HN       VAL  29   0.625  -7.747  -0.733
  186    HA   VAL  29           HA       VAL  29   2.076  -9.236  -2.800
  187    HB   VAL  29           HB       VAL  29  -0.901  -8.810  -2.528
  188   HG11  VAL  29          HG11      VAL  29  -1.091 -10.566  -4.221
  189   HG12  VAL  29          HG12      VAL  29   0.666 -10.631  -4.353
  190   HG13  VAL  29          HG13      VAL  29  -0.200  -9.175  -4.843
  191   HG21  VAL  29          HG21      VAL  29  -0.948 -11.188  -1.872
  192   HG22  VAL  29          HG22      VAL  29  -0.076 -10.180  -0.718
  193   HG23  VAL  29          HG23      VAL  29   0.815 -11.195  -1.853
  194    H    PHE  30           HN       PHE  30   0.110  -6.320  -2.333
  195    HA   PHE  30           HA       PHE  30   0.919  -5.452  -5.038
  196    HB2  PHE  30           HB2      PHE  30  -1.632  -4.678  -3.596
  197    HB3  PHE  30           HB1      PHE  30  -1.170  -4.210  -5.228
  198    HD1  PHE  30           HD1      PHE  30  -0.815  -6.159  -6.907
  199    HD2  PHE  30           HD2      PHE  30  -3.011  -6.522  -3.275
  200    HE1  PHE  30           HE1      PHE  30  -1.978  -8.124  -7.812
  201    HE2  PHE  30           HE2      PHE  30  -4.173  -8.490  -4.176
  202    HZ   PHE  30           HZ       PHE  30  -3.717  -9.279  -6.405
  203    H    HIS  31           HN       HIS  31   2.566  -4.958  -2.924
  204    HA   HIS  31           HA       HIS  31   2.106  -2.855  -1.227
  205    HB2  HIS  31           HB2      HIS  31   4.074  -4.356  -1.177
  206    HB3  HIS  31           HB1      HIS  31   4.736  -3.501  -2.564
  207    HD1  HIS  31           HD1      HIS  31   3.589  -2.586   0.975
  208    HD2  HIS  31           HD2      HIS  31   6.470  -1.594  -1.852
  209    HE1  HIS  31           HE1      HIS  31   5.138  -0.912   2.087
  210    H    GLU  32           HN       GLU  32   3.440  -2.636  -4.514
  211    HA   GLU  32           HA       GLU  32   4.012   0.133  -4.398
  212    HB2  GLU  32           HB2      GLU  32   3.610  -1.759  -6.705
  213    HB3  GLU  32           HB1      GLU  32   4.024  -0.066  -6.931
  214    HG2  GLU  32           HG2      GLU  32   5.665  -2.057  -5.388
  215    HG3  GLU  32           HG1      GLU  32   5.979  -1.546  -7.045
  216    H    ASP  33           HN       ASP  33   1.211  -1.687  -5.451
  217    HA   ASP  33           HA       ASP  33  -0.163   0.607  -6.505
  218    HB2  ASP  33           HB2      ASP  33  -1.049  -2.225  -5.935
  219    HB3  ASP  33           HB1      ASP  33  -2.114  -1.003  -6.620
  220    H    CYS  34           HN       CYS  34   0.146  -0.965  -3.470
  221    HA   CYS  34           HA       CYS  34  -2.299   0.027  -2.343
  222    HB2  CYS  34           HB2      CYS  34   0.094  -1.435  -1.262
  223    HB3  CYS  34           HB1      CYS  34  -1.137  -0.788  -0.176
  224    H    HIS  35           HN       HIS  35   0.462   1.580  -3.157
  225    HA   HIS  35           HA       HIS  35   0.202   3.559  -1.002
  226    HB2  HIS  35           HB2      HIS  35   2.309   3.114  -3.110
  227    HB3  HIS  35           HB1      HIS  35   2.244   4.583  -2.137
  228    HD1  HIS  35           HD1      HIS  35   2.868   4.341   0.403
  229    HD2  HIS  35           HD2      HIS  35   3.133   0.830  -1.798
  230    HE1  HIS  35           HE1      HIS  35   4.140   2.696   1.841
  231    H    ILE  36           HN       ILE  36  -1.302   2.909  -3.751
  232    HA   ILE  36           HA       ILE  36  -1.591   5.729  -4.533
  233    HB   ILE  36           HB       ILE  36  -1.576   3.351  -6.399
  234   HG12  ILE  36          HG12      ILE  36   0.449   5.583  -6.111
  235   HG13  ILE  36          HG11      ILE  36   0.664   3.944  -5.508
  236   HG21  ILE  36          HG21      ILE  36  -1.821   6.300  -6.984
  237   HG22  ILE  36          HG22      ILE  36  -3.090   5.089  -7.160
  238   HG23  ILE  36          HG23      ILE  36  -1.663   5.028  -8.194
  239   HD11  ILE  36          HD11      ILE  36   0.328   4.721  -8.395
  240   HD12  ILE  36          HD12      ILE  36   0.577   3.087  -7.781
  241   HD13  ILE  36          HD13      ILE  36   1.847   4.296  -7.603
  242    HA   PRO  37           HA       PRO  37  -2.770   7.064  -5.158
  243    HB2  PRO  37           HB2      PRO  37  -4.813   8.707  -4.664
  244    HB3  PRO  37           HB1      PRO  37  -4.763   7.742  -6.153
  245    HG2  PRO  37           HG2      PRO  37  -6.333   7.288  -3.646
  246    HG3  PRO  37           HG1      PRO  37  -6.821   7.046  -5.335
  247    HD2  PRO  37           HD2      PRO  37  -5.935   5.042  -3.606
  248    HD3  PRO  37           HD1      PRO  37  -5.981   4.926  -5.378
  249    HA   PRO  38           HA       PRO  38  -1.755   8.013  -0.914
  250    HB2  PRO  38           HB2      PRO  38  -0.605  10.445  -1.300
  251    HB3  PRO  38           HB1      PRO  38   0.209   8.925  -1.688
  252    HG2  PRO  38           HG2      PRO  38  -1.225  10.830  -3.501
  253    HG3  PRO  38           HG1      PRO  38   0.301   9.965  -3.769
  254    HD2  PRO  38           HD2      PRO  38  -2.059   9.142  -4.842
  255    HD3  PRO  38           HD1      PRO  38  -0.770   8.006  -4.381
  256    H    VAL  39           HN       VAL  39  -2.442   9.405   0.779
  257    HA   VAL  39           HA       VAL  39  -5.013  10.528   0.351
  258    HB   VAL  39           HB       VAL  39  -4.624   9.501   2.469
  259   HG11  VAL  39          HG11      VAL  39  -2.251   9.809   2.735
  260   HG12  VAL  39          HG12      VAL  39  -3.088  10.457   4.144
  261   HG13  VAL  39          HG13      VAL  39  -2.466  11.550   2.909
  262   HG21  VAL  39          HG21      VAL  39  -5.417  11.223   3.975
  263   HG22  VAL  39          HG22      VAL  39  -6.178  11.395   2.392
  264   HG23  VAL  39          HG23      VAL  39  -4.867  12.476   2.862
  265    H    GLU  40           HN       GLU  40  -5.268  12.298  -0.724
  266    HA   GLU  40           HA       GLU  40  -3.853  14.711   0.119
  267    HB2  GLU  40           HB2      GLU  40  -4.199  13.848  -2.767
  268    HB3  GLU  40           HB1      GLU  40  -3.615  15.424  -2.253
  269    HG2  GLU  40           HG2      GLU  40  -1.664  14.402  -1.241
  270    HG3  GLU  40           HG1      GLU  40  -2.262  12.799  -1.664
  271    H    ALA  41           HN       ALA  41  -6.415  13.413  -1.986
  272    HA   ALA  41           HA       ALA  41  -8.062  15.752  -1.423
  273    HB1  ALA  41           HB1      ALA  41  -7.965  14.946  -3.735
  274    HB2  ALA  41           HB2      ALA  41  -9.601  14.839  -3.084
  275    HB3  ALA  41           HB3      ALA  41  -8.609  13.388  -3.218
  276    H    GLU  42           HN       GLU  42  -7.887  12.313  -0.820
  277    HA   GLU  42           HA       GLU  42  -9.492  12.465   1.509
  278    HB2  GLU  42           HB2      GLU  42 -11.353  11.046   0.748
  279    HB3  GLU  42           HB1      GLU  42 -11.309  12.574  -0.117
  280    HG2  GLU  42           HG2      GLU  42 -10.335  11.513  -2.042
  281    HG3  GLU  42           HG1      GLU  42 -10.224   9.979  -1.177
  282    H    ARG  43           HN       ARG  43 -10.371   9.685   1.281
  283    HA   ARG  43           HA       ARG  43  -9.687   7.545   1.449
  284    HB2  ARG  43           HB2      ARG  43  -7.275   8.658   0.104
  285    HB3  ARG  43           HB1      ARG  43  -7.178   7.065   0.845
  286    HG2  ARG  43           HG2      ARG  43  -9.250   7.853  -1.192
  287    HG3  ARG  43           HG1      ARG  43  -7.728   7.052  -1.583
  288    HD2  ARG  43           HD2      ARG  43  -9.420   5.364  -1.452
  289    HD3  ARG  43           HD1      ARG  43  -8.397   5.202  -0.027
  290    HE   ARG  43           HE       ARG  43 -10.810   6.791   0.302
  291   HH11  ARG  43          HH11      ARG  43  -9.293   3.650   0.671
  292   HH12  ARG  43          HH12      ARG  43 -10.460   3.087   1.829
  293   HH21  ARG  43          HH21      ARG  43 -12.321   6.056   1.834
  294   HH22  ARG  43          HH22      ARG  43 -12.169   4.460   2.501
  295    H    THR  44           HN       THR  44  -9.234   6.454   3.173
  296    HA   THR  44           HA       THR  44  -7.703   7.782   5.287
  297    HB   THR  44           HB       THR  44  -9.057   6.334   6.824
  298    HG1  THR  44           HG1      THR  44 -11.038   5.495   5.682
  299   HG21  THR  44          HG21      THR  44 -11.178   7.581   6.514
  300   HG22  THR  44          HG22      THR  44 -10.597   8.135   4.945
  301   HG23  THR  44          HG23      THR  44  -9.762   8.628   6.418
  302    HA   PRO  45           HA       PRO  45  -4.675   4.591   4.627
  303    HB2  PRO  45           HB2      PRO  45  -3.709   5.276   7.330
  304    HB3  PRO  45           HB1      PRO  45  -2.866   5.349   5.778
  305    HG2  PRO  45           HG2      PRO  45  -3.654   7.575   7.049
  306    HG3  PRO  45           HG1      PRO  45  -3.679   7.453   5.280
  307    HD2  PRO  45           HD2      PRO  45  -5.946   7.245   7.230
  308    HD3  PRO  45           HD1      PRO  45  -5.891   8.033   5.636
  309    H    TRP  46           HN       TRP  46  -6.865   4.611   7.316
  310    HA   TRP  46           HA       TRP  46  -5.966   1.966   8.177
  311    HB2  TRP  46           HB2      TRP  46  -7.605   2.237  10.034
  312    HB3  TRP  46           HB1      TRP  46  -6.385   3.502   9.989
  313    HD1  TRP  46           HD1      TRP  46 -10.131   2.936   9.644
  314    HE1  TRP  46           HE1      TRP  46 -11.324   5.213   9.627
  315    HE3  TRP  46           HE3      TRP  46  -6.047   5.993   9.278
  316    HZ2  TRP  46           HZ2      TRP  46 -10.628   7.938   9.480
  317    HZ3  TRP  46           HZ3      TRP  46  -6.402   8.426   9.200
  318    HH2  TRP  46           HH2      TRP  46  -8.639   9.374   9.296
  319    H    ASN  47           HN       ASN  47  -7.316   2.488   5.618
  320    HA   ASN  47           HA       ASN  47  -9.385   0.427   5.894
  321    HB2  ASN  47           HB2      ASN  47 -10.590   2.543   5.674
  322    HB3  ASN  47           HB1      ASN  47  -9.618   2.981   4.276
  323   HD21  ASN  47          HD21      ASN  47 -11.082  -0.172   4.983
  324   HD22  ASN  47          HD22      ASN  47 -12.123  -0.177   3.601
  325    H    CYS  48           HN       CYS  48  -9.153  -1.186   4.376
  326    HA   CYS  48           HA       CYS  48  -6.848  -0.928   2.629
  327    HB2  CYS  48           HB2      CYS  48  -7.232  -2.992   4.028
  328    HB3  CYS  48           HB1      CYS  48  -8.643  -3.341   3.035
  329    H    ILE  49           HN       ILE  49  -7.026  -0.306   0.581
  330    HA   ILE  49           HA       ILE  49  -9.634  -0.018  -0.600
  331    HB   ILE  49           HB       ILE  49  -8.362   0.844  -2.606
  332   HG12  ILE  49          HG12      ILE  49  -6.009   0.772  -0.717
  333   HG13  ILE  49          HG11      ILE  49  -6.220  -0.332  -2.072
  334   HG21  ILE  49          HG21      ILE  49  -9.351   2.361  -1.037
  335   HG22  ILE  49          HG22      ILE  49  -7.757   2.971  -1.481
  336   HG23  ILE  49          HG23      ILE  49  -7.994   2.170   0.071
  337   HD11  ILE  49          HD11      ILE  49  -5.950   2.663  -2.258
  338   HD12  ILE  49          HD12      ILE  49  -6.140   1.554  -3.616
  339   HD13  ILE  49          HD13      ILE  49  -4.689   1.482  -2.615
  340    H    PHE  50           HN       PHE  50  -7.046  -2.314  -0.822
  341    HA   PHE  50           HA       PHE  50  -7.945  -3.357  -3.352
  342    HB2  PHE  50           HB2      PHE  50  -5.679  -3.964  -1.542
  343    HB3  PHE  50           HB1      PHE  50  -6.291  -5.311  -2.507
  344    HD1  PHE  50           HD2      PHE  50  -4.957  -1.861  -2.727
  345    HD2  PHE  50           HD1      PHE  50  -5.843  -5.464  -4.803
  346    HE1  PHE  50           HE2      PHE  50  -3.782  -1.004  -4.705
  347    HE2  PHE  50           HE1      PHE  50  -4.673  -4.614  -6.789
  348    HZ   PHE  50           HZ       PHE  50  -3.641  -2.382  -6.745
  349    H    CYS  51           HN       CYS  51  -8.447  -4.083   0.031
  350    HA   CYS  51           HA       CYS  51  -9.786  -6.550  -0.381
  351    HB2  CYS  51           HB2      CYS  51  -9.685  -4.570   1.852
  352    HB3  CYS  51           HB1      CYS  51 -10.991  -5.748   1.848
  353    H    ARG  52           HN       ARG  52 -10.955  -3.188  -0.190
  354    HA   ARG  52           HA       ARG  52 -13.653  -3.891  -0.758
  355    HB2  ARG  52           HB2      ARG  52 -12.220  -1.237  -0.990
  356    HB3  ARG  52           HB1      ARG  52 -13.953  -1.447  -1.149
  357    HG2  ARG  52           HG2      ARG  52 -12.390  -2.127   1.337
  358    HG3  ARG  52           HG1      ARG  52 -13.209  -0.592   1.063
  359    HD2  ARG  52           HD2      ARG  52 -14.695  -1.869   2.364
  360    HD3  ARG  52           HD1      ARG  52 -15.331  -1.949   0.725
  361    HE   ARG  52           HE       ARG  52 -13.677  -4.120   1.824
  362   HH11  ARG  52          HH11      ARG  52 -16.678  -2.999   0.405
  363   HH12  ARG  52          HH12      ARG  52 -17.306  -4.599   0.170
  364   HH21  ARG  52          HH21      ARG  52 -14.524  -6.224   1.535
  365   HH22  ARG  52          HH22      ARG  52 -16.081  -6.428   0.799
  366    H    MET  53           HN       MET  53 -10.915  -3.781  -2.685
  367    HA   MET  53           HA       MET  53 -12.526  -3.397  -5.125
  368    HB2  MET  53           HB2      MET  53 -10.659  -1.722  -4.668
  369    HB3  MET  53           HB1      MET  53  -9.534  -3.046  -4.929
  370    HG2  MET  53           HG2      MET  53  -9.728  -1.741  -6.932
  371    HG3  MET  53           HG1      MET  53 -10.435  -3.334  -7.195
  372    HE1  MET  53           HE1      MET  53 -11.524  -2.279  -9.422
  373    HE2  MET  53           HE2      MET  53 -10.886  -0.681  -9.030
  374    HE3  MET  53           HE3      MET  53 -12.597  -0.880  -9.408
  375    H    LYS  54           HN       LYS  54 -12.315  -5.803  -3.640
  376    HA   LYS  54           HA       LYS  54 -10.686  -7.493  -5.406
  377    HB2  LYS  54           HB2      LYS  54 -10.059  -7.640  -3.029
  378    HB3  LYS  54           HB1      LYS  54 -11.715  -8.050  -2.615
  379    HG2  LYS  54           HG2      LYS  54 -11.537 -10.130  -3.868
  380    HG3  LYS  54           HG1      LYS  54  -9.882  -9.727  -4.320
  381    HD2  LYS  54           HD2      LYS  54  -9.954 -11.306  -2.449
  382    HD3  LYS  54           HD1      LYS  54  -9.212  -9.778  -1.981
  383    HE2  LYS  54           HE2      LYS  54 -10.747 -10.638  -0.264
  384    HE3  LYS  54           HE1      LYS  54 -11.261  -9.076  -0.897
  385    HZ1  LYS  54           HZ1      LYS  54 -12.885 -10.196  -2.276
  386    HZ2  LYS  54           HZ2      LYS  54 -13.111 -10.621  -0.655
  387    HZ3  LYS  54           HZ3      LYS  54 -12.370 -11.708  -1.719
  388    H    GLU  55           HN       GLU  55 -12.347  -7.398  -6.994
  389    HA   GLU  55           HA       GLU  55 -14.522  -9.279  -6.491
  390    HB2  GLU  55           HB2      GLU  55 -15.413  -7.013  -6.091
  391    HB3  GLU  55           HB1      GLU  55 -14.919  -6.546  -7.708
  392    HG2  GLU  55           HG2      GLU  55 -16.465  -8.201  -8.644
  393    HG3  GLU  55           HG1      GLU  55 -16.972  -8.630  -7.010
  394    H    SER  56           HN       SER  56 -13.041 -10.583  -7.763
  395    HA   SER  56           HA       SER  56 -13.733 -10.409 -10.561
  396    HB2  SER  56           HB2      SER  56 -11.553  -9.113 -10.246
  397    HB3  SER  56           HB1      SER  56 -10.811 -10.654  -9.820
  398    HG   SER  56           HG       SER  56 -11.041 -11.359 -11.850
  Start of MODEL   11
    1    H1   GLY   1           HT1      GLY   1  17.473  -6.203   5.721
    2    H2   GLY   1           HT2      GLY   1  17.936  -6.741   7.254
    3    H3   GLY   1           HT3      GLY   1  17.566  -7.859   6.043
    4    HA2  GLY   1           HA1      GLY   1  19.847  -5.970   5.996
    5    HA3  GLY   1           HA2      GLY   1  19.956  -7.684   6.374
    6    H    ALA   2           HN       ALA   2  19.488  -5.312   3.874
    7    HA   ALA   2           HA       ALA   2  20.101  -7.361   1.872
    8    HB1  ALA   2           HB1      ALA   2  17.659  -7.114   1.869
    9    HB2  ALA   2           HB2      ALA   2  18.371  -6.537   0.362
   10    HB3  ALA   2           HB3      ALA   2  17.838  -5.383   1.584
   11    H    MET   3           HN       MET   3  22.003  -5.775   2.777
   12    HA   MET   3           HA       MET   3  23.684  -4.433   2.077
   13    HB2  MET   3           HB2      MET   3  23.310  -5.541  -0.120
   14    HB3  MET   3           HB1      MET   3  22.174  -4.270  -0.541
   15    HG2  MET   3           HG2      MET   3  23.912  -2.626  -0.553
   16    HG3  MET   3           HG1      MET   3  25.074  -3.778   0.103
   17    HE1  MET   3           HE1      MET   3  22.370  -4.534  -2.692
   18    HE2  MET   3           HE2      MET   3  23.274  -4.095  -4.143
   19    HE3  MET   3           HE3      MET   3  22.826  -2.855  -2.974
   20    H    GLY   4           HN       GLY   4  22.342  -3.163   3.744
   21    HA2  GLY   4           HA2      GLY   4  22.627  -0.513   3.481
   22    HA3  GLY   4           HA1      GLY   4  21.067  -0.773   2.707
   23    H    MET   5           HN       MET   5  20.171   0.570   4.416
   24    HA   MET   5           HA       MET   5  19.758  -0.982   6.888
   25    HB2  MET   5           HB2      MET   5  19.872   2.000   6.472
   26    HB3  MET   5           HB1      MET   5  19.083   1.296   7.877
   27    HG2  MET   5           HG2      MET   5  21.153   0.257   8.566
   28    HG3  MET   5           HG1      MET   5  21.961   0.838   7.113
   29    HE1  MET   5           HE1      MET   5  20.263   1.870  10.512
   30    HE2  MET   5           HE2      MET   5  19.349   2.808   9.332
   31    HE3  MET   5           HE3      MET   5  20.423   3.626  10.466
   32    H    ARG   6           HN       ARG   6  18.064   1.740   5.337
   33    HA   ARG   6           HA       ARG   6  15.638   0.072   5.327
   34    HB2  ARG   6           HB2      ARG   6  15.896   3.087   5.402
   35    HB3  ARG   6           HB1      ARG   6  14.378   2.219   5.228
   36    HG2  ARG   6           HG2      ARG   6  14.751   1.169   7.422
   37    HG3  ARG   6           HG1      ARG   6  16.235   2.108   7.595
   38    HD2  ARG   6           HD2      ARG   6  14.971   4.173   7.513
   39    HD3  ARG   6           HD1      ARG   6  13.480   3.278   7.223
   40    HE   ARG   6           HE       ARG   6  14.779   2.471   9.635
   41   HH11  ARG   6          HH11      ARG   6  12.704   4.917   8.241
   42   HH12  ARG   6          HH12      ARG   6  11.953   5.320   9.749
   43   HH21  ARG   6          HH21      ARG   6  13.779   2.975  11.614
   44   HH22  ARG   6          HH22      ARG   6  12.558   4.209  11.674
   45    H    ASN   7           HN       ASN   7  16.869  -0.726   3.347
   46    HA   ASN   7           HA       ASN   7  16.792   1.028   1.051
   47    HB2  ASN   7           HB2      ASN   7  18.558  -0.785   1.464
   48    HB3  ASN   7           HB1      ASN   7  17.325  -1.944   0.980
   49   HD21  ASN   7          HD21      ASN   7  16.708  -2.050  -1.180
   50   HD22  ASN   7          HD22      ASN   7  17.578  -1.249  -2.436
   51    H    LEU   8           HN       LEU   8  14.756  -1.194   2.618
   52    HA   LEU   8           HA       LEU   8  12.524  -1.560   2.399
   53    HB2  LEU   8           HB2      LEU   8  12.683   0.472   0.180
   54    HB3  LEU   8           HB1      LEU   8  11.215  -0.083   0.957
   55    HG   LEU   8           HG       LEU   8  13.422   1.439   2.353
   56   HD11  LEU   8          HD11      LEU   8  11.812   3.306   2.355
   57   HD12  LEU   8          HD12      LEU   8  10.748   2.361   1.314
   58   HD13  LEU   8          HD13      LEU   8  12.335   2.858   0.732
   59   HD21  LEU   8          HD21      LEU   8  11.687   1.720   4.118
   60   HD22  LEU   8          HD22      LEU   8  12.236   0.059   3.919
   61   HD23  LEU   8          HD23      LEU   8  10.681   0.557   3.254
   62    H    ASP   9           HN       ASP   9  10.803  -1.817   0.390
   63    HA   ASP   9           HA       ASP   9  11.752  -4.198  -0.956
   64    HB2  ASP   9           HB2      ASP   9   9.564  -4.167   0.213
   65    HB3  ASP   9           HB1      ASP   9   8.996  -2.946  -0.917
   66    H    GLU  10           HN       GLU  10  12.544  -1.384  -1.721
   67    HA   GLU  10           HA       GLU  10  13.075  -0.221  -3.593
   68    HB2  GLU  10           HB2      GLU  10  11.537  -2.323  -5.123
   69    HB3  GLU  10           HB1      GLU  10  12.547  -1.073  -5.834
   70    HG2  GLU  10           HG2      GLU  10  13.530  -3.214  -3.965
   71    HG3  GLU  10           HG1      GLU  10  13.625  -3.296  -5.723
   72    H    CYS  11           HN       CYS  11  10.846   0.229  -1.954
   73    HA   CYS  11           HA       CYS  11   8.884   1.425  -3.768
   74    HB2  CYS  11           HB2      CYS  11   8.042  -0.102  -2.039
   75    HB3  CYS  11           HB1      CYS  11   8.785   0.890  -0.802
   76    H    GLU  12           HN       GLU  12   9.986   3.284  -4.355
   77    HA   GLU  12           HA       GLU  12  11.461   4.874  -2.553
   78    HB2  GLU  12           HB2      GLU  12  10.369   5.415  -5.296
   79    HB3  GLU  12           HB1      GLU  12  11.255   6.633  -4.389
   80    HG2  GLU  12           HG2      GLU  12  12.306   3.922  -5.173
   81    HG3  GLU  12           HG1      GLU  12  12.703   5.452  -5.949
   82    H    VAL  13           HN       VAL  13   8.079   4.752  -3.270
   83    HA   VAL  13           HA       VAL  13   7.505   7.340  -2.248
   84    HB   VAL  13           HB       VAL  13   5.914   6.317  -3.737
   85   HG11  VAL  13          HG11      VAL  13   4.605   4.391  -3.189
   86   HG12  VAL  13          HG12      VAL  13   5.401   4.244  -1.625
   87   HG13  VAL  13          HG13      VAL  13   6.312   3.974  -3.110
   88   HG21  VAL  13          HG21      VAL  13   3.864   6.708  -2.521
   89   HG22  VAL  13          HG22      VAL  13   5.081   7.890  -2.036
   90   HG23  VAL  13          HG23      VAL  13   4.712   6.521  -0.987
   91    H    CYS  14           HN       CYS  14   7.832   4.140  -0.798
   92    HA   CYS  14           HA       CYS  14   7.006   4.878   1.811
   93    HB2  CYS  14           HB2      CYS  14   8.526   2.657   0.620
   94    HB3  CYS  14           HB1      CYS  14   8.935   3.019   2.292
   95    H    ARG  15           HN       ARG  15   9.959   5.243   0.026
   96    HA   ARG  15           HA       ARG  15  11.644   6.122   2.113
   97    HB2  ARG  15           HB2      ARG  15  12.471   5.422  -0.091
   98    HB3  ARG  15           HB1      ARG  15  11.668   6.795  -0.834
   99    HG2  ARG  15           HG2      ARG  15  13.136   8.304   0.455
  100    HG3  ARG  15           HG1      ARG  15  13.985   6.888   1.085
  101    HD2  ARG  15           HD2      ARG  15  14.494   6.214  -1.240
  102    HD3  ARG  15           HD1      ARG  15  13.729   7.695  -1.809
  103    HE   ARG  15           HE       ARG  15  15.654   8.519  -0.035
  104   HH11  ARG  15          HH11      ARG  15  15.586   6.641  -2.996
  105   HH12  ARG  15          HH12      ARG  15  17.197   7.099  -3.466
  106   HH21  ARG  15          HH21      ARG  15  17.754   9.145  -0.669
  107   HH22  ARG  15          HH22      ARG  15  18.425   8.535  -2.147
  108    H    ASP  16           HN       ASP  16   9.413   7.757  -0.038
  109    HA   ASP  16           HA       ASP  16   9.830  10.370   1.001
  110    HB2  ASP  16           HB2      ASP  16   7.469   9.226  -0.507
  111    HB3  ASP  16           HB1      ASP  16   7.722  10.938  -0.183
  112    H    GLY  17           HN       GLY  17   8.440   7.699   2.401
  113    HA2  GLY  17           HA2      GLY  17   7.471   7.572   4.521
  114    HA3  GLY  17           HA1      GLY  17   7.212   9.312   4.480
  115    H    GLY  18           HN       GLY  18   6.208   7.436   1.768
  116    HA2  GLY  18           HA2      GLY  18   3.576   8.350   1.821
  117    HA3  GLY  18           HA1      GLY  18   4.157   6.992   0.878
  118    H    GLU  19           HN       GLU  19   1.639   7.418   2.275
  119    HA   GLU  19           HA       GLU  19   1.711   5.540   4.497
  120    HB2  GLU  19           HB2      GLU  19  -0.380   7.385   3.389
  121    HB3  GLU  19           HB1      GLU  19  -0.785   6.159   4.586
  122    HG2  GLU  19           HG2      GLU  19   1.272   8.334   4.945
  123    HG3  GLU  19           HG1      GLU  19  -0.376   8.382   5.571
  124    H    LEU  20           HN       LEU  20   0.176   3.798   4.645
  125    HA   LEU  20           HA       LEU  20  -0.227   2.481   2.054
  126    HB2  LEU  20           HB2      LEU  20   0.178   1.468   4.843
  127    HB3  LEU  20           HB1      LEU  20  -0.593   0.455   3.639
  128    HG   LEU  20           HG       LEU  20   2.146   1.662   3.255
  129   HD11  LEU  20          HD11      LEU  20   3.044  -0.510   3.894
  130   HD12  LEU  20          HD12      LEU  20   1.419  -1.094   4.253
  131   HD13  LEU  20          HD13      LEU  20   2.131   0.193   5.229
  132   HD21  LEU  20          HD21      LEU  20   0.669  -0.592   1.887
  133   HD22  LEU  20          HD22      LEU  20   2.338  -0.130   1.570
  134   HD23  LEU  20          HD23      LEU  20   1.029   0.990   1.197
  135    H    PHE  21           HN       PHE  21  -2.221   1.906   1.384
  136    HA   PHE  21           HA       PHE  21  -4.459   2.427   3.236
  137    HB2  PHE  21           HB2      PHE  21  -4.490   2.687   0.212
  138    HB3  PHE  21           HB1      PHE  21  -5.779   3.149   1.326
  139    HD1  PHE  21           HD1      PHE  21  -5.403   5.056   2.912
  140    HD2  PHE  21           HD2      PHE  21  -2.696   4.162  -0.258
  141    HE1  PHE  21           HE1      PHE  21  -4.484   7.324   3.059
  142    HE2  PHE  21           HE2      PHE  21  -1.771   6.432  -0.100
  143    HZ   PHE  21           HZ       PHE  21  -2.541   7.955   1.655
  144    H    CYS  22           HN       CYS  22  -3.068  -0.009   3.042
  145    HA   CYS  22           HA       CYS  22  -5.178  -1.771   2.031
  146    HB2  CYS  22           HB2      CYS  22  -2.242  -1.881   1.414
  147    HB3  CYS  22           HB1      CYS  22  -3.182  -3.369   1.473
  148    H    CYS  23           HN       CYS  23  -5.091  -3.931   2.978
  149    HA   CYS  23           HA       CYS  23  -4.322  -3.884   5.752
  150    HB2  CYS  23           HB2      CYS  23  -5.418  -6.007   5.927
  151    HB3  CYS  23           HB1      CYS  23  -6.402  -5.045   4.827
  152    H    ASP  24           HN       ASP  24  -2.955  -5.771   6.606
  153    HA   ASP  24           HA       ASP  24  -0.391  -5.492   5.559
  154    HB2  ASP  24           HB2      ASP  24  -1.532  -7.581   7.404
  155    HB3  ASP  24           HB1      ASP  24   0.172  -7.537   6.967
  156    H    THR  25           HN       THR  25  -2.749  -8.047   5.045
  157    HA   THR  25           HA       THR  25  -1.155  -9.864   3.666
  158    HB   THR  25           HB       THR  25  -4.095  -9.359   3.203
  159    HG1  THR  25           HG1      THR  25  -2.677 -10.549   5.324
  160   HG21  THR  25          HG21      THR  25  -3.079 -10.915   1.611
  161   HG22  THR  25          HG22      THR  25  -4.162 -11.762   2.714
  162   HG23  THR  25          HG23      THR  25  -2.418 -11.857   2.947
  163    H    CYS  26           HN       CYS  26  -3.207  -7.235   2.360
  164    HA   CYS  26           HA       CYS  26  -2.470  -7.826  -0.347
  165    HB2  CYS  26           HB2      CYS  26  -3.831  -5.400   0.823
  166    HB3  CYS  26           HB1      CYS  26  -3.605  -5.670  -0.896
  167    H    SER  27           HN       SER  27  -1.266  -5.669   2.140
  168    HA   SER  27           HA       SER  27   0.200  -3.940   0.458
  169    HB2  SER  27           HB2      SER  27  -0.316  -3.357   2.779
  170    HB3  SER  27           HB1      SER  27   0.695  -4.684   3.347
  171    HG   SER  27           HG       SER  27   2.277  -3.321   3.265
  172    H    ARG  28           HN       ARG  28   0.845  -7.131   1.689
  173    HA   ARG  28           HA       ARG  28   3.634  -7.040   1.003
  174    HB2  ARG  28           HB2      ARG  28   1.813  -9.303   1.818
  175    HB3  ARG  28           HB1      ARG  28   3.527  -9.514   1.479
  176    HG2  ARG  28           HG2      ARG  28   4.096  -8.003   3.292
  177    HG3  ARG  28           HG1      ARG  28   2.384  -7.711   3.607
  178    HD2  ARG  28           HD2      ARG  28   3.229  -9.304   5.200
  179    HD3  ARG  28           HD1      ARG  28   2.106 -10.113   4.109
  180    HE   ARG  28           HE       ARG  28   4.714 -10.407   3.110
  181   HH11  ARG  28          HH11      ARG  28   2.716 -11.478   5.771
  182   HH12  ARG  28          HH12      ARG  28   3.588 -12.961   6.000
  183   HH21  ARG  28          HH21      ARG  28   5.875 -12.357   3.399
  184   HH22  ARG  28          HH22      ARG  28   5.387 -13.466   4.643
  185    H    VAL  29           HN       VAL  29   0.723  -7.629  -0.682
  186    HA   VAL  29           HA       VAL  29   2.104  -9.133  -2.780
  187    HB   VAL  29           HB       VAL  29  -0.853  -8.577  -2.554
  188   HG11  VAL  29          HG11      VAL  29   0.686 -10.550  -4.235
  189   HG12  VAL  29          HG12      VAL  29  -0.102  -9.084  -4.818
  190   HG13  VAL  29          HG13      VAL  29  -1.069 -10.405  -4.164
  191   HG21  VAL  29          HG21      VAL  29  -0.149  -9.893  -0.650
  192   HG22  VAL  29          HG22      VAL  29   0.716 -11.007  -1.708
  193   HG23  VAL  29          HG23      VAL  29  -1.043 -10.908  -1.781
  194    H    PHE  30           HN       PHE  30   0.073  -6.233  -2.363
  195    HA   PHE  30           HA       PHE  30   0.989  -5.332  -5.024
  196    HB2  PHE  30           HB2      PHE  30  -1.614  -4.549  -3.685
  197    HB3  PHE  30           HB1      PHE  30  -1.105  -4.156  -5.322
  198    HD1  PHE  30           HD1      PHE  30  -0.638  -6.274  -6.859
  199    HD2  PHE  30           HD2      PHE  30  -3.077  -6.272  -3.371
  200    HE1  PHE  30           HE1      PHE  30  -1.816  -8.267  -7.684
  201    HE2  PHE  30           HE2      PHE  30  -4.254  -8.269  -4.185
  202    HZ   PHE  30           HZ       PHE  30  -3.626  -9.269  -6.347
  203    H    HIS  31           HN       HIS  31   2.524  -4.860  -2.820
  204    HA   HIS  31           HA       HIS  31   2.037  -2.774  -1.133
  205    HB2  HIS  31           HB2      HIS  31   4.028  -4.255  -1.088
  206    HB3  HIS  31           HB1      HIS  31   4.691  -3.361  -2.452
  207    HD1  HIS  31           HD1      HIS  31   3.398  -2.407   1.036
  208    HD2  HIS  31           HD2      HIS  31   6.471  -1.559  -1.634
  209    HE1  HIS  31           HE1      HIS  31   4.928  -0.742   2.203
  210    H    GLU  32           HN       GLU  32   3.321  -2.523  -4.418
  211    HA   GLU  32           HA       GLU  32   3.983   0.228  -4.232
  212    HB2  GLU  32           HB2      GLU  32   3.519  -1.532  -6.642
  213    HB3  GLU  32           HB1      GLU  32   4.199   0.089  -6.706
  214    HG2  GLU  32           HG2      GLU  32   6.142  -0.580  -5.529
  215    HG3  GLU  32           HG1      GLU  32   5.431  -2.136  -5.104
  216    H    ASP  33           HN       ASP  33   1.170  -1.490  -5.527
  217    HA   ASP  33           HA       ASP  33  -0.104   0.923  -6.428
  218    HB2  ASP  33           HB2      ASP  33  -1.058  -1.925  -6.171
  219    HB3  ASP  33           HB1      ASP  33  -2.136  -0.622  -6.654
  220    H    CYS  34           HN       CYS  34   0.042  -0.868  -3.503
  221    HA   CYS  34           HA       CYS  34  -2.392   0.098  -2.357
  222    HB2  CYS  34           HB2      CYS  34  -0.002  -1.399  -1.333
  223    HB3  CYS  34           HB1      CYS  34  -1.173  -0.729  -0.195
  224    H    HIS  35           HN       HIS  35   0.433   1.667  -3.045
  225    HA   HIS  35           HA       HIS  35   0.209   3.532  -0.814
  226    HB2  HIS  35           HB2      HIS  35   2.184   3.181  -3.047
  227    HB3  HIS  35           HB1      HIS  35   2.138   4.676  -2.107
  228    HD1  HIS  35           HD1      HIS  35   2.867   4.510   0.408
  229    HD2  HIS  35           HD2      HIS  35   3.089   0.940  -1.702
  230    HE1  HIS  35           HE1      HIS  35   4.114   2.883   1.892
  231    H    ILE  36           HN       ILE  36  -1.304   3.029  -3.657
  232    HA   ILE  36           HA       ILE  36  -1.803   5.889  -4.141
  233    HB   ILE  36           HB       ILE  36  -2.271   3.565  -6.023
  234   HG12  ILE  36          HG12      ILE  36  -0.063   5.638  -6.035
  235   HG13  ILE  36          HG11      ILE  36   0.128   3.937  -5.626
  236   HG21  ILE  36          HG21      ILE  36  -2.373   6.534  -6.540
  237   HG22  ILE  36          HG22      ILE  36  -3.771   5.471  -6.393
  238   HG23  ILE  36          HG23      ILE  36  -2.639   5.261  -7.728
  239   HD11  ILE  36          HD11      ILE  36  -0.715   5.009  -8.308
  240   HD12  ILE  36          HD12      ILE  36  -0.488   3.311  -7.897
  241   HD13  ILE  36          HD13      ILE  36   0.888   4.412  -7.890
  242    HA   PRO  37           HA       PRO  37  -3.147   7.226  -4.717
  243    HB2  PRO  37           HB2      PRO  37  -5.328   8.681  -3.580
  244    HB3  PRO  37           HB1      PRO  37  -5.064   8.310  -5.291
  245    HG2  PRO  37           HG2      PRO  37  -7.135   7.308  -3.746
  246    HG3  PRO  37           HG1      PRO  37  -6.546   6.582  -5.253
  247    HD2  PRO  37           HD2      PRO  37  -5.929   5.830  -2.416
  248    HD3  PRO  37           HD1      PRO  37  -6.208   4.781  -3.827
  249    HA   PRO  38           HA       PRO  38  -1.089   8.175  -0.869
  250    HB2  PRO  38           HB2      PRO  38  -0.661  10.802  -2.204
  251    HB3  PRO  38           HB1      PRO  38   0.512   9.713  -1.454
  252    HG2  PRO  38           HG2      PRO  38   0.337   9.877  -4.104
  253    HG3  PRO  38           HG1      PRO  38   0.600   8.311  -3.306
  254    HD2  PRO  38           HD2      PRO  38  -1.910   9.434  -4.505
  255    HD3  PRO  38           HD1      PRO  38  -1.296   7.765  -4.525
  256    H    VAL  39           HN       VAL  39  -1.244   9.646   0.918
  257    HA   VAL  39           HA       VAL  39  -3.939  10.548   1.267
  258    HB   VAL  39           HB       VAL  39  -2.988   9.429   3.127
  259   HG11  VAL  39          HG11      VAL  39  -1.070  10.419   4.406
  260   HG12  VAL  39          HG12      VAL  39  -0.776  11.458   3.010
  261   HG13  VAL  39          HG13      VAL  39  -0.657   9.707   2.850
  262   HG21  VAL  39          HG21      VAL  39  -3.275  11.077   4.924
  263   HG22  VAL  39          HG22      VAL  39  -4.524  11.213   3.687
  264   HG23  VAL  39          HG23      VAL  39  -3.196  12.372   3.729
  265    H    GLU  40           HN       GLU  40  -4.306  12.320   0.032
  266    HA   GLU  40           HA       GLU  40  -2.770  14.732   0.651
  267    HB2  GLU  40           HB2      GLU  40  -4.677  13.996  -1.532
  268    HB3  GLU  40           HB1      GLU  40  -4.534  15.686  -1.086
  269    HG2  GLU  40           HG2      GLU  40  -3.107  15.238  -2.945
  270    HG3  GLU  40           HG1      GLU  40  -2.114  15.571  -1.534
  271    H    ALA  41           HN       ALA  41  -5.659  13.109   1.394
  272    HA   ALA  41           HA       ALA  41  -6.610  15.459   2.883
  273    HB1  ALA  41           HB1      ALA  41  -8.347  13.355   1.604
  274    HB2  ALA  41           HB2      ALA  41  -8.067  14.972   0.963
  275    HB3  ALA  41           HB3      ALA  41  -8.896  14.767   2.504
  276    H    GLU  42           HN       GLU  42  -7.335  11.958   2.770
  277    HA   GLU  42           HA       GLU  42  -6.910  11.879   5.679
  278    HB2  GLU  42           HB2      GLU  42  -9.239  10.677   4.176
  279    HB3  GLU  42           HB1      GLU  42  -8.882  10.373   5.869
  280    HG2  GLU  42           HG2      GLU  42  -9.188  12.752   6.352
  281    HG3  GLU  42           HG1      GLU  42  -9.568  13.036   4.653
  282    H    ARG  43           HN       ARG  43  -6.252   9.897   6.542
  283    HA   ARG  43           HA       ARG  43  -5.544   7.823   4.586
  284    HB2  ARG  43           HB2      ARG  43  -3.522   7.337   5.939
  285    HB3  ARG  43           HB1      ARG  43  -3.493   8.935   5.212
  286    HG2  ARG  43           HG2      ARG  43  -4.089   9.947   7.331
  287    HG3  ARG  43           HG1      ARG  43  -4.226   8.353   8.074
  288    HD2  ARG  43           HD2      ARG  43  -1.855   7.949   7.683
  289    HD3  ARG  43           HD1      ARG  43  -1.705   9.521   6.897
  290    HE   ARG  43           HE       ARG  43  -2.691  10.165   9.322
  291   HH11  ARG  43          HH11      ARG  43   0.037   8.159   8.377
  292   HH12  ARG  43          HH12      ARG  43   0.960   8.556   9.797
  293   HH21  ARG  43          HH21      ARG  43  -1.465  10.668  11.172
  294   HH22  ARG  43          HH22      ARG  43   0.113   9.973  11.373
  295    H    THR  44           HN       THR  44  -6.493   5.947   5.003
  296    HA   THR  44           HA       THR  44  -7.208   5.351   7.795
  297    HB   THR  44           HB       THR  44  -9.166   4.084   6.890
  298    HG1  THR  44           HG1      THR  44  -8.300   3.908   4.710
  299   HG21  THR  44          HG21      THR  44  -9.081   7.020   6.180
  300   HG22  THR  44          HG22      THR  44  -9.447   6.354   7.771
  301   HG23  THR  44          HG23      THR  44 -10.542   6.062   6.418
  302    HA   PRO  45           HA       PRO  45  -4.381   2.011   6.251
  303    HB2  PRO  45           HB2      PRO  45  -3.534   1.963   9.068
  304    HB3  PRO  45           HB1      PRO  45  -2.559   2.159   7.605
  305    HG2  PRO  45           HG2      PRO  45  -2.989   4.202   9.300
  306    HG3  PRO  45           HG1      PRO  45  -2.867   4.448   7.547
  307    HD2  PRO  45           HD2      PRO  45  -5.321   4.312   9.277
  308    HD3  PRO  45           HD1      PRO  45  -4.949   5.428   7.942
  309    H    TRP  46           HN       TRP  46  -6.822   2.223   8.625
  310    HA   TRP  46           HA       TRP  46  -6.787  -0.620   9.237
  311    HB2  TRP  46           HB2      TRP  46  -8.783  -0.075  10.654
  312    HB3  TRP  46           HB1      TRP  46  -7.344   0.848  11.082
  313    HD1  TRP  46           HD1      TRP  46 -10.836   1.263   9.569
  314    HE1  TRP  46           HE1      TRP  46 -11.431   3.766   9.532
  315    HE3  TRP  46           HE3      TRP  46  -6.310   3.197  10.970
  316    HZ2  TRP  46           HZ2      TRP  46 -10.154   6.227  10.024
  317    HZ3  TRP  46           HZ3      TRP  46  -6.087   5.642  11.161
  318    HH2  TRP  46           HH2      TRP  46  -7.963   7.119  10.695
  319    H    ASN  47           HN       ASN  47  -7.677   1.024   6.633
  320    HA   ASN  47           HA       ASN  47  -9.938  -0.771   6.067
  321    HB2  ASN  47           HB2      ASN  47 -10.754   1.568   6.390
  322    HB3  ASN  47           HB1      ASN  47  -9.689   2.090   5.087
  323   HD21  ASN  47          HD21      ASN  47 -11.336   2.800   3.770
  324   HD22  ASN  47          HD22      ASN  47 -12.453   1.724   2.998
  325    H    CYS  48           HN       CYS  48  -9.549  -2.035   4.342
  326    HA   CYS  48           HA       CYS  48  -7.229  -1.371   2.698
  327    HB2  CYS  48           HB2      CYS  48  -7.358  -3.596   3.840
  328    HB3  CYS  48           HB1      CYS  48  -8.777  -3.972   2.870
  329    H    ILE  49           HN       ILE  49  -7.511  -0.538   0.731
  330    HA   ILE  49           HA       ILE  49 -10.132  -0.411  -0.442
  331    HB   ILE  49           HB       ILE  49  -8.964   0.733  -2.361
  332   HG12  ILE  49          HG12      ILE  49  -6.566   0.690  -0.529
  333   HG13  ILE  49          HG11      ILE  49  -6.732  -0.342  -1.947
  334   HG21  ILE  49          HG21      ILE  49 -10.018   2.007  -0.590
  335   HG22  ILE  49          HG22      ILE  49  -8.527   2.800  -1.101
  336   HG23  ILE  49          HG23      ILE  49  -8.564   1.877   0.400
  337   HD11  ILE  49          HD11      ILE  49  -6.823   1.640  -3.369
  338   HD12  ILE  49          HD12      ILE  49  -5.343   1.603  -2.407
  339   HD13  ILE  49          HD13      ILE  49  -6.671   2.669  -1.944
  340    H    PHE  50           HN       PHE  50  -7.399  -2.481  -0.742
  341    HA   PHE  50           HA       PHE  50  -8.128  -3.438  -3.367
  342    HB2  PHE  50           HB2      PHE  50  -5.882  -3.990  -1.505
  343    HB3  PHE  50           HB1      PHE  50  -6.356  -5.299  -2.594
  344    HD1  PHE  50           HD2      PHE  50  -5.294  -1.757  -2.493
  345    HD2  PHE  50           HD1      PHE  50  -5.790  -5.252  -4.862
  346    HE1  PHE  50           HE2      PHE  50  -4.090  -0.669  -4.336
  347    HE2  PHE  50           HE1      PHE  50  -4.589  -4.173  -6.716
  348    HZ   PHE  50           HZ       PHE  50  -3.738  -1.876  -6.456
  349    H    CYS  51           HN       CYS  51  -8.627  -4.398  -0.037
  350    HA   CYS  51           HA       CYS  51  -9.762  -6.928  -0.722
  351    HB2  CYS  51           HB2      CYS  51  -9.713  -5.274   1.775
  352    HB3  CYS  51           HB1      CYS  51 -10.853  -6.606   1.650
  353    H    ARG  52           HN       ARG  52 -11.068  -3.659  -0.280
  354    HA   ARG  52           HA       ARG  52 -13.771  -4.495  -0.579
  355    HB2  ARG  52           HB2      ARG  52 -12.444  -1.795  -0.695
  356    HB3  ARG  52           HB1      ARG  52 -14.165  -2.005  -0.963
  357    HG2  ARG  52           HG2      ARG  52 -12.704  -2.809   1.548
  358    HG3  ARG  52           HG1      ARG  52 -13.604  -1.308   1.335
  359    HD2  ARG  52           HD2      ARG  52 -15.082  -2.749   2.459
  360    HD3  ARG  52           HD1      ARG  52 -15.616  -2.775   0.781
  361    HE   ARG  52           HE       ARG  52 -13.796  -4.886   1.651
  362   HH11  ARG  52          HH11      ARG  52 -17.060  -3.925   0.800
  363   HH12  ARG  52          HH12      ARG  52 -17.646  -5.556   0.703
  364   HH21  ARG  52          HH21      ARG  52 -14.558  -7.029   1.492
  365   HH22  ARG  52          HH22      ARG  52 -16.218  -7.321   1.078
  366    H    MET  53           HN       MET  53 -11.571  -4.909  -2.818
  367    HA   MET  53           HA       MET  53 -13.069  -3.800  -5.049
  368    HB2  MET  53           HB2      MET  53 -11.361  -4.544  -6.472
  369    HB3  MET  53           HB1      MET  53 -10.509  -4.091  -5.006
  370    HG2  MET  53           HG2      MET  53 -10.397  -6.440  -4.341
  371    HG3  MET  53           HG1      MET  53 -11.263  -6.894  -5.807
  372    HE1  MET  53           HE1      MET  53  -9.272  -8.637  -6.302
  373    HE2  MET  53           HE2      MET  53  -8.422  -8.094  -4.855
  374    HE3  MET  53           HE3      MET  53  -7.575  -8.165  -6.400
  375    H    LYS  54           HN       LYS  54 -13.457  -6.309  -3.021
  376    HA   LYS  54           HA       LYS  54 -14.701  -8.038  -5.043
  377    HB2  LYS  54           HB2      LYS  54 -12.877  -9.011  -3.599
  378    HB3  LYS  54           HB1      LYS  54 -13.903  -8.729  -2.203
  379    HG2  LYS  54           HG2      LYS  54 -15.598 -10.246  -3.224
  380    HG3  LYS  54           HG1      LYS  54 -14.431 -10.605  -4.501
  381    HD2  LYS  54           HD2      LYS  54 -12.856 -11.440  -2.833
  382    HD3  LYS  54           HD1      LYS  54 -14.002 -11.059  -1.547
  383    HE2  LYS  54           HE2      LYS  54 -14.102 -13.417  -2.053
  384    HE3  LYS  54           HE1      LYS  54 -15.604 -12.642  -2.544
  385    HZ1  LYS  54           HZ1      LYS  54 -14.767 -14.223  -4.196
  386    HZ2  LYS  54           HZ2      LYS  54 -13.360 -13.304  -4.374
  387    HZ3  LYS  54           HZ3      LYS  54 -14.855 -12.655  -4.818
  388    H    GLU  55           HN       GLU  55 -16.287  -6.045  -4.726
  389    HA   GLU  55           HA       GLU  55 -18.177  -6.727  -2.575
  390    HB2  GLU  55           HB2      GLU  55 -18.005  -4.152  -4.143
  391    HB3  GLU  55           HB1      GLU  55 -19.088  -4.486  -2.799
  392    HG2  GLU  55           HG2      GLU  55 -17.063  -4.808  -1.366
  393    HG3  GLU  55           HG1      GLU  55 -16.098  -4.215  -2.716
  394    H    SER  56           HN       SER  56 -18.434  -8.492  -4.370
  395    HA   SER  56           HA       SER  56 -20.660  -7.657  -6.098
  396    HB2  SER  56           HB2      SER  56 -18.627  -9.811  -6.738
  397    HB3  SER  56           HB1      SER  56 -19.922  -9.235  -7.786
  398    HG   SER  56           HG       SER  56 -18.853  -7.123  -7.627
  Start of MODEL   12
    1    H1   GLY   1           HT1      GLY   1  11.924 -13.067   6.973
    2    H2   GLY   1           HT2      GLY   1  10.477 -12.965   7.836
    3    H3   GLY   1           HT3      GLY   1  11.450 -14.341   7.976
    4    HA2  GLY   1           HA1      GLY   1  11.686 -12.954   9.920
    5    HA3  GLY   1           HA2      GLY   1  13.191 -13.049   9.015
    6    H    ALA   2           HN       ALA   2  14.130 -11.125   9.416
    7    HA   ALA   2           HA       ALA   2  12.475  -8.709   9.298
    8    HB1  ALA   2           HB1      ALA   2  15.296  -9.038  10.311
    9    HB2  ALA   2           HB2      ALA   2  13.843  -9.064  11.310
   10    HB3  ALA   2           HB3      ALA   2  14.296  -7.593  10.449
   11    H    MET   3           HN       MET   3  13.869 -10.394   7.046
   12    HA   MET   3           HA       MET   3  14.526  -8.043   5.469
   13    HB2  MET   3           HB2      MET   3  16.677  -8.798   6.497
   14    HB3  MET   3           HB1      MET   3  16.480 -10.344   5.685
   15    HG2  MET   3           HG2      MET   3  18.024  -8.888   4.485
   16    HG3  MET   3           HG1      MET   3  16.597  -9.253   3.518
   17    HE1  MET   3           HE1      MET   3  17.580  -5.602   2.435
   18    HE2  MET   3           HE2      MET   3  17.229  -7.234   1.864
   19    HE3  MET   3           HE3      MET   3  18.655  -6.934   2.856
   20    H    GLY   4           HN       GLY   4  12.283  -9.338   5.156
   21    HA2  GLY   4           HA2      GLY   4  12.730 -11.070   2.802
   22    HA3  GLY   4           HA1      GLY   4  11.367 -11.262   3.895
   23    H    MET   5           HN       MET   5  10.243  -8.954   4.216
   24    HA   MET   5           HA       MET   5   9.264  -8.291   1.573
   25    HB2  MET   5           HB2      MET   5   8.386  -7.278   4.286
   26    HB3  MET   5           HB1      MET   5   7.566  -6.960   2.766
   27    HG2  MET   5           HG2      MET   5   6.344  -8.664   3.831
   28    HG3  MET   5           HG1      MET   5   7.252  -9.451   2.543
   29    HE1  MET   5           HE1      MET   5   7.192 -12.230   5.284
   30    HE2  MET   5           HE2      MET   5   6.870 -11.838   3.594
   31    HE3  MET   5           HE3      MET   5   5.899 -11.105   4.871
   32    H    ARG   6           HN       ARG   6  11.716  -7.496   1.468
   33    HA   ARG   6           HA       ARG   6  11.978  -4.742   2.393
   34    HB2  ARG   6           HB2      ARG   6  13.850  -6.424   2.582
   35    HB3  ARG   6           HB1      ARG   6  13.964  -6.400   0.831
   36    HG2  ARG   6           HG2      ARG   6  15.665  -4.998   1.848
   37    HG3  ARG   6           HG1      ARG   6  14.544  -4.037   0.884
   38    HD2  ARG   6           HD2      ARG   6  15.088  -2.951   3.016
   39    HD3  ARG   6           HD1      ARG   6  13.374  -3.340   2.893
   40    HE   ARG   6           HE       ARG   6  14.399  -5.478   4.196
   41   HH11  ARG   6          HH11      ARG   6  14.609  -2.024   4.735
   42   HH12  ARG   6          HH12      ARG   6  14.754  -2.173   6.458
   43   HH21  ARG   6          HH21      ARG   6  14.589  -5.681   6.462
   44   HH22  ARG   6          HH22      ARG   6  14.753  -4.255   7.439
   45    H    ASN   7           HN       ASN   7   9.995  -5.342   0.449
   46    HA   ASN   7           HA       ASN   7  10.948  -4.482  -2.130
   47    HB2  ASN   7           HB2      ASN   7   8.980  -6.048  -1.771
   48    HB3  ASN   7           HB1      ASN   7   8.070  -4.651  -1.208
   49   HD21  ASN   7          HD21      ASN   7  10.414  -4.726  -3.842
   50   HD22  ASN   7          HD22      ASN   7   9.284  -4.333  -5.090
   51    H    LEU   8           HN       LEU   8  10.031  -3.024   0.756
   52    HA   LEU   8           HA       LEU   8   9.018  -0.573  -0.339
   53    HB2  LEU   8           HB2      LEU   8   9.088   0.227   2.000
   54    HB3  LEU   8           HB1      LEU   8   8.208  -1.274   1.804
   55    HG   LEU   8           HG       LEU   8  10.589  -2.291   2.485
   56   HD11  LEU   8          HD11      LEU   8  11.676  -0.114   2.682
   57   HD12  LEU   8          HD12      LEU   8  11.615  -0.943   4.237
   58   HD13  LEU   8          HD13      LEU   8  10.492   0.372   3.894
   59   HD21  LEU   8          HD21      LEU   8   9.730  -2.453   4.770
   60   HD22  LEU   8          HD22      LEU   8   8.466  -2.756   3.578
   61   HD23  LEU   8          HD23      LEU   8   8.539  -1.203   4.409
   62    H    ASP   9           HN       ASP   9  12.042  -1.862  -0.150
   63    HA   ASP   9           HA       ASP   9  13.513   0.525   0.526
   64    HB2  ASP   9           HB2      ASP   9  14.446  -1.723   0.969
   65    HB3  ASP   9           HB1      ASP   9  14.498  -2.031  -0.763
   66    H    GLU  10           HN       GLU  10  12.462  -1.135  -2.338
   67    HA   GLU  10           HA       GLU  10  13.635   0.918  -4.064
   68    HB2  GLU  10           HB2      GLU  10  12.195  -1.629  -4.827
   69    HB3  GLU  10           HB1      GLU  10  13.108  -0.578  -5.904
   70    HG2  GLU  10           HG2      GLU  10  15.162  -1.122  -4.790
   71    HG3  GLU  10           HG1      GLU  10  14.298  -2.051  -3.567
   72    H    CYS  11           HN       CYS  11  11.246   1.038  -2.233
   73    HA   CYS  11           HA       CYS  11   9.162   1.849  -4.133
   74    HB2  CYS  11           HB2      CYS  11   8.556   0.209  -2.375
   75    HB3  CYS  11           HB1      CYS  11   9.030   1.363  -1.147
   76    H    GLU  12           HN       GLU  12   9.714   3.853  -4.728
   77    HA   GLU  12           HA       GLU  12  11.226   5.718  -3.376
   78    HB2  GLU  12           HB2      GLU  12   9.005   6.309  -5.329
   79    HB3  GLU  12           HB1      GLU  12  10.338   7.375  -4.921
   80    HG2  GLU  12           HG2      GLU  12  11.913   5.789  -5.902
   81    HG3  GLU  12           HG1      GLU  12  10.572   4.717  -6.312
   82    H    VAL  13           HN       VAL  13   7.730   5.346  -3.420
   83    HA   VAL  13           HA       VAL  13   7.219   7.719  -1.971
   84    HB   VAL  13           HB       VAL  13   5.546   6.773  -3.435
   85   HG11  VAL  13          HG11      VAL  13   4.369   4.728  -2.932
   86   HG12  VAL  13          HG12      VAL  13   5.373   4.474  -1.507
   87   HG13  VAL  13          HG13      VAL  13   6.091   4.411  -3.116
   88   HG21  VAL  13          HG21      VAL  13   3.602   6.920  -2.000
   89   HG22  VAL  13          HG22      VAL  13   4.800   8.128  -1.527
   90   HG23  VAL  13          HG23      VAL  13   4.611   6.651  -0.582
   91    H    CYS  14           HN       CYS  14   7.885   4.416  -1.005
   92    HA   CYS  14           HA       CYS  14   7.105   4.726   1.717
   93    HB2  CYS  14           HB2      CYS  14   8.559   2.717   0.150
   94    HB3  CYS  14           HB1      CYS  14   9.072   2.840   1.827
   95    H    ARG  15           HN       ARG  15   9.933   5.509  -0.116
   96    HA   ARG  15           HA       ARG  15  11.692   5.939   2.075
   97    HB2  ARG  15           HB2      ARG  15  11.777   7.236  -0.651
   98    HB3  ARG  15           HB1      ARG  15  13.105   7.137   0.496
   99    HG2  ARG  15           HG2      ARG  15  13.129   4.709   0.267
  100    HG3  ARG  15           HG1      ARG  15  11.793   4.804  -0.879
  101    HD2  ARG  15           HD2      ARG  15  14.587   5.885  -1.214
  102    HD3  ARG  15           HD1      ARG  15  13.826   4.583  -2.126
  103    HE   ARG  15           HE       ARG  15  12.453   7.105  -2.345
  104   HH11  ARG  15          HH11      ARG  15  14.987   5.083  -3.669
  105   HH12  ARG  15          HH12      ARG  15  15.034   5.920  -5.187
  106   HH21  ARG  15          HH21      ARG  15  12.503   8.196  -4.352
  107   HH22  ARG  15          HH22      ARG  15  13.620   7.688  -5.577
  108    H    ASP  16           HN       ASP  16   9.425   7.927   0.312
  109    HA   ASP  16           HA       ASP  16  10.009  10.315   1.790
  110    HB2  ASP  16           HB2      ASP  16   7.784   9.569  -0.105
  111    HB3  ASP  16           HB1      ASP  16   7.876  11.142   0.681
  112    H    GLY  17           HN       GLY  17   8.577   7.547   2.746
  113    HA2  GLY  17           HA2      GLY  17   7.498   7.086   4.744
  114    HA3  GLY  17           HA1      GLY  17   7.389   8.818   5.039
  115    H    GLY  18           HN       GLY  18   6.221   7.301   2.112
  116    HA2  GLY  18           HA2      GLY  18   3.665   8.427   2.257
  117    HA3  GLY  18           HA1      GLY  18   4.122   7.083   1.230
  118    H    GLU  19           HN       GLU  19   1.613   7.202   2.211
  119    HA   GLU  19           HA       GLU  19   1.575   5.371   4.507
  120    HB2  GLU  19           HB2      GLU  19  -0.599   7.156   3.411
  121    HB3  GLU  19           HB1      GLU  19  -0.800   6.058   4.771
  122    HG2  GLU  19           HG2      GLU  19   1.118   7.354   5.862
  123    HG3  GLU  19           HG1      GLU  19   0.856   8.555   4.600
  124    H    LEU  20           HN       LEU  20   0.581   3.448   4.400
  125    HA   LEU  20           HA       LEU  20  -0.072   2.415   1.769
  126    HB2  LEU  20           HB2      LEU  20   0.307   1.201   4.488
  127    HB3  LEU  20           HB1      LEU  20  -0.414   0.278   3.184
  128    HG   LEU  20           HG       LEU  20   2.291   1.579   2.912
  129   HD11  LEU  20          HD11      LEU  20   3.260  -0.600   3.464
  130   HD12  LEU  20          HD12      LEU  20   1.654  -1.210   3.866
  131   HD13  LEU  20          HD13      LEU  20   2.375   0.079   4.830
  132   HD21  LEU  20          HD21      LEU  20   1.203   0.917   0.834
  133   HD22  LEU  20          HD22      LEU  20   0.928  -0.701   1.475
  134   HD23  LEU  20          HD23      LEU  20   2.571  -0.140   1.176
  135    H    PHE  21           HN       PHE  21  -2.084   1.735   1.118
  136    HA   PHE  21           HA       PHE  21  -4.314   2.343   2.955
  137    HB2  PHE  21           HB2      PHE  21  -4.431   2.252  -0.075
  138    HB3  PHE  21           HB1      PHE  21  -5.653   2.901   1.020
  139    HD1  PHE  21           HD1      PHE  21  -4.958   4.906   2.468
  140    HD2  PHE  21           HD2      PHE  21  -2.819   3.665  -1.000
  141    HE1  PHE  21           HE1      PHE  21  -3.984   7.151   2.268
  142    HE2  PHE  21           HE2      PHE  21  -1.838   5.908  -1.196
  143    HZ   PHE  21           HZ       PHE  21  -2.264   7.584   0.479
  144    H    CYS  22           HN       CYS  22  -2.889  -0.085   2.994
  145    HA   CYS  22           HA       CYS  22  -4.981  -1.962   2.183
  146    HB2  CYS  22           HB2      CYS  22  -2.088  -1.998   1.384
  147    HB3  CYS  22           HB1      CYS  22  -2.996  -3.504   1.491
  148    H    CYS  23           HN       CYS  23  -4.861  -4.027   3.244
  149    HA   CYS  23           HA       CYS  23  -4.047  -3.989   5.975
  150    HB2  CYS  23           HB2      CYS  23  -4.657  -6.472   4.356
  151    HB3  CYS  23           HB1      CYS  23  -4.887  -6.224   6.086
  152    H    ASP  24           HN       ASP  24  -2.484  -5.683   6.888
  153    HA   ASP  24           HA       ASP  24   0.063  -5.436   5.836
  154    HB2  ASP  24           HB2      ASP  24  -1.042  -7.664   7.557
  155    HB3  ASP  24           HB1      ASP  24   0.669  -7.436   7.222
  156    H    THR  25           HN       THR  25  -2.177  -8.152   5.412
  157    HA   THR  25           HA       THR  25  -0.497  -9.663   3.726
  158    HB   THR  25           HB       THR  25  -3.513  -9.722   3.855
  159    HG1  THR  25           HG1      THR  25  -1.521 -11.073   5.388
  160   HG21  THR  25          HG21      THR  25  -3.266 -12.043   3.126
  161   HG22  THR  25          HG22      THR  25  -1.517 -11.839   3.042
  162   HG23  THR  25          HG23      THR  25  -2.562 -10.942   1.942
  163    H    CYS  26           HN       CYS  26  -3.158  -7.410   2.981
  164    HA   CYS  26           HA       CYS  26  -3.086  -7.780   0.189
  165    HB2  CYS  26           HB2      CYS  26  -4.009  -5.343   1.733
  166    HB3  CYS  26           HB1      CYS  26  -4.423  -5.724   0.063
  167    H    SER  27           HN       SER  27  -1.445  -5.502   2.311
  168    HA   SER  27           HA       SER  27  -0.168  -3.993   0.283
  169    HB2  SER  27           HB2      SER  27  -0.408  -3.163   2.575
  170    HB3  SER  27           HB1      SER  27   0.633  -4.454   3.166
  171    HG   SER  27           HG       SER  27   2.176  -3.083   2.834
  172    H    ARG  28           HN       ARG  28   0.565  -7.032   1.822
  173    HA   ARG  28           HA       ARG  28   3.301  -7.115   1.012
  174    HB2  ARG  28           HB2      ARG  28   2.415  -8.371   2.950
  175    HB3  ARG  28           HB1      ARG  28   1.462  -9.360   1.856
  176    HG2  ARG  28           HG2      ARG  28   3.491 -10.236   0.850
  177    HG3  ARG  28           HG1      ARG  28   4.468  -9.212   1.907
  178    HD2  ARG  28           HD2      ARG  28   2.571 -11.377   2.804
  179    HD3  ARG  28           HD1      ARG  28   4.328 -11.507   2.750
  180    HE   ARG  28           HE       ARG  28   3.772  -9.296   4.305
  181   HH11  ARG  28          HH11      ARG  28   3.014 -12.706   4.412
  182   HH12  ARG  28          HH12      ARG  28   3.000 -12.776   6.144
  183   HH21  ARG  28          HH21      ARG  28   3.756  -9.380   6.577
  184   HH22  ARG  28          HH22      ARG  28   3.430 -10.884   7.379
  185    H    VAL  29           HN       VAL  29   0.296  -7.777  -0.510
  186    HA   VAL  29           HA       VAL  29   1.575  -9.322  -2.628
  187    HB   VAL  29           HB       VAL  29  -1.346  -8.637  -2.272
  188   HG11  VAL  29          HG11      VAL  29  -0.749  -9.058  -4.608
  189   HG12  VAL  29          HG12      VAL  29  -1.744 -10.361  -3.962
  190   HG13  VAL  29          HG13      VAL  29  -0.006 -10.587  -4.146
  191   HG21  VAL  29          HG21      VAL  29   0.161 -11.173  -1.657
  192   HG22  VAL  29          HG22      VAL  29  -1.593 -10.997  -1.610
  193   HG23  VAL  29          HG23      VAL  29  -0.585 -10.083  -0.488
  194    H    PHE  30           HN       PHE  30  -0.187  -6.265  -2.161
  195    HA   PHE  30           HA       PHE  30   0.604  -5.512  -4.908
  196    HB2  PHE  30           HB2      PHE  30  -1.814  -4.483  -3.405
  197    HB3  PHE  30           HB1      PHE  30  -1.394  -4.159  -5.082
  198    HD1  PHE  30           HD1      PHE  30  -1.398  -6.161  -6.705
  199    HD2  PHE  30           HD2      PHE  30  -3.205  -6.236  -2.848
  200    HE1  PHE  30           HE1      PHE  30  -2.802  -8.052  -7.401
  201    HE2  PHE  30           HE2      PHE  30  -4.604  -8.136  -3.537
  202    HZ   PHE  30           HZ       PHE  30  -4.405  -9.047  -5.815
  203    H    HIS  31           HN       HIS  31   2.366  -5.031  -2.822
  204    HA   HIS  31           HA       HIS  31   2.058  -2.813  -1.241
  205    HB2  HIS  31           HB2      HIS  31   3.969  -4.371  -1.122
  206    HB3  HIS  31           HB1      HIS  31   4.612  -3.682  -2.609
  207    HD1  HIS  31           HD1      HIS  31   3.712  -2.451   0.901
  208    HD2  HIS  31           HD2      HIS  31   6.420  -1.742  -2.171
  209    HE1  HIS  31           HE1      HIS  31   5.363  -0.745   1.785
  210    H    GLU  32           HN       GLU  32   3.327  -2.872  -4.553
  211    HA   GLU  32           HA       GLU  32   4.066  -0.157  -4.636
  212    HB2  GLU  32           HB2      GLU  32   3.235  -1.864  -6.987
  213    HB3  GLU  32           HB1      GLU  32   4.275  -0.448  -7.026
  214    HG2  GLU  32           HG2      GLU  32   5.875  -2.043  -7.113
  215    HG3  GLU  32           HG1      GLU  32   5.708  -1.949  -5.364
  216    H    ASP  33           HN       ASP  33   1.101  -1.807  -5.592
  217    HA   ASP  33           HA       ASP  33  -0.102   0.592  -6.632
  218    HB2  ASP  33           HB2      ASP  33  -1.211  -2.173  -6.135
  219    HB3  ASP  33           HB1      ASP  33  -2.167  -0.850  -6.793
  220    H    CYS  34           HN       CYS  34   0.038  -1.029  -3.592
  221    HA   CYS  34           HA       CYS  34  -2.336   0.123  -2.484
  222    HB2  CYS  34           HB2      CYS  34  -0.002  -1.395  -1.336
  223    HB3  CYS  34           HB1      CYS  34  -1.224  -0.677  -0.288
  224    H    HIS  35           HN       HIS  35   0.410   1.583  -3.396
  225    HA   HIS  35           HA       HIS  35   0.331   3.569  -1.241
  226    HB2  HIS  35           HB2      HIS  35   2.283   3.041  -3.472
  227    HB3  HIS  35           HB1      HIS  35   2.309   4.548  -2.551
  228    HD1  HIS  35           HD1      HIS  35   2.967   4.343   0.014
  229    HD2  HIS  35           HD2      HIS  35   3.232   0.826  -2.181
  230    HE1  HIS  35           HE1      HIS  35   4.245   2.700   1.455
  231    H    ILE  36           HN       ILE  36  -1.141   2.927  -4.108
  232    HA   ILE  36           HA       ILE  36  -1.542   5.769  -4.767
  233    HB   ILE  36           HB       ILE  36  -1.585   3.322  -6.541
  234   HG12  ILE  36          HG12      ILE  36  -0.078   4.873  -7.945
  235   HG13  ILE  36          HG11      ILE  36   0.030   5.869  -6.503
  236   HG21  ILE  36          HG21      ILE  36  -2.453   4.623  -8.361
  237   HG22  ILE  36          HG22      ILE  36  -2.502   6.069  -7.357
  238   HG23  ILE  36          HG23      ILE  36  -3.574   4.717  -7.002
  239   HD11  ILE  36          HD11      ILE  36   0.968   3.950  -5.284
  240   HD12  ILE  36          HD12      ILE  36   1.950   4.438  -6.664
  241   HD13  ILE  36          HD13      ILE  36   0.923   3.010  -6.775
  242    HA   PRO  37           HA       PRO  37  -2.980   7.067  -5.741
  243    HB2  PRO  37           HB2      PRO  37  -5.016   8.552  -4.305
  244    HB3  PRO  37           HB1      PRO  37  -4.812   8.356  -6.053
  245    HG2  PRO  37           HG2      PRO  37  -6.881   7.267  -4.652
  246    HG3  PRO  37           HG1      PRO  37  -6.231   6.562  -6.141
  247    HD2  PRO  37           HD2      PRO  37  -5.728   5.775  -3.295
  248    HD3  PRO  37           HD1      PRO  37  -5.984   4.745  -4.721
  249    HA   PRO  38           HA       PRO  38  -0.402   7.913  -2.224
  250    HB2  PRO  38           HB2      PRO  38   0.152  10.414  -3.741
  251    HB3  PRO  38           HB1      PRO  38   1.279   9.226  -3.074
  252    HG2  PRO  38           HG2      PRO  38   0.805   9.299  -5.695
  253    HG3  PRO  38           HG1      PRO  38   0.987   7.749  -4.844
  254    HD2  PRO  38           HD2      PRO  38  -1.512   9.106  -5.799
  255    HD3  PRO  38           HD1      PRO  38  -1.093   7.380  -5.805
  256    H    VAL  39           HN       VAL  39  -0.726   8.942  -0.343
  257    HA   VAL  39           HA       VAL  39  -3.071  10.502  -0.039
  258    HB   VAL  39           HB       VAL  39  -2.438   9.007   1.737
  259   HG11  VAL  39          HG11      VAL  39  -0.063   8.968   1.595
  260   HG12  VAL  39          HG12      VAL  39  -0.493   9.539   3.205
  261   HG13  VAL  39          HG13      VAL  39   0.043  10.685   1.979
  262   HG21  VAL  39          HG21      VAL  39  -3.723  10.967   2.359
  263   HG22  VAL  39          HG22      VAL  39  -2.238  11.877   2.625
  264   HG23  VAL  39          HG23      VAL  39  -2.629  10.504   3.660
  265    H    GLU  40           HN       GLU  40  -3.295  12.548  -0.409
  266    HA   GLU  40           HA       GLU  40  -1.022  14.365  -0.033
  267    HB2  GLU  40           HB2      GLU  40  -2.043  14.457  -2.256
  268    HB3  GLU  40           HB1      GLU  40  -3.621  14.735  -1.542
  269    HG2  GLU  40           HG2      GLU  40  -2.704  16.855  -0.579
  270    HG3  GLU  40           HG1      GLU  40  -1.266  16.593  -1.569
  271    H    ALA  41           HN       ALA  41  -4.391  13.773   0.753
  272    HA   ALA  41           HA       ALA  41  -4.182  14.695   3.393
  273    HB1  ALA  41           HB1      ALA  41  -5.621  16.602   1.550
  274    HB2  ALA  41           HB2      ALA  41  -4.085  16.914   2.355
  275    HB3  ALA  41           HB3      ALA  41  -5.554  16.709   3.309
  276    H    GLU  42           HN       GLU  42  -6.203  14.034   0.615
  277    HA   GLU  42           HA       GLU  42  -8.523  13.515   2.328
  278    HB2  GLU  42           HB2      GLU  42  -8.352  13.695  -0.682
  279    HB3  GLU  42           HB1      GLU  42  -9.823  13.602   0.276
  280    HG2  GLU  42           HG2      GLU  42  -9.466  15.768   1.184
  281    HG3  GLU  42           HG1      GLU  42  -7.843  15.851   0.501
  282    H    ARG  43           HN       ARG  43  -6.614  11.560   2.579
  283    HA   ARG  43           HA       ARG  43  -7.947   9.298   1.278
  284    HB2  ARG  43           HB2      ARG  43  -4.952   9.669   1.469
  285    HB3  ARG  43           HB1      ARG  43  -5.738   8.172   0.993
  286    HG2  ARG  43           HG2      ARG  43  -6.045  10.781  -0.471
  287    HG3  ARG  43           HG1      ARG  43  -4.885   9.526  -0.905
  288    HD2  ARG  43           HD2      ARG  43  -6.655   7.973  -1.371
  289    HD3  ARG  43           HD1      ARG  43  -7.864   9.088  -0.739
  290    HE   ARG  43           HE       ARG  43  -6.510  10.369  -2.820
  291   HH11  ARG  43          HH11      ARG  43  -8.633   7.623  -2.377
  292   HH12  ARG  43          HH12      ARG  43  -9.375   7.785  -3.937
  293   HH21  ARG  43          HH21      ARG  43  -7.492  10.583  -4.882
  294   HH22  ARG  43          HH22      ARG  43  -8.719   9.450  -5.362
  295    H    THR  44           HN       THR  44  -8.272   7.569   2.578
  296    HA   THR  44           HA       THR  44  -7.493   7.928   5.373
  297    HB   THR  44           HB       THR  44  -9.314   6.229   5.809
  298    HG1  THR  44           HG1      THR  44 -10.613   5.617   4.152
  299   HG21  THR  44          HG21      THR  44  -9.708   8.617   6.115
  300   HG22  THR  44          HG22      THR  44 -11.144   7.849   5.440
  301   HG23  THR  44          HG23      THR  44 -10.076   8.793   4.401
  302    HA   PRO  45           HA       PRO  45  -4.529   4.656   4.469
  303    HB2  PRO  45           HB2      PRO  45  -3.791   4.949   7.298
  304    HB3  PRO  45           HB1      PRO  45  -2.809   5.190   5.848
  305    HG2  PRO  45           HG2      PRO  45  -3.630   7.249   7.389
  306    HG3  PRO  45           HG1      PRO  45  -3.421   7.398   5.634
  307    HD2  PRO  45           HD2      PRO  45  -5.939   7.073   7.228
  308    HD3  PRO  45           HD1      PRO  45  -5.630   8.077   5.791
  309    H    TRP  46           HN       TRP  46  -6.899   4.700   7.020
  310    HA   TRP  46           HA       TRP  46  -6.426   1.899   7.674
  311    HB2  TRP  46           HB2      TRP  46  -8.232   2.235   9.367
  312    HB3  TRP  46           HB1      TRP  46  -6.880   3.344   9.562
  313    HD1  TRP  46           HD1      TRP  46 -10.583   3.261   8.631
  314    HE1  TRP  46           HE1      TRP  46 -11.511   5.659   8.682
  315    HE3  TRP  46           HE3      TRP  46  -6.200   5.814   9.246
  316    HZ2  TRP  46           HZ2      TRP  46 -10.521   8.278   8.948
  317    HZ3  TRP  46           HZ3      TRP  46  -6.280   8.271   9.385
  318    HH2  TRP  46           HH2      TRP  46  -8.390   9.473   9.235
  319    H    ASN  47           HN       ASN  47  -7.452   2.820   5.048
  320    HA   ASN  47           HA       ASN  47  -9.842   1.117   4.977
  321    HB2  ASN  47           HB2      ASN  47 -10.569   3.451   4.727
  322    HB3  ASN  47           HB1      ASN  47  -9.421   3.678   3.414
  323   HD21  ASN  47          HD21      ASN  47 -11.414   0.809   3.914
  324   HD22  ASN  47          HD22      ASN  47 -12.366   1.011   2.482
  325    H    CYS  48           HN       CYS  48  -9.433  -0.609   3.773
  326    HA   CYS  48           HA       CYS  48  -7.129  -0.605   2.002
  327    HB2  CYS  48           HB2      CYS  48  -7.450  -2.456   3.619
  328    HB3  CYS  48           HB1      CYS  48  -8.983  -2.847   2.855
  329    H    ILE  49           HN       ILE  49  -7.348  -0.264  -0.091
  330    HA   ILE  49           HA       ILE  49  -9.978  -0.141  -1.273
  331    HB   ILE  49           HB       ILE  49  -8.650   0.466  -3.380
  332   HG12  ILE  49          HG12      ILE  49  -6.418   0.739  -1.358
  333   HG13  ILE  49          HG11      ILE  49  -6.491  -0.505  -2.602
  334   HG21  ILE  49          HG21      ILE  49  -8.266   2.759  -2.589
  335   HG22  ILE  49          HG22      ILE  49  -8.411   2.204  -0.922
  336   HG23  ILE  49          HG23      ILE  49  -9.801   2.116  -2.006
  337   HD11  ILE  49          HD11      ILE  49  -6.379   1.220  -4.322
  338   HD12  ILE  49          HD12      ILE  49  -5.002   1.318  -3.223
  339   HD13  ILE  49          HD13      ILE  49  -6.333   2.464  -3.075
  340    H    PHE  50           HN       PHE  50  -7.346  -2.378  -1.173
  341    HA   PHE  50           HA       PHE  50  -8.125  -3.736  -3.585
  342    HB2  PHE  50           HB2      PHE  50  -5.927  -4.158  -1.604
  343    HB3  PHE  50           HB1      PHE  50  -6.371  -5.463  -2.711
  344    HD1  PHE  50           HD1      PHE  50  -6.034  -5.257  -5.082
  345    HD2  PHE  50           HD2      PHE  50  -4.986  -2.086  -2.454
  346    HE1  PHE  50           HE1      PHE  50  -4.796  -4.168  -6.901
  347    HE2  PHE  50           HE2      PHE  50  -3.745  -0.988  -4.263
  348    HZ   PHE  50           HZ       PHE  50  -3.651  -2.029  -6.497
  349    H    CYS  51           HN       CYS  51  -8.729  -4.125  -0.163
  350    HA   CYS  51           HA       CYS  51  -9.820  -6.716  -0.281
  351    HB2  CYS  51           HB2      CYS  51 -10.021  -4.418   1.575
  352    HB3  CYS  51           HB1      CYS  51 -11.341  -5.581   1.644
  353    H    ARG  52           HN       ARG  52 -11.171  -3.569  -1.121
  354    HA   ARG  52           HA       ARG  52 -13.758  -4.734  -1.688
  355    HB2  ARG  52           HB2      ARG  52 -12.732  -1.940  -2.229
  356    HB3  ARG  52           HB1      ARG  52 -14.400  -2.471  -2.383
  357    HG2  ARG  52           HG2      ARG  52 -14.446  -2.954   0.031
  358    HG3  ARG  52           HG1      ARG  52 -12.793  -2.352   0.160
  359    HD2  ARG  52           HD2      ARG  52 -15.193  -0.769  -0.748
  360    HD3  ARG  52           HD1      ARG  52 -14.413  -0.655   0.828
  361    HE   ARG  52           HE       ARG  52 -12.813  -0.094  -1.557
  362   HH11  ARG  52          HH11      ARG  52 -14.483   1.091   1.284
  363   HH12  ARG  52          HH12      ARG  52 -13.701   2.638   1.249
  364   HH21  ARG  52          HH21      ARG  52 -11.789   1.940  -1.605
  365   HH22  ARG  52          HH22      ARG  52 -12.155   3.118  -0.383
  366    H    MET  53           HN       MET  53 -10.824  -4.402  -3.264
  367    HA   MET  53           HA       MET  53 -12.090  -4.688  -5.907
  368    HB2  MET  53           HB2      MET  53  -9.360  -3.631  -5.164
  369    HB3  MET  53           HB1      MET  53  -9.824  -4.025  -6.811
  370    HG2  MET  53           HG2      MET  53 -11.580  -2.353  -6.739
  371    HG3  MET  53           HG1      MET  53 -11.175  -1.981  -5.065
  372    HE1  MET  53           HE1      MET  53 -11.360   0.168  -7.489
  373    HE2  MET  53           HE2      MET  53  -9.976   1.186  -7.094
  374    HE3  MET  53           HE3      MET  53 -11.035   0.604  -5.812
  375    H    LYS  54           HN       LYS  54 -11.626  -6.734  -3.858
  376    HA   LYS  54           HA       LYS  54  -9.492  -8.379  -4.824
  377    HB2  LYS  54           HB2      LYS  54 -10.333 -10.070  -3.258
  378    HB3  LYS  54           HB1      LYS  54 -10.181  -8.503  -2.475
  379    HG2  LYS  54           HG2      LYS  54 -12.588  -8.147  -2.718
  380    HG3  LYS  54           HG1      LYS  54 -12.742  -9.734  -3.477
  381    HD2  LYS  54           HD2      LYS  54 -11.906 -10.793  -1.437
  382    HD3  LYS  54           HD1      LYS  54 -11.732  -9.207  -0.682
  383    HE2  LYS  54           HE2      LYS  54 -14.311 -10.467  -1.614
  384    HE3  LYS  54           HE1      LYS  54 -13.777 -10.302   0.057
  385    HZ1  LYS  54           HZ1      LYS  54 -13.809  -7.878  -0.249
  386    HZ2  LYS  54           HZ2      LYS  54 -15.335  -8.575  -0.459
  387    HZ3  LYS  54           HZ3      LYS  54 -14.438  -8.089  -1.807
  388    H    GLU  55           HN       GLU  55  -9.623 -10.226  -6.054
  389    HA   GLU  55           HA       GLU  55 -11.856 -10.270  -7.905
  390    HB2  GLU  55           HB2      GLU  55  -9.511 -10.332  -8.696
  391    HB3  GLU  55           HB1      GLU  55  -9.300 -11.879  -7.892
  392    HG2  GLU  55           HG2      GLU  55 -10.988 -12.870  -9.346
  393    HG3  GLU  55           HG1      GLU  55 -11.206 -11.314 -10.150
  394    H    SER  56           HN       SER  56 -13.490 -11.123  -6.582
  395    HA   SER  56           HA       SER  56 -13.334 -14.016  -6.220
  396    HB2  SER  56           HB2      SER  56 -12.713 -12.929  -4.037
  397    HB3  SER  56           HB1      SER  56 -14.304 -12.174  -4.015
  398    HG   SER  56           HG       SER  56 -13.733 -14.961  -3.990
  Start of MODEL   13
    1    H1   GLY   1           HT1      GLY   1  17.662  -9.453  11.549
    2    H2   GLY   1           HT2      GLY   1  17.486 -11.121  11.747
    3    H3   GLY   1           HT3      GLY   1  16.341 -10.249  10.860
    4    HA2  GLY   1           HA1      GLY   1  19.173 -10.686  10.114
    5    HA3  GLY   1           HA2      GLY   1  17.778 -11.451   9.369
    6    H    ALA   2           HN       ALA   2  18.651 -10.518   7.368
    7    HA   ALA   2           HA       ALA   2  18.153  -7.623   7.161
    8    HB1  ALA   2           HB1      ALA   2  20.464  -8.293   6.685
    9    HB2  ALA   2           HB2      ALA   2  19.678  -7.612   5.260
   10    HB3  ALA   2           HB3      ALA   2  19.889  -9.357   5.402
   11    H    MET   3           HN       MET   3  16.370 -10.160   6.787
   12    HA   MET   3           HA       MET   3  15.034  -9.090   4.427
   13    HB2  MET   3           HB2      MET   3  16.099 -11.880   4.648
   14    HB3  MET   3           HB1      MET   3  14.598 -11.600   3.775
   15    HG2  MET   3           HG2      MET   3  17.238 -10.274   3.177
   16    HG3  MET   3           HG1      MET   3  16.540 -11.627   2.286
   17    HE1  MET   3           HE1      MET   3  16.878 -10.216   0.062
   18    HE2  MET   3           HE2      MET   3  17.497  -8.835   0.964
   19    HE3  MET   3           HE3      MET   3  16.195  -8.614  -0.205
   20    H    GLY   4           HN       GLY   4  12.871 -10.207   4.110
   21    HA2  GLY   4           HA2      GLY   4  11.222 -11.582   5.499
   22    HA3  GLY   4           HA1      GLY   4  11.601 -10.409   6.758
   23    H    MET   5           HN       MET   5  11.024  -8.209   6.431
   24    HA   MET   5           HA       MET   5   9.093  -7.766   4.257
   25    HB2  MET   5           HB2      MET   5   8.057  -7.885   6.550
   26    HB3  MET   5           HB1      MET   5   9.006  -6.473   6.992
   27    HG2  MET   5           HG2      MET   5   6.706  -5.890   6.407
   28    HG3  MET   5           HG1      MET   5   7.873  -5.143   5.318
   29    HE1  MET   5           HE1      MET   5   5.270  -8.795   4.215
   30    HE2  MET   5           HE2      MET   5   5.204  -7.971   5.772
   31    HE3  MET   5           HE3      MET   5   6.635  -8.901   5.327
   32    H    ARG   6           HN       ARG   6  11.605  -7.353   3.645
   33    HA   ARG   6           HA       ARG   6  11.977  -4.444   3.873
   34    HB2  ARG   6           HB2      ARG   6  14.119  -6.561   3.626
   35    HB3  ARG   6           HB1      ARG   6  14.402  -4.826   3.630
   36    HG2  ARG   6           HG2      ARG   6  13.443  -4.725   5.912
   37    HG3  ARG   6           HG1      ARG   6  13.316  -6.485   5.889
   38    HD2  ARG   6           HD2      ARG   6  15.751  -6.622   5.511
   39    HD3  ARG   6           HD1      ARG   6  15.846  -4.866   5.639
   40    HE   ARG   6           HE       ARG   6  14.644  -6.223   7.896
   41   HH11  ARG   6          HH11      ARG   6  17.570  -4.932   6.481
   42   HH12  ARG   6          HH12      ARG   6  18.390  -4.778   8.003
   43   HH21  ARG   6          HH21      ARG   6  15.710  -5.995   9.904
   44   HH22  ARG   6          HH22      ARG   6  17.324  -5.365   9.954
   45    H    ASN   7           HN       ASN   7  10.449  -4.754   1.954
   46    HA   ASN   7           HA       ASN   7  12.167  -4.722  -0.438
   47    HB2  ASN   7           HB2      ASN   7  10.400  -6.584  -0.350
   48    HB3  ASN   7           HB1      ASN   7   9.207  -5.302  -0.521
   49   HD21  ASN   7          HD21      ASN   7   9.137  -4.114  -2.491
   50   HD22  ASN   7          HD22      ASN   7   9.853  -4.737  -3.935
   51    H    LEU   8           HN       LEU   8  12.253  -2.559   0.898
   52    HA   LEU   8           HA       LEU   8  10.172  -0.744  -0.129
   53    HB2  LEU   8           HB2      LEU   8  11.905  -0.252   2.275
   54    HB3  LEU   8           HB1      LEU   8  10.439   0.590   1.821
   55    HG   LEU   8           HG       LEU   8  10.549  -2.282   2.736
   56   HD11  LEU   8          HD11      LEU   8   9.744   0.213   4.224
   57   HD12  LEU   8          HD12      LEU   8  11.168  -0.777   4.539
   58   HD13  LEU   8          HD13      LEU   8   9.559  -1.438   4.812
   59   HD21  LEU   8          HD21      LEU   8   8.118  -2.047   2.941
   60   HD22  LEU   8          HD22      LEU   8   8.659  -1.827   1.278
   61   HD23  LEU   8          HD23      LEU   8   8.221  -0.426   2.256
   62    H    ASP   9           HN       ASP   9  12.954  -1.673  -1.095
   63    HA   ASP   9           HA       ASP   9  14.469   0.812  -0.986
   64    HB2  ASP   9           HB2      ASP   9  15.153  -1.873  -2.187
   65    HB3  ASP   9           HB1      ASP   9  16.233  -0.483  -2.177
   66    H    GLU  10           HN       GLU  10  12.367  -0.855  -3.085
   67    HA   GLU  10           HA       GLU  10  13.137   0.815  -5.371
   68    HB2  GLU  10           HB2      GLU  10  11.174  -1.482  -5.249
   69    HB3  GLU  10           HB1      GLU  10  11.727  -0.663  -6.702
   70    HG2  GLU  10           HG2      GLU  10  13.886  -1.564  -6.515
   71    HG3  GLU  10           HG1      GLU  10  13.605  -2.098  -4.859
   72    H    CYS  11           HN       CYS  11  11.105   0.871  -2.788
   73    HA   CYS  11           HA       CYS  11   8.895   2.156  -4.218
   74    HB2  CYS  11           HB2      CYS  11   8.448   0.291  -2.575
   75    HB3  CYS  11           HB1      CYS  11   9.023   1.359  -1.308
   76    H    GLU  12           HN       GLU  12   9.738   4.145  -4.626
   77    HA   GLU  12           HA       GLU  12  11.358   5.629  -2.894
   78    HB2  GLU  12           HB2      GLU  12  10.974   5.879  -5.419
   79    HB3  GLU  12           HB1      GLU  12   9.561   6.829  -4.982
   80    HG2  GLU  12           HG2      GLU  12  11.443   8.268  -5.460
   81    HG3  GLU  12           HG1      GLU  12  10.988   8.389  -3.761
   82    H    VAL  13           HN       VAL  13   7.902   5.382  -3.220
   83    HA   VAL  13           HA       VAL  13   7.312   7.724  -1.730
   84    HB   VAL  13           HB       VAL  13   5.700   6.849  -3.311
   85   HG11  VAL  13          HG11      VAL  13   4.460   4.821  -2.933
   86   HG12  VAL  13          HG12      VAL  13   5.381   4.501  -1.466
   87   HG13  VAL  13          HG13      VAL  13   6.183   4.469  -3.037
   88   HG21  VAL  13          HG21      VAL  13   3.692   6.983  -1.955
   89   HG22  VAL  13          HG22      VAL  13   4.883   8.167  -1.413
   90   HG23  VAL  13          HG23      VAL  13   4.639   6.676  -0.503
   91    H    CYS  14           HN       CYS  14   7.751   4.318  -0.871
   92    HA   CYS  14           HA       CYS  14   6.983   4.550   1.844
   93    HB2  CYS  14           HB2      CYS  14   8.496   2.622   0.220
   94    HB3  CYS  14           HB1      CYS  14   8.962   2.671   1.915
   95    H    ARG  15           HN       ARG  15   9.966   5.099   0.132
   96    HA   ARG  15           HA       ARG  15  11.629   5.606   2.361
   97    HB2  ARG  15           HB2      ARG  15  12.395   5.080   0.051
   98    HB3  ARG  15           HB1      ARG  15  11.848   6.667  -0.460
   99    HG2  ARG  15           HG2      ARG  15  13.469   7.679   1.112
  100    HG3  ARG  15           HG1      ARG  15  14.068   6.056   1.479
  101    HD2  ARG  15           HD2      ARG  15  14.514   5.752  -0.952
  102    HD3  ARG  15           HD1      ARG  15  14.075   7.439  -1.196
  103    HE   ARG  15           HE       ARG  15  16.189   6.947   0.724
  104   HH11  ARG  15          HH11      ARG  15  15.297   7.804  -2.550
  105   HH12  ARG  15          HH12      ARG  15  16.876   8.400  -2.958
  106   HH21  ARG  15          HH21      ARG  15  18.273   7.745   0.196
  107   HH22  ARG  15          HH22      ARG  15  18.569   8.370  -1.396
  108    H    ASP  16           HN       ASP  16   9.596   7.609   0.344
  109    HA   ASP  16           HA       ASP  16  10.240  10.101   1.503
  110    HB2  ASP  16           HB2      ASP  16   9.155   9.769  -0.717
  111    HB3  ASP  16           HB1      ASP  16   7.686   9.270   0.106
  112    H    GLY  17           HN       GLY  17   8.423   7.486   2.693
  113    HA2  GLY  17           HA2      GLY  17   7.597   7.369   4.905
  114    HA3  GLY  17           HA1      GLY  17   7.502   9.124   4.938
  115    H    GLY  18           HN       GLY  18   6.273   7.500   2.186
  116    HA2  GLY  18           HA2      GLY  18   3.691   8.565   2.394
  117    HA3  GLY  18           HA1      GLY  18   4.164   7.260   1.326
  118    H    GLU  19           HN       GLU  19   1.683   7.204   2.231
  119    HA   GLU  19           HA       GLU  19   1.652   5.377   4.527
  120    HB2  GLU  19           HB2      GLU  19  -0.476   7.188   3.385
  121    HB3  GLU  19           HB1      GLU  19  -0.813   5.979   4.618
  122    HG2  GLU  19           HG2      GLU  19   0.836   7.095   6.097
  123    HG3  GLU  19           HG1      GLU  19   1.060   8.331   4.864
  124    H    LEU  20           HN       LEU  20   0.134   3.611   4.471
  125    HA   LEU  20           HA       LEU  20  -0.135   2.473   1.768
  126    HB2  LEU  20           HB2      LEU  20   0.318   1.266   4.469
  127    HB3  LEU  20           HB1      LEU  20  -0.418   0.311   3.202
  128    HG   LEU  20           HG       LEU  20   2.250   1.668   2.848
  129   HD11  LEU  20          HD11      LEU  20   3.261  -0.507   3.365
  130   HD12  LEU  20          HD12      LEU  20   1.673  -1.131   3.813
  131   HD13  LEU  20          HD13      LEU  20   2.410   0.162   4.758
  132   HD21  LEU  20          HD21      LEU  20   1.122   0.994   0.800
  133   HD22  LEU  20          HD22      LEU  20   0.881  -0.627   1.448
  134   HD23  LEU  20          HD23      LEU  20   2.509  -0.051   1.105
  135    H    PHE  21           HN       PHE  21  -2.134   1.997   1.005
  136    HA   PHE  21           HA       PHE  21  -4.366   2.459   2.862
  137    HB2  PHE  21           HB2      PHE  21  -4.330   2.655  -0.166
  138    HB3  PHE  21           HB1      PHE  21  -5.697   3.048   0.879
  139    HD1  PHE  21           HD1      PHE  21  -5.215   4.833   2.732
  140    HD2  PHE  21           HD2      PHE  21  -2.883   4.365  -0.806
  141    HE1  PHE  21           HE1      PHE  21  -4.359   7.113   2.992
  142    HE2  PHE  21           HE2      PHE  21  -2.034   6.656  -0.544
  143    HZ   PHE  21           HZ       PHE  21  -2.772   8.031   1.359
  144    H    CYS  22           HN       CYS  22  -3.115  -0.039   2.871
  145    HA   CYS  22           HA       CYS  22  -5.474  -1.620   2.384
  146    HB2  CYS  22           HB2      CYS  22  -4.389  -3.327   1.050
  147    HB3  CYS  22           HB1      CYS  22  -4.208  -1.767   0.246
  148    H    CYS  23           HN       CYS  23  -4.905  -4.028   3.060
  149    HA   CYS  23           HA       CYS  23  -4.144  -3.870   5.807
  150    HB2  CYS  23           HB2      CYS  23  -4.474  -6.438   4.257
  151    HB3  CYS  23           HB1      CYS  23  -4.789  -6.145   5.966
  152    H    ASP  24           HN       ASP  24  -2.473  -5.344   6.773
  153    HA   ASP  24           HA       ASP  24   0.069  -4.908   5.769
  154    HB2  ASP  24           HB2      ASP  24  -0.917  -7.085   7.620
  155    HB3  ASP  24           HB1      ASP  24   0.783  -6.779   7.298
  156    H    THR  25           HN       THR  25  -1.863  -7.883   5.538
  157    HA   THR  25           HA       THR  25   0.004  -9.338   4.016
  158    HB   THR  25           HB       THR  25  -2.993  -9.696   4.107
  159    HG1  THR  25           HG1      THR  25  -0.892 -10.524   5.831
  160   HG21  THR  25          HG21      THR  25  -0.767 -11.635   3.468
  161   HG22  THR  25          HG22      THR  25  -1.939 -10.983   2.323
  162   HG23  THR  25          HG23      THR  25  -2.474 -12.052   3.620
  163    H    CYS  26           HN       CYS  26  -2.802  -7.383   3.036
  164    HA   CYS  26           HA       CYS  26  -2.612  -7.917   0.280
  165    HB2  CYS  26           HB2      CYS  26  -3.706  -5.436   1.632
  166    HB3  CYS  26           HB1      CYS  26  -4.062  -5.964  -0.013
  167    H    SER  27           HN       SER  27  -1.086  -5.531   2.341
  168    HA   SER  27           HA       SER  27   0.171  -4.007   0.323
  169    HB2  SER  27           HB2      SER  27  -0.075  -3.203   2.626
  170    HB3  SER  27           HB1      SER  27   1.015  -4.466   3.193
  171    HG   SER  27           HG       SER  27   1.634  -2.058   2.281
  172    H    ARG  28           HN       ARG  28   0.927  -7.094   1.713
  173    HA   ARG  28           HA       ARG  28   3.654  -7.099   0.844
  174    HB2  ARG  28           HB2      ARG  28   2.926  -8.506   2.720
  175    HB3  ARG  28           HB1      ARG  28   1.860  -9.398   1.644
  176    HG2  ARG  28           HG2      ARG  28   3.813 -10.153   0.365
  177    HG3  ARG  28           HG1      ARG  28   4.864  -9.302   1.496
  178    HD2  ARG  28           HD2      ARG  28   4.057 -10.698   3.317
  179    HD3  ARG  28           HD1      ARG  28   2.960 -11.527   2.213
  180    HE   ARG  28           HE       ARG  28   5.673 -11.648   1.332
  181   HH11  ARG  28          HH11      ARG  28   3.396 -13.093   3.561
  182   HH12  ARG  28          HH12      ARG  28   4.201 -14.628   3.578
  183   HH21  ARG  28          HH21      ARG  28   6.734 -13.654   1.352
  184   HH22  ARG  28          HH22      ARG  28   6.099 -14.952   2.313
  185    H    VAL  29           HN       VAL  29   0.568  -8.017  -0.474
  186    HA   VAL  29           HA       VAL  29   1.761  -9.400  -2.719
  187    HB   VAL  29           HB       VAL  29  -1.146  -8.775  -2.184
  188   HG11  VAL  29          HG11      VAL  29   0.108 -10.702  -4.135
  189   HG12  VAL  29          HG12      VAL  29  -0.655  -9.170  -4.555
  190   HG13  VAL  29          HG13      VAL  29  -1.619 -10.473  -3.863
  191   HG21  VAL  29          HG21      VAL  29   0.470 -11.264  -1.649
  192   HG22  VAL  29          HG22      VAL  29  -1.288 -11.165  -1.543
  193   HG23  VAL  29          HG23      VAL  29  -0.285 -10.212  -0.451
  194    H    PHE  30           HN       PHE  30  -0.199  -6.463  -2.203
  195    HA   PHE  30           HA       PHE  30   0.532  -5.637  -4.943
  196    HB2  PHE  30           HB2      PHE  30  -1.942  -4.860  -3.376
  197    HB3  PHE  30           HB1      PHE  30  -1.545  -4.328  -5.005
  198    HD1  PHE  30           HD1      PHE  30  -1.167  -6.313  -6.733
  199    HD2  PHE  30           HD2      PHE  30  -3.405  -6.589  -3.118
  200    HE1  PHE  30           HE1      PHE  30  -2.402  -8.231  -7.644
  201    HE2  PHE  30           HE2      PHE  30  -4.636  -8.513  -4.025
  202    HZ   PHE  30           HZ       PHE  30  -4.136  -9.337  -6.291
  203    H    HIS  31           HN       HIS  31   2.370  -5.062  -3.117
  204    HA   HIS  31           HA       HIS  31   2.064  -2.907  -1.413
  205    HB2  HIS  31           HB2      HIS  31   4.029  -4.429  -1.514
  206    HB3  HIS  31           HB1      HIS  31   4.554  -3.601  -2.976
  207    HD1  HIS  31           HD1      HIS  31   3.783  -2.673   0.657
  208    HD2  HIS  31           HD2      HIS  31   6.285  -1.618  -2.493
  209    HE1  HIS  31           HE1      HIS  31   5.444  -0.990   1.592
  210    H    GLU  32           HN       GLU  32   3.072  -2.860  -4.814
  211    HA   GLU  32           HA       GLU  32   3.691  -0.102  -4.873
  212    HB2  GLU  32           HB2      GLU  32   3.077  -2.089  -7.052
  213    HB3  GLU  32           HB1      GLU  32   3.506  -0.417  -7.386
  214    HG2  GLU  32           HG2      GLU  32   5.221  -2.375  -5.882
  215    HG3  GLU  32           HG1      GLU  32   5.422  -1.936  -7.578
  216    H    ASP  33           HN       ASP  33   0.805  -1.940  -5.584
  217    HA   ASP  33           HA       ASP  33  -0.643   0.311  -6.619
  218    HB2  ASP  33           HB2      ASP  33  -1.643  -2.400  -5.733
  219    HB3  ASP  33           HB1      ASP  33  -2.583  -1.205  -6.622
  220    H    CYS  34           HN       CYS  34  -0.091  -1.114  -3.530
  221    HA   CYS  34           HA       CYS  34  -2.347  -0.010  -2.187
  222    HB2  CYS  34           HB2      CYS  34   0.258  -1.207  -1.291
  223    HB3  CYS  34           HB1      CYS  34  -0.821  -0.440  -0.128
  224    H    HIS  35           HN       HIS  35   0.474   1.386  -3.392
  225    HA   HIS  35           HA       HIS  35   0.289   3.674  -1.566
  226    HB2  HIS  35           HB2      HIS  35   2.351   2.926  -3.642
  227    HB3  HIS  35           HB1      HIS  35   2.375   4.442  -2.743
  228    HD1  HIS  35           HD1      HIS  35   2.910   4.243  -0.139
  229    HD2  HIS  35           HD2      HIS  35   3.218   0.709  -2.303
  230    HE1  HIS  35           HE1      HIS  35   4.182   2.621   1.325
  231    H    ILE  36           HN       ILE  36  -1.304   2.702  -4.123
  232    HA   ILE  36           HA       ILE  36  -1.508   5.384  -5.326
  233    HB   ILE  36           HB       ILE  36  -1.923   2.731  -6.728
  234   HG12  ILE  36          HG12      ILE  36   0.305   4.760  -7.032
  235   HG13  ILE  36          HG11      ILE  36   0.452   3.184  -6.265
  236   HG21  ILE  36          HG21      ILE  36  -3.383   4.473  -7.589
  237   HG22  ILE  36          HG22      ILE  36  -2.131   4.075  -8.766
  238   HG23  ILE  36          HG23      ILE  36  -2.000   5.546  -7.804
  239   HD11  ILE  36          HD11      ILE  36   1.367   3.140  -8.503
  240   HD12  ILE  36          HD12      ILE  36  -0.171   3.692  -9.165
  241   HD13  ILE  36          HD13      ILE  36  -0.058   2.107  -8.404
  242    HA   PRO  37           HA       PRO  37  -2.919   6.759  -6.181
  243    HB2  PRO  37           HB2      PRO  37  -4.441   8.633  -4.953
  244    HB3  PRO  37           HB1      PRO  37  -5.027   7.704  -6.347
  245    HG2  PRO  37           HG2      PRO  37  -5.537   7.267  -3.415
  246    HG3  PRO  37           HG1      PRO  37  -6.691   7.231  -4.765
  247    HD2  PRO  37           HD2      PRO  37  -5.650   4.974  -3.686
  248    HD3  PRO  37           HD1      PRO  37  -6.065   5.100  -5.409
  249    HA   PRO  38           HA       PRO  38  -0.007   7.832  -3.018
  250    HB2  PRO  38           HB2      PRO  38   0.617  10.372  -3.887
  251    HB3  PRO  38           HB1      PRO  38   1.313   8.889  -4.552
  252    HG2  PRO  38           HG2      PRO  38  -0.937  10.566  -5.592
  253    HG3  PRO  38           HG1      PRO  38   0.371   9.763  -6.485
  254    HD2  PRO  38           HD2      PRO  38  -2.120   8.732  -6.391
  255    HD3  PRO  38           HD1      PRO  38  -0.681   7.688  -6.406
  256    H    VAL  39           HN       VAL  39  -0.132   8.715  -1.054
  257    HA   VAL  39           HA       VAL  39  -2.509   9.705  -0.075
  258    HB   VAL  39           HB       VAL  39  -0.864   8.642   1.358
  259   HG11  VAL  39          HG11      VAL  39   1.092   9.915   2.186
  260   HG12  VAL  39          HG12      VAL  39   0.777  11.129   0.945
  261   HG13  VAL  39          HG13      VAL  39   1.197   9.481   0.482
  262   HG21  VAL  39          HG21      VAL  39  -2.548  10.047   2.393
  263   HG22  VAL  39          HG22      VAL  39  -1.492  11.452   2.241
  264   HG23  VAL  39          HG23      VAL  39  -1.037  10.116   3.298
  265    H    GLU  40           HN       GLU  40  -3.459  11.605  -0.023
  266    HA   GLU  40           HA       GLU  40  -1.892  14.054  -0.302
  267    HB2  GLU  40           HB2      GLU  40  -2.602  13.419  -2.580
  268    HB3  GLU  40           HB1      GLU  40  -4.275  13.380  -2.044
  269    HG2  GLU  40           HG2      GLU  40  -3.985  15.430  -3.152
  270    HG3  GLU  40           HG1      GLU  40  -4.022  15.799  -1.430
  271    H    ALA  41           HN       ALA  41  -5.152  12.674   0.147
  272    HA   ALA  41           HA       ALA  41  -5.580  14.568   2.329
  273    HB1  ALA  41           HB1      ALA  41  -7.577  14.204   0.097
  274    HB2  ALA  41           HB2      ALA  41  -6.555  15.621   0.337
  275    HB3  ALA  41           HB3      ALA  41  -7.783  15.207   1.534
  276    H    GLU  42           HN       GLU  42  -6.924  11.829   0.516
  277    HA   GLU  42           HA       GLU  42  -8.475  10.920   2.760
  278    HB2  GLU  42           HB2      GLU  42  -7.843   9.657   0.091
  279    HB3  GLU  42           HB1      GLU  42  -8.861   8.901   1.307
  280    HG2  GLU  42           HG2      GLU  42  -9.399  11.580   0.053
  281    HG3  GLU  42           HG1      GLU  42 -10.130  10.060  -0.462
  282    H    ARG  43           HN       ARG  43  -6.794  10.781   4.325
  283    HA   ARG  43           HA       ARG  43  -4.755   8.743   3.916
  284    HB2  ARG  43           HB2      ARG  43  -5.205  10.444   6.365
  285    HB3  ARG  43           HB1      ARG  43  -3.759   9.536   5.946
  286    HG2  ARG  43           HG2      ARG  43  -3.659  11.051   3.873
  287    HG3  ARG  43           HG1      ARG  43  -4.797  12.076   4.751
  288    HD2  ARG  43           HD2      ARG  43  -2.055  11.223   5.666
  289    HD3  ARG  43           HD1      ARG  43  -2.525  12.833   5.132
  290    HE   ARG  43           HE       ARG  43  -3.987  12.913   7.127
  291   HH11  ARG  43          HH11      ARG  43  -1.371  10.581   7.055
  292   HH12  ARG  43          HH12      ARG  43  -1.155  10.587   8.780
  293   HH21  ARG  43          HH21      ARG  43  -3.712  12.912   9.397
  294   HH22  ARG  43          HH22      ARG  43  -2.494  11.907  10.116
  295    H    THR  44           HN       THR  44  -6.029   6.891   3.889
  296    HA   THR  44           HA       THR  44  -7.257   6.198   6.470
  297    HB   THR  44           HB       THR  44  -8.930   4.857   5.202
  298    HG1  THR  44           HG1      THR  44  -7.639   4.715   3.250
  299   HG21  THR  44          HG21      THR  44 -10.287   6.754   4.447
  300   HG22  THR  44          HG22      THR  44  -8.860   7.791   4.477
  301   HG23  THR  44          HG23      THR  44  -9.492   7.117   5.978
  302    HA   PRO  45           HA       PRO  45  -4.053   2.987   5.471
  303    HB2  PRO  45           HB2      PRO  45  -3.675   2.994   8.383
  304    HB3  PRO  45           HB1      PRO  45  -2.487   3.243   7.099
  305    HG2  PRO  45           HG2      PRO  45  -3.295   5.253   8.700
  306    HG3  PRO  45           HG1      PRO  45  -2.873   5.516   6.997
  307    HD2  PRO  45           HD2      PRO  45  -5.583   5.271   8.263
  308    HD3  PRO  45           HD1      PRO  45  -5.026   6.403   7.007
  309    H    TRP  46           HN       TRP  46  -6.839   3.182   7.423
  310    HA   TRP  46           HA       TRP  46  -6.852   0.313   7.996
  311    HB2  TRP  46           HB2      TRP  46  -8.914   0.873   9.329
  312    HB3  TRP  46           HB1      TRP  46  -7.454   1.689   9.883
  313    HD1  TRP  46           HD1      TRP  46 -10.773   2.388   8.090
  314    HE1  TRP  46           HE1      TRP  46 -11.253   4.909   8.196
  315    HE3  TRP  46           HE3      TRP  46  -6.357   3.968  10.131
  316    HZ2  TRP  46           HZ2      TRP  46  -9.936   7.258   9.033
  317    HZ3  TRP  46           HZ3      TRP  46  -6.051   6.374  10.549
  318    HH2  TRP  46           HH2      TRP  46  -7.799   7.981  10.010
  319    H    ASN  47           HN       ASN  47  -7.641   2.213   5.496
  320    HA   ASN  47           HA       ASN  47 -10.029   0.640   4.795
  321    HB2  ASN  47           HB2      ASN  47 -10.451   3.078   4.834
  322    HB3  ASN  47           HB1      ASN  47  -9.155   3.313   3.667
  323   HD21  ASN  47          HD21      ASN  47  -9.465   2.616   1.507
  324   HD22  ASN  47          HD22      ASN  47 -11.050   2.304   0.879
  325    H    CYS  48           HN       CYS  48  -9.384  -1.055   3.646
  326    HA   CYS  48           HA       CYS  48  -7.065  -0.848   1.900
  327    HB2  CYS  48           HB2      CYS  48  -7.369  -2.789   3.425
  328    HB3  CYS  48           HB1      CYS  48  -8.855  -3.188   2.589
  329    H    ILE  49           HN       ILE  49  -7.277  -0.374  -0.170
  330    HA   ILE  49           HA       ILE  49  -9.826   0.064  -1.321
  331    HB   ILE  49           HB       ILE  49  -8.445   0.338  -3.490
  332   HG12  ILE  49          HG12      ILE  49  -6.208   0.340  -1.455
  333   HG13  ILE  49          HG11      ILE  49  -6.461  -0.908  -2.672
  334   HG21  ILE  49          HG21      ILE  49  -9.341   2.204  -2.246
  335   HG22  ILE  49          HG22      ILE  49  -7.695   2.576  -2.763
  336   HG23  ILE  49          HG23      ILE  49  -8.010   2.113  -1.091
  337   HD11  ILE  49          HD11      ILE  49  -4.720   0.607  -3.368
  338   HD12  ILE  49          HD12      ILE  49  -5.804   1.986  -3.174
  339   HD13  ILE  49          HD13      ILE  49  -6.121   0.783  -4.426
  340    H    PHE  50           HN       PHE  50  -7.717  -2.682  -1.301
  341    HA   PHE  50           HA       PHE  50  -8.956  -3.869  -3.638
  342    HB2  PHE  50           HB2      PHE  50  -6.801  -4.848  -1.764
  343    HB3  PHE  50           HB1      PHE  50  -7.487  -5.856  -3.039
  344    HD1  PHE  50           HD1      PHE  50  -7.068  -5.355  -5.375
  345    HD2  PHE  50           HD2      PHE  50  -5.375  -2.969  -2.282
  346    HE1  PHE  50           HE1      PHE  50  -5.486  -4.401  -6.983
  347    HE2  PHE  50           HE2      PHE  50  -3.793  -2.000  -3.893
  348    HZ   PHE  50           HZ       PHE  50  -3.929  -2.610  -6.261
  349    H    CYS  51           HN       CYS  51  -9.002  -4.247  -0.131
  350    HA   CYS  51           HA       CYS  51 -10.719  -6.520  -0.150
  351    HB2  CYS  51           HB2      CYS  51  -9.831  -4.628   2.000
  352    HB3  CYS  51           HB1      CYS  51 -11.122  -5.774   2.315
  353    H    ARG  52           HN       ARG  52 -11.351  -3.205  -0.708
  354    HA   ARG  52           HA       ARG  52 -14.090  -3.491   0.306
  355    HB2  ARG  52           HB2      ARG  52 -12.525  -0.975  -0.308
  356    HB3  ARG  52           HB1      ARG  52 -14.214  -1.008   0.174
  357    HG2  ARG  52           HG2      ARG  52 -11.860  -1.899   1.822
  358    HG3  ARG  52           HG1      ARG  52 -12.827  -0.441   2.056
  359    HD2  ARG  52           HD2      ARG  52 -13.772  -3.295   2.330
  360    HD3  ARG  52           HD1      ARG  52 -13.494  -2.153   3.642
  361    HE   ARG  52           HE       ARG  52 -15.352  -1.022   1.880
  362   HH11  ARG  52          HH11      ARG  52 -15.113  -3.708   4.116
  363   HH12  ARG  52          HH12      ARG  52 -16.810  -3.728   4.473
  364   HH21  ARG  52          HH21      ARG  52 -17.588  -1.048   2.345
  365   HH22  ARG  52          HH22      ARG  52 -18.220  -2.217   3.460
  366    H    MET  53           HN       MET  53 -12.294  -3.731  -2.442
  367    HA   MET  53           HA       MET  53 -14.230  -2.490  -4.220
  368    HB2  MET  53           HB2      MET  53 -12.741  -2.914  -5.999
  369    HB3  MET  53           HB1      MET  53 -11.715  -2.475  -4.644
  370    HG2  MET  53           HG2      MET  53 -11.243  -4.847  -4.247
  371    HG3  MET  53           HG1      MET  53 -12.257  -5.266  -5.625
  372    HE1  MET  53           HE1      MET  53  -9.339  -6.360  -5.427
  373    HE2  MET  53           HE2      MET  53  -8.728  -6.045  -7.051
  374    HE3  MET  53           HE3      MET  53 -10.377  -6.631  -6.828
  375    H    LYS  54           HN       LYS  54 -14.302  -5.130  -2.475
  376    HA   LYS  54           HA       LYS  54 -15.007  -7.232  -4.182
  377    HB2  LYS  54           HB2      LYS  54 -14.572  -7.569  -1.794
  378    HB3  LYS  54           HB1      LYS  54 -15.975  -6.594  -1.382
  379    HG2  LYS  54           HG2      LYS  54 -16.480  -8.936  -1.115
  380    HG3  LYS  54           HG1      LYS  54 -17.433  -8.265  -2.441
  381    HD2  LYS  54           HD2      LYS  54 -15.760  -9.172  -4.031
  382    HD3  LYS  54           HD1      LYS  54 -14.927  -9.929  -2.675
  383    HE2  LYS  54           HE2      LYS  54 -16.922 -11.239  -2.168
  384    HE3  LYS  54           HE1      LYS  54 -17.780 -10.461  -3.498
  385    HZ1  LYS  54           HZ1      LYS  54 -16.197 -11.427  -5.042
  386    HZ2  LYS  54           HZ2      LYS  54 -16.947 -12.637  -4.129
  387    HZ3  LYS  54           HZ3      LYS  54 -15.363 -12.166  -3.768
  388    H    GLU  55           HN       GLU  55 -16.834  -7.706  -5.277
  389    HA   GLU  55           HA       GLU  55 -19.062  -5.799  -5.028
  390    HB2  GLU  55           HB2      GLU  55 -17.960  -5.628  -7.191
  391    HB3  GLU  55           HB1      GLU  55 -18.145  -7.356  -7.450
  392    HG2  GLU  55           HG2      GLU  55 -20.549  -7.116  -7.536
  393    HG3  GLU  55           HG1      GLU  55 -20.410  -5.394  -7.182
  394    H    SER  56           HN       SER  56 -20.939  -6.592  -4.366
  395    HA   SER  56           HA       SER  56 -21.724  -9.296  -5.011
  396    HB2  SER  56           HB2      SER  56 -20.388  -9.493  -2.884
  397    HB3  SER  56           HB1      SER  56 -21.573  -8.447  -2.105
  398    HG   SER  56           HG       SER  56 -21.989 -11.027  -3.214
  Start of MODEL   14
    1    H1   GLY   1           HT1      GLY   1   6.487 -11.086  -4.246
    2    H2   GLY   1           HT2      GLY   1   8.127 -11.005  -4.637
    3    H3   GLY   1           HT3      GLY   1   7.644 -11.004  -3.018
    4    HA2  GLY   1           HA1      GLY   1   6.815 -13.246  -3.210
    5    HA3  GLY   1           HA2      GLY   1   7.258 -13.252  -4.910
    6    H    ALA   2           HN       ALA   2   8.325 -15.255  -3.782
    7    HA   ALA   2           HA       ALA   2  10.237 -16.369  -3.305
    8    HB1  ALA   2           HB1      ALA   2  12.343 -15.444  -4.106
    9    HB2  ALA   2           HB2      ALA   2  11.598 -13.854  -4.273
   10    HB3  ALA   2           HB3      ALA   2  11.065 -15.191  -5.294
   11    H    MET   3           HN       MET   3   9.002 -15.210  -1.147
   12    HA   MET   3           HA       MET   3   9.282 -14.638   1.032
   13    HB2  MET   3           HB2      MET   3  10.841 -16.612   0.901
   14    HB3  MET   3           HB1      MET   3  12.162 -15.480   0.643
   15    HG2  MET   3           HG2      MET   3  11.621 -14.435   2.832
   16    HG3  MET   3           HG1      MET   3  10.416 -15.697   3.089
   17    HE1  MET   3           HE1      MET   3  12.625 -18.919   3.250
   18    HE2  MET   3           HE2      MET   3  11.871 -18.244   1.807
   19    HE3  MET   3           HE3      MET   3  10.992 -18.262   3.336
   20    H    GLY   4           HN       GLY   4   9.209 -12.510  -0.481
   21    HA2  GLY   4           HA2      GLY   4  11.499 -10.823  -0.385
   22    HA3  GLY   4           HA1      GLY   4   9.856 -10.320  -0.753
   23    H    MET   5           HN       MET   5  12.328 -10.422   1.590
   24    HA   MET   5           HA       MET   5  10.648  -9.743   3.831
   25    HB2  MET   5           HB2      MET   5  13.658  -9.648   3.503
   26    HB3  MET   5           HB1      MET   5  12.809  -9.332   5.007
   27    HG2  MET   5           HG2      MET   5  11.931 -11.613   4.990
   28    HG3  MET   5           HG1      MET   5  12.796 -11.938   3.494
   29    HE1  MET   5           HE1      MET   5  13.061 -13.729   6.161
   30    HE2  MET   5           HE2      MET   5  14.799 -14.029   6.130
   31    HE3  MET   5           HE3      MET   5  13.870 -14.071   4.631
   32    H    ARG   6           HN       ARG   6   9.543  -7.903   3.299
   33    HA   ARG   6           HA       ARG   6   9.097  -5.715   2.945
   34    HB2  ARG   6           HB2      ARG   6  11.855  -5.327   4.117
   35    HB3  ARG   6           HB1      ARG   6  10.656  -4.059   3.906
   36    HG2  ARG   6           HG2      ARG   6   9.161  -5.217   5.458
   37    HG3  ARG   6           HG1      ARG   6  10.368  -6.486   5.667
   38    HD2  ARG   6           HD2      ARG   6  11.949  -4.756   6.504
   39    HD3  ARG   6           HD1      ARG   6  10.638  -3.580   6.422
   40    HE   ARG   6           HE       ARG   6   9.914  -5.878   7.943
   41   HH11  ARG   6          HH11      ARG   6  11.634  -2.831   8.106
   42   HH12  ARG   6          HH12      ARG   6  11.502  -2.707   9.830
   43   HH21  ARG   6          HH21      ARG   6   9.741  -5.717  10.203
   44   HH22  ARG   6          HH22      ARG   6  10.406  -4.341  11.023
   45    H    ASN   7           HN       ASN   7   9.227  -6.368   0.653
   46    HA   ASN   7           HA       ASN   7  11.544  -5.483  -0.842
   47    HB2  ASN   7           HB2      ASN   7  10.158  -7.470  -1.530
   48    HB3  ASN   7           HB1      ASN   7   8.850  -6.357  -1.915
   49   HD21  ASN   7          HD21      ASN   7   9.052  -5.007  -3.737
   50   HD22  ASN   7          HD22      ASN   7  10.246  -5.283  -4.960
   51    H    LEU   8           HN       LEU   8  11.427  -3.313   0.022
   52    HA   LEU   8           HA       LEU   8   9.555  -1.636  -1.485
   53    HB2  LEU   8           HB2      LEU   8   9.498  -0.116   0.533
   54    HB3  LEU   8           HB1      LEU   8   8.629  -1.628   0.677
   55    HG   LEU   8           HG       LEU   8  10.772  -2.495   1.851
   56   HD11  LEU   8          HD11      LEU   8  12.043  -0.806   3.047
   57   HD12  LEU   8          HD12      LEU   8  11.141   0.472   2.233
   58   HD13  LEU   8          HD13      LEU   8  12.200  -0.589   1.303
   59   HD21  LEU   8          HD21      LEU   8   9.948  -1.646   4.009
   60   HD22  LEU   8          HD22      LEU   8   8.648  -2.226   2.968
   61   HD23  LEU   8          HD23      LEU   8   8.928  -0.494   3.147
   62    H    ASP   9           HN       ASP   9  12.396  -2.453  -1.747
   63    HA   ASP   9           HA       ASP   9  13.939  -0.072  -1.192
   64    HB2  ASP   9           HB2      ASP   9  14.643  -2.598  -2.701
   65    HB3  ASP   9           HB1      ASP   9  15.774  -1.287  -2.383
   66    H    GLU  10           HN       GLU  10  12.155  -1.444  -3.778
   67    HA   GLU  10           HA       GLU  10  13.075   0.544  -5.699
   68    HB2  GLU  10           HB2      GLU  10  11.644  -0.648  -7.285
   69    HB3  GLU  10           HB1      GLU  10  12.711  -1.770  -6.452
   70    HG2  GLU  10           HG2      GLU  10  10.752  -2.167  -4.862
   71    HG3  GLU  10           HG1      GLU  10   9.770  -1.365  -6.081
   72    H    CYS  11           HN       CYS  11  11.130   0.612  -3.170
   73    HA   CYS  11           HA       CYS  11   8.926   2.066  -4.440
   74    HB2  CYS  11           HB2      CYS  11   8.415   0.121  -2.957
   75    HB3  CYS  11           HB1      CYS  11   9.151   0.991  -1.625
   76    H    GLU  12           HN       GLU  12   9.891   4.051  -4.729
   77    HA   GLU  12           HA       GLU  12  11.478   5.393  -2.838
   78    HB2  GLU  12           HB2      GLU  12  11.346   5.917  -5.274
   79    HB3  GLU  12           HB1      GLU  12   9.752   6.601  -4.995
   80    HG2  GLU  12           HG2      GLU  12  11.357   8.371  -5.115
   81    HG3  GLU  12           HG1      GLU  12  10.760   8.245  -3.461
   82    H    VAL  13           HN       VAL  13   8.033   5.198  -3.344
   83    HA   VAL  13           HA       VAL  13   7.357   7.480  -1.829
   84    HB   VAL  13           HB       VAL  13   5.838   6.622  -3.501
   85   HG11  VAL  13          HG11      VAL  13   4.615   4.555  -3.224
   86   HG12  VAL  13          HG12      VAL  13   5.511   4.206  -1.749
   87   HG13  VAL  13          HG13      VAL  13   6.348   4.252  -3.300
   88   HG21  VAL  13          HG21      VAL  13   3.769   6.713  -2.277
   89   HG22  VAL  13          HG22      VAL  13   4.919   7.845  -1.561
   90   HG23  VAL  13          HG23      VAL  13   4.601   6.294  -0.782
   91    H    CYS  14           HN       CYS  14   8.115   4.194  -0.971
   92    HA   CYS  14           HA       CYS  14   6.947   4.204   1.625
   93    HB2  CYS  14           HB2      CYS  14   8.739   2.478   0.118
   94    HB3  CYS  14           HB1      CYS  14   9.210   2.599   1.809
   95    H    ARG  15           HN       ARG  15   9.987   5.261   0.294
   96    HA   ARG  15           HA       ARG  15  11.214   5.834   2.816
   97    HB2  ARG  15           HB2      ARG  15  11.928   6.753   0.032
   98    HB3  ARG  15           HB1      ARG  15  12.943   6.947   1.453
   99    HG2  ARG  15           HG2      ARG  15  13.140   4.539   1.673
  100    HG3  ARG  15           HG1      ARG  15  12.062   4.312   0.296
  101    HD2  ARG  15           HD2      ARG  15  13.655   5.417  -1.161
  102    HD3  ARG  15           HD1      ARG  15  14.714   5.737   0.209
  103    HE   ARG  15           HE       ARG  15  14.431   3.033   0.231
  104   HH11  ARG  15          HH11      ARG  15  15.407   5.349  -2.204
  105   HH12  ARG  15          HH12      ARG  15  16.483   4.252  -3.004
  106   HH21  ARG  15          HH21      ARG  15  15.850   1.586  -0.817
  107   HH22  ARG  15          HH22      ARG  15  16.734   2.106  -2.216
  108    H    ASP  16           HN       ASP  16   9.274   7.536   0.510
  109    HA   ASP  16           HA       ASP  16   9.633  10.135   1.640
  110    HB2  ASP  16           HB2      ASP  16   8.907   9.735  -0.708
  111    HB3  ASP  16           HB1      ASP  16   7.380   9.105  -0.104
  112    H    GLY  17           HN       GLY  17   8.074   7.410   2.732
  113    HA2  GLY  17           HA2      GLY  17   6.891   7.148   4.715
  114    HA3  GLY  17           HA1      GLY  17   6.731   8.898   4.818
  115    H    GLY  18           HN       GLY  18   5.843   7.103   1.954
  116    HA2  GLY  18           HA2      GLY  18   3.202   8.155   1.981
  117    HA3  GLY  18           HA1      GLY  18   3.822   6.944   0.876
  118    H    GLU  19           HN       GLU  19   1.481   7.451   2.964
  119    HA   GLU  19           HA       GLU  19   1.393   5.238   4.661
  120    HB2  GLU  19           HB2      GLU  19  -0.524   7.227   3.638
  121    HB3  GLU  19           HB1      GLU  19  -1.241   5.703   4.131
  122    HG2  GLU  19           HG2      GLU  19  -1.203   7.455   5.890
  123    HG3  GLU  19           HG1      GLU  19  -0.428   5.945   6.351
  124    H    LEU  20           HN       LEU  20   0.717   3.201   4.441
  125    HA   LEU  20           HA       LEU  20   0.153   2.172   1.792
  126    HB2  LEU  20           HB2      LEU  20   0.647   0.969   4.487
  127    HB3  LEU  20           HB1      LEU  20  -0.138   0.011   3.247
  128    HG   LEU  20           HG       LEU  20   2.524   1.343   2.780
  129   HD11  LEU  20          HD11      LEU  20   2.818  -0.089   4.699
  130   HD12  LEU  20          HD12      LEU  20   3.529  -0.864   3.281
  131   HD13  LEU  20          HD13      LEU  20   1.964  -1.402   3.891
  132   HD21  LEU  20          HD21      LEU  20   2.722  -0.432   1.077
  133   HD22  LEU  20          HD22      LEU  20   1.341   0.626   0.784
  134   HD23  LEU  20          HD23      LEU  20   1.094  -0.975   1.479
  135    H    PHE  21           HN       PHE  21  -1.865   2.012   1.012
  136    HA   PHE  21           HA       PHE  21  -4.087   2.306   2.901
  137    HB2  PHE  21           HB2      PHE  21  -3.968   2.618  -0.117
  138    HB3  PHE  21           HB1      PHE  21  -5.449   2.755   0.833
  139    HD1  PHE  21           HD1      PHE  21  -5.664   4.591   2.519
  140    HD2  PHE  21           HD2      PHE  21  -2.428   4.434  -0.256
  141    HE1  PHE  21           HE1      PHE  21  -5.175   6.959   2.951
  142    HE2  PHE  21           HE2      PHE  21  -1.942   6.802   0.178
  143    HZ   PHE  21           HZ       PHE  21  -3.314   8.068   1.785
  144    H    CYS  22           HN       CYS  22  -2.786  -0.081   2.952
  145    HA   CYS  22           HA       CYS  22  -4.903  -1.900   2.098
  146    HB2  CYS  22           HB2      CYS  22  -2.023  -1.985   1.282
  147    HB3  CYS  22           HB1      CYS  22  -2.918  -3.490   1.448
  148    H    CYS  23           HN       CYS  23  -4.712  -4.040   3.152
  149    HA   CYS  23           HA       CYS  23  -4.005  -3.857   5.921
  150    HB2  CYS  23           HB2      CYS  23  -4.567  -6.411   4.403
  151    HB3  CYS  23           HB1      CYS  23  -4.815  -6.100   6.120
  152    H    ASP  24           HN       ASP  24  -2.453  -5.509   6.923
  153    HA   ASP  24           HA       ASP  24   0.109  -5.127   5.949
  154    HB2  ASP  24           HB2      ASP  24  -0.930  -7.330   7.737
  155    HB3  ASP  24           HB1      ASP  24   0.779  -7.053   7.427
  156    H    THR  25           HN       THR  25  -1.966  -7.966   5.506
  157    HA   THR  25           HA       THR  25  -0.148  -9.399   3.887
  158    HB   THR  25           HB       THR  25  -3.154  -9.639   4.024
  159    HG1  THR  25           HG1      THR  25  -2.827 -10.856   5.773
  160   HG21  THR  25          HG21      THR  25  -1.056 -11.597   3.076
  161   HG22  THR  25          HG22      THR  25  -2.226 -10.761   2.058
  162   HG23  THR  25          HG23      THR  25  -2.777 -11.943   3.246
  163    H    CYS  26           HN       CYS  26  -2.927  -7.319   3.073
  164    HA   CYS  26           HA       CYS  26  -2.807  -7.680   0.293
  165    HB2  CYS  26           HB2      CYS  26  -3.793  -5.261   1.830
  166    HB3  CYS  26           HB1      CYS  26  -4.172  -5.629   0.150
  167    H    SER  27           HN       SER  27  -1.229  -5.358   2.414
  168    HA   SER  27           HA       SER  27  -0.029  -3.779   0.404
  169    HB2  SER  27           HB2      SER  27   0.843  -4.230   3.265
  170    HB3  SER  27           HB1      SER  27   1.427  -2.945   2.211
  171    HG   SER  27           HG       SER  27  -0.434  -2.555   3.756
  172    H    ARG  28           HN       ARG  28   0.848  -6.869   1.713
  173    HA   ARG  28           HA       ARG  28   3.580  -6.649   0.788
  174    HB2  ARG  28           HB2      ARG  28   2.030  -8.902   2.056
  175    HB3  ARG  28           HB1      ARG  28   3.684  -9.087   1.488
  176    HG2  ARG  28           HG2      ARG  28   4.425  -7.358   3.034
  177    HG3  ARG  28           HG1      ARG  28   2.765  -7.125   3.585
  178    HD2  ARG  28           HD2      ARG  28   3.975  -8.502   5.164
  179    HD3  ARG  28           HD1      ARG  28   2.728  -9.462   4.373
  180    HE   ARG  28           HE       ARG  28   4.714 -10.153   2.860
  181   HH11  ARG  28          HH11      ARG  28   4.859  -9.557   6.309
  182   HH12  ARG  28          HH12      ARG  28   6.173 -10.660   6.568
  183   HH21  ARG  28          HH21      ARG  28   6.451 -11.600   3.205
  184   HH22  ARG  28          HH22      ARG  28   7.083 -11.810   4.807
  185    H    VAL  29           HN       VAL  29   0.547  -7.670  -0.451
  186    HA   VAL  29           HA       VAL  29   1.786  -9.201  -2.591
  187    HB   VAL  29           HB       VAL  29  -1.140  -8.633  -2.087
  188   HG11  VAL  29          HG11      VAL  29  -1.559 -10.443  -3.675
  189   HG12  VAL  29          HG12      VAL  29   0.174 -10.599  -3.963
  190   HG13  VAL  29          HG13      VAL  29  -0.669  -9.124  -4.437
  191   HG21  VAL  29          HG21      VAL  29   0.527 -11.065  -1.459
  192   HG22  VAL  29          HG22      VAL  29  -1.229 -10.974  -1.321
  193   HG23  VAL  29          HG23      VAL  29  -0.212  -9.963  -0.295
  194    H    PHE  30           HN       PHE  30  -0.275  -6.306  -2.223
  195    HA   PHE  30           HA       PHE  30   0.401  -5.592  -5.009
  196    HB2  PHE  30           HB2      PHE  30  -1.906  -4.524  -3.359
  197    HB3  PHE  30           HB1      PHE  30  -1.627  -4.270  -5.077
  198    HD1  PHE  30           HD1      PHE  30  -1.614  -6.402  -6.555
  199    HD2  PHE  30           HD2      PHE  30  -3.333  -6.218  -2.662
  200    HE1  PHE  30           HE1      PHE  30  -3.004  -8.357  -7.080
  201    HE2  PHE  30           HE2      PHE  30  -4.723  -8.177  -3.182
  202    HZ   PHE  30           HZ       PHE  30  -4.599  -9.236  -5.347
  203    H    HIS  31           HN       HIS  31   2.331  -5.065  -3.212
  204    HA   HIS  31           HA       HIS  31   2.157  -2.939  -1.487
  205    HB2  HIS  31           HB2      HIS  31   4.048  -4.532  -1.662
  206    HB3  HIS  31           HB1      HIS  31   4.574  -3.710  -3.125
  207    HD1  HIS  31           HD1      HIS  31   4.053  -2.915   0.574
  208    HD2  HIS  31           HD2      HIS  31   6.330  -1.719  -2.691
  209    HE1  HIS  31           HE1      HIS  31   5.779  -1.286   1.465
  210    H    GLU  32           HN       GLU  32   3.100  -2.784  -4.918
  211    HA   GLU  32           HA       GLU  32   3.854  -0.034  -4.780
  212    HB2  GLU  32           HB2      GLU  32   3.217  -1.794  -7.152
  213    HB3  GLU  32           HB1      GLU  32   3.897  -0.179  -7.265
  214    HG2  GLU  32           HG2      GLU  32   5.892  -0.902  -6.103
  215    HG3  GLU  32           HG1      GLU  32   5.209  -2.513  -5.887
  216    H    ASP  33           HN       ASP  33   0.969  -1.764  -5.694
  217    HA   ASP  33           HA       ASP  33  -0.390   0.543  -6.733
  218    HB2  ASP  33           HB2      ASP  33  -1.416  -2.212  -6.008
  219    HB3  ASP  33           HB1      ASP  33  -2.353  -0.982  -6.850
  220    H    CYS  34           HN       CYS  34   0.012  -0.978  -3.676
  221    HA   CYS  34           HA       CYS  34  -2.334   0.158  -2.454
  222    HB2  CYS  34           HB2      CYS  34   0.029  -1.398  -1.415
  223    HB3  CYS  34           HB1      CYS  34  -1.184  -0.719  -0.329
  224    H    HIS  35           HN       HIS  35   0.515   1.504  -3.390
  225    HA   HIS  35           HA       HIS  35   0.525   3.489  -1.226
  226    HB2  HIS  35           HB2      HIS  35   2.459   2.877  -3.449
  227    HB3  HIS  35           HB1      HIS  35   2.562   4.365  -2.508
  228    HD1  HIS  35           HD1      HIS  35   3.155   4.061   0.086
  229    HD2  HIS  35           HD2      HIS  35   3.375   0.627  -2.238
  230    HE1  HIS  35           HE1      HIS  35   4.478   2.377   1.430
  231    H    ILE  36           HN       ILE  36  -1.230   3.022  -3.829
  232    HA   ILE  36           HA       ILE  36  -1.236   5.852  -4.658
  233    HB   ILE  36           HB       ILE  36  -2.054   3.461  -6.325
  234   HG12  ILE  36          HG12      ILE  36   0.440   5.170  -6.499
  235   HG13  ILE  36          HG11      ILE  36   0.377   3.512  -5.915
  236   HG21  ILE  36          HG21      ILE  36  -1.704   6.358  -7.088
  237   HG22  ILE  36          HG22      ILE  36  -3.244   5.523  -6.888
  238   HG23  ILE  36          HG23      ILE  36  -2.141   5.043  -8.178
  239   HD11  ILE  36          HD11      ILE  36  -0.355   2.775  -8.137
  240   HD12  ILE  36          HD12      ILE  36   1.211   3.585  -8.180
  241   HD13  ILE  36          HD13      ILE  36  -0.240   4.438  -8.711
  242    HA   PRO  37           HA       PRO  37  -2.548   7.371  -5.492
  243    HB2  PRO  37           HB2      PRO  37  -4.198   9.068  -3.767
  244    HB3  PRO  37           HB1      PRO  37  -4.155   8.993  -5.535
  245    HG2  PRO  37           HG2      PRO  37  -6.275   8.121  -4.107
  246    HG3  PRO  37           HG1      PRO  37  -5.780   7.357  -5.634
  247    HD2  PRO  37           HD2      PRO  37  -5.227   6.480  -2.810
  248    HD3  PRO  37           HD1      PRO  37  -5.760   5.507  -4.204
  249    HA   PRO  38           HA       PRO  38   0.495   8.340  -2.386
  250    HB2  PRO  38           HB2      PRO  38   0.359  11.103  -3.487
  251    HB3  PRO  38           HB1      PRO  38   1.762  10.054  -3.248
  252    HG2  PRO  38           HG2      PRO  38   0.756  10.460  -5.695
  253    HG3  PRO  38           HG1      PRO  38   1.389   8.875  -5.206
  254    HD2  PRO  38           HD2      PRO  38  -1.451   9.773  -5.502
  255    HD3  PRO  38           HD1      PRO  38  -0.727   8.182  -5.828
  256    H    VAL  39           HN       VAL  39   0.287   8.933  -0.311
  257    HA   VAL  39           HA       VAL  39  -2.187   9.831   0.633
  258    HB   VAL  39           HB       VAL  39  -0.820   8.376   1.972
  259   HG11  VAL  39          HG11      VAL  39   1.109  10.674   2.125
  260   HG12  VAL  39          HG12      VAL  39   1.394   9.078   1.436
  261   HG13  VAL  39          HG13      VAL  39   1.173   9.259   3.174
  262   HG21  VAL  39          HG21      VAL  39  -1.203  11.037   3.324
  263   HG22  VAL  39          HG22      VAL  39  -1.029   9.478   4.131
  264   HG23  VAL  39          HG23      VAL  39  -2.435   9.793   3.113
  265    H    GLU  40           HN       GLU  40  -3.003  11.758   0.578
  266    HA   GLU  40           HA       GLU  40  -1.268  14.075   1.102
  267    HB2  GLU  40           HB2      GLU  40  -3.583  13.876  -0.830
  268    HB3  GLU  40           HB1      GLU  40  -2.860  15.397  -0.333
  269    HG2  GLU  40           HG2      GLU  40  -1.460  13.168  -1.791
  270    HG3  GLU  40           HG1      GLU  40  -2.029  14.676  -2.500
  271    H    ALA  41           HN       ALA  41  -1.756  14.162   3.256
  272    HA   ALA  41           HA       ALA  41  -2.807  14.959   5.085
  273    HB1  ALA  41           HB1      ALA  41  -4.787  16.303   4.916
  274    HB2  ALA  41           HB2      ALA  41  -5.101  15.697   3.289
  275    HB3  ALA  41           HB3      ALA  41  -3.689  16.709   3.596
  276    H    GLU  42           HN       GLU  42  -4.351  12.629   3.091
  277    HA   GLU  42           HA       GLU  42  -6.120  11.797   5.271
  278    HB2  GLU  42           HB2      GLU  42  -5.961  10.722   2.451
  279    HB3  GLU  42           HB1      GLU  42  -7.204  10.364   3.640
  280    HG2  GLU  42           HG2      GLU  42  -8.008  12.618   3.567
  281    HG3  GLU  42           HG1      GLU  42  -6.673  13.105   2.521
  282    H    ARG  43           HN       ARG  43  -4.158  11.161   6.481
  283    HA   ARG  43           HA       ARG  43  -2.660   8.910   5.456
  284    HB2  ARG  43           HB2      ARG  43  -2.538  10.192   8.187
  285    HB3  ARG  43           HB1      ARG  43  -1.385   9.045   7.523
  286    HG2  ARG  43           HG2      ARG  43  -1.090  10.820   5.651
  287    HG3  ARG  43           HG1      ARG  43  -1.803  11.918   6.837
  288    HD2  ARG  43           HD2      ARG  43  -0.078  11.175   8.464
  289    HD3  ARG  43           HD1      ARG  43   0.669  10.230   7.179
  290    HE   ARG  43           HE       ARG  43   0.568  13.158   7.353
  291   HH11  ARG  43          HH11      ARG  43   1.713  10.269   5.705
  292   HH12  ARG  43          HH12      ARG  43   3.011  11.113   4.907
  293   HH21  ARG  43          HH21      ARG  43   2.264  14.239   6.298
  294   HH22  ARG  43          HH22      ARG  43   3.317  13.361   5.234
  295    H    THR  44           HN       THR  44  -4.596   7.598   5.246
  296    HA   THR  44           HA       THR  44  -5.456   6.416   7.795
  297    HB   THR  44           HB       THR  44  -7.422   5.566   6.477
  298    HG1  THR  44           HG1      THR  44  -6.328   5.852   4.393
  299   HG21  THR  44          HG21      THR  44  -7.608   7.575   7.860
  300   HG22  THR  44          HG22      THR  44  -8.584   7.727   6.399
  301   HG23  THR  44          HG23      THR  44  -7.034   8.562   6.516
  302    HA   PRO  45           HA       PRO  45  -3.016   2.999   5.893
  303    HB2  PRO  45           HB2      PRO  45  -2.455   2.268   8.664
  304    HB3  PRO  45           HB1      PRO  45  -1.321   2.692   7.376
  305    HG2  PRO  45           HG2      PRO  45  -1.768   4.296   9.515
  306    HG3  PRO  45           HG1      PRO  45  -1.348   4.930   7.912
  307    HD2  PRO  45           HD2      PRO  45  -4.037   4.747   9.236
  308    HD3  PRO  45           HD1      PRO  45  -3.342   6.079   8.280
  309    H    TRP  46           HN       TRP  46  -5.641   3.296   7.977
  310    HA   TRP  46           HA       TRP  46  -6.224   0.425   8.002
  311    HB2  TRP  46           HB2      TRP  46  -8.201   1.328   9.479
  312    HB3  TRP  46           HB1      TRP  46  -6.581   1.227  10.166
  313    HD1  TRP  46           HD1      TRP  46  -9.061   3.830   8.765
  314    HE1  TRP  46           HE1      TRP  46  -8.422   6.144   9.696
  315    HE3  TRP  46           HE3      TRP  46  -4.720   2.573  11.173
  316    HZ2  TRP  46           HZ2      TRP  46  -6.359   7.280  11.240
  317    HZ3  TRP  46           HZ3      TRP  46  -3.477   4.340  12.352
  318    HH2  TRP  46           HH2      TRP  46  -4.278   6.640  12.381
  319    H    ASN  47           HN       ASN  47  -6.336   1.958   5.588
  320    HA   ASN  47           HA       ASN  47  -9.186   1.623   4.931
  321    HB2  ASN  47           HB2      ASN  47  -8.711   4.044   5.051
  322    HB3  ASN  47           HB1      ASN  47  -7.367   3.841   3.934
  323   HD21  ASN  47          HD21      ASN  47 -10.548   2.319   3.751
  324   HD22  ASN  47          HD22      ASN  47 -11.015   3.061   2.258
  325    H    CYS  48           HN       CYS  48  -8.943  -0.336   3.862
  326    HA   CYS  48           HA       CYS  48  -6.711  -0.597   1.994
  327    HB2  CYS  48           HB2      CYS  48  -7.198  -2.433   3.633
  328    HB3  CYS  48           HB1      CYS  48  -8.751  -2.671   2.844
  329    H    ILE  49           HN       ILE  49  -6.994  -0.213  -0.075
  330    HA   ILE  49           HA       ILE  49  -9.620   0.332  -1.104
  331    HB   ILE  49           HB       ILE  49  -8.271   0.670  -3.296
  332   HG12  ILE  49          HG12      ILE  49  -6.030   0.713  -1.267
  333   HG13  ILE  49          HG11      ILE  49  -6.240  -0.512  -2.515
  334   HG21  ILE  49          HG21      ILE  49  -7.585   2.922  -2.544
  335   HG22  ILE  49          HG22      ILE  49  -7.886   2.428  -0.878
  336   HG23  ILE  49          HG23      ILE  49  -9.218   2.493  -2.032
  337   HD11  ILE  49          HD11      ILE  49  -5.699   2.415  -2.947
  338   HD12  ILE  49          HD12      ILE  49  -5.950   1.225  -4.223
  339   HD13  ILE  49          HD13      ILE  49  -4.552   1.093  -3.156
  340    H    PHE  50           HN       PHE  50  -7.488  -2.390  -1.145
  341    HA   PHE  50           HA       PHE  50  -8.651  -3.498  -3.560
  342    HB2  PHE  50           HB2      PHE  50  -6.492  -4.466  -1.694
  343    HB3  PHE  50           HB1      PHE  50  -7.201  -5.531  -2.912
  344    HD1  PHE  50           HD2      PHE  50  -5.324  -2.401  -2.407
  345    HD2  PHE  50           HD1      PHE  50  -6.655  -5.317  -5.201
  346    HE1  PHE  50           HE2      PHE  50  -3.865  -1.416  -4.117
  347    HE2  PHE  50           HE1      PHE  50  -5.198  -4.341  -6.924
  348    HZ   PHE  50           HZ       PHE  50  -3.800  -2.384  -6.385
  349    H    CYS  51           HN       CYS  51  -8.848  -3.939  -0.092
  350    HA   CYS  51           HA       CYS  51 -10.435  -6.270  -0.135
  351    HB2  CYS  51           HB2      CYS  51  -9.806  -4.223   1.939
  352    HB3  CYS  51           HB1      CYS  51 -11.176  -5.292   2.216
  353    H    ARG  52           HN       ARG  52 -11.260  -3.059  -1.005
  354    HA   ARG  52           HA       ARG  52 -14.060  -3.542  -0.291
  355    HB2  ARG  52           HB2      ARG  52 -12.651  -0.944  -0.940
  356    HB3  ARG  52           HB1      ARG  52 -14.377  -1.098  -0.639
  357    HG2  ARG  52           HG2      ARG  52 -13.880  -1.931   1.629
  358    HG3  ARG  52           HG1      ARG  52 -12.161  -1.684   1.313
  359    HD2  ARG  52           HD2      ARG  52 -12.519   0.695   1.048
  360    HD3  ARG  52           HD1      ARG  52 -14.261   0.483   1.238
  361    HE   ARG  52           HE       ARG  52 -12.883  -0.572   3.471
  362   HH11  ARG  52          HH11      ARG  52 -13.768   2.491   2.034
  363   HH12  ARG  52          HH12      ARG  52 -13.860   3.317   3.555
  364   HH21  ARG  52          HH21      ARG  52 -12.991   0.512   5.466
  365   HH22  ARG  52          HH22      ARG  52 -13.415   2.193   5.508
  366    H    MET  53           HN       MET  53 -12.055  -4.071  -2.731
  367    HA   MET  53           HA       MET  53 -14.145  -3.580  -4.746
  368    HB2  MET  53           HB2      MET  53 -11.151  -3.478  -5.133
  369    HB3  MET  53           HB1      MET  53 -12.324  -3.423  -6.440
  370    HG2  MET  53           HG2      MET  53 -13.237  -1.352  -5.549
  371    HG3  MET  53           HG1      MET  53 -12.084  -1.414  -4.218
  372    HE1  MET  53           HE1      MET  53 -11.496  -2.316  -8.029
  373    HE2  MET  53           HE2      MET  53 -10.937  -0.760  -8.643
  374    HE3  MET  53           HE3      MET  53 -12.592  -0.936  -8.061
  375    H    LYS  54           HN       LYS  54 -12.374  -5.805  -3.056
  376    HA   LYS  54           HA       LYS  54 -11.894  -7.869  -4.868
  377    HB2  LYS  54           HB2      LYS  54 -11.015  -7.859  -2.576
  378    HB3  LYS  54           HB1      LYS  54 -12.643  -8.027  -1.940
  379    HG2  LYS  54           HG2      LYS  54 -11.572 -10.150  -1.831
  380    HG3  LYS  54           HG1      LYS  54 -12.803 -10.226  -3.093
  381    HD2  LYS  54           HD2      LYS  54 -11.086  -9.893  -4.797
  382    HD3  LYS  54           HD1      LYS  54  -9.851  -9.793  -3.541
  383    HE2  LYS  54           HE2      LYS  54 -10.436 -12.088  -2.838
  384    HE3  LYS  54           HE1      LYS  54 -11.589 -12.175  -4.166
  385    HZ1  LYS  54           HZ1      LYS  54  -8.658 -11.801  -4.446
  386    HZ2  LYS  54           HZ2      LYS  54  -9.765 -11.876  -5.721
  387    HZ3  LYS  54           HZ3      LYS  54  -9.509 -13.231  -4.747
  388    H    GLU  55           HN       GLU  55 -14.603  -7.762  -2.549
  389    HA   GLU  55           HA       GLU  55 -16.429  -8.619  -4.630
  390    HB2  GLU  55           HB2      GLU  55 -17.298 -10.460  -3.152
  391    HB3  GLU  55           HB1      GLU  55 -15.722 -10.751  -3.867
  392    HG2  GLU  55           HG2      GLU  55 -14.632 -10.209  -1.787
  393    HG3  GLU  55           HG1      GLU  55 -16.178  -9.781  -1.057
  394    H    SER  56           HN       SER  56 -16.776  -6.268  -3.948
  395    HA   SER  56           HA       SER  56 -18.985  -6.252  -2.052
  396    HB2  SER  56           HB2      SER  56 -16.807  -5.592  -0.876
  397    HB3  SER  56           HB1      SER  56 -16.833  -4.141  -1.875
  398    HG   SER  56           HG       SER  56 -19.010  -3.801  -0.985
  Start of MODEL   15
    1    H1   GLY   1           HT1      GLY   1  10.997  -7.626  14.745
    2    H2   GLY   1           HT2      GLY   1   9.950  -8.069  13.496
    3    H3   GLY   1           HT3      GLY   1   9.405  -7.053  14.733
    4    HA2  GLY   1           HA1      GLY   1   9.824  -5.761  12.764
    5    HA3  GLY   1           HA2      GLY   1  10.958  -5.336  14.037
    6    H    ALA   2           HN       ALA   2  10.788  -5.713  10.873
    7    HA   ALA   2           HA       ALA   2  12.257  -6.035   9.179
    8    HB1  ALA   2           HB1      ALA   2  13.527  -4.343  10.388
    9    HB2  ALA   2           HB2      ALA   2  14.608  -5.506   9.620
   10    HB3  ALA   2           HB3      ALA   2  14.302  -5.598  11.353
   11    H    MET   3           HN       MET   3  11.255  -8.393  10.071
   12    HA   MET   3           HA       MET   3  13.513 -10.178   9.527
   13    HB2  MET   3           HB2      MET   3  11.491 -10.594  11.739
   14    HB3  MET   3           HB1      MET   3  12.529 -11.869  11.120
   15    HG2  MET   3           HG2      MET   3  14.501 -10.511  11.762
   16    HG3  MET   3           HG1      MET   3  13.409  -9.337  12.492
   17    HE1  MET   3           HE1      MET   3  13.134 -13.292  12.475
   18    HE2  MET   3           HE2      MET   3  13.991 -13.668  13.967
   19    HE3  MET   3           HE3      MET   3  14.857 -12.944  12.612
   20    H    GLY   4           HN       GLY   4  11.663  -9.168   7.739
   21    HA2  GLY   4           HA2      GLY   4  10.380 -11.658   6.888
   22    HA3  GLY   4           HA1      GLY   4   9.366 -10.229   7.044
   23    H    MET   5           HN       MET   5   8.869  -9.891   4.918
   24    HA   MET   5           HA       MET   5  11.148  -9.254   3.166
   25    HB2  MET   5           HB2      MET   5   8.506 -10.512   2.406
   26    HB3  MET   5           HB1      MET   5   9.671  -9.898   1.242
   27    HG2  MET   5           HG2      MET   5  11.331 -11.506   2.115
   28    HG3  MET   5           HG1      MET   5  10.095 -12.158   3.186
   29    HE1  MET   5           HE1      MET   5   7.852 -13.329   2.291
   30    HE2  MET   5           HE2      MET   5   7.507 -13.597   0.584
   31    HE3  MET   5           HE3      MET   5   7.506 -11.959   1.235
   32    H    ARG   6           HN       ARG   6  10.856  -7.115   4.162
   33    HA   ARG   6           HA       ARG   6   8.597  -5.643   2.998
   34    HB2  ARG   6           HB2      ARG   6  10.542  -4.765   5.145
   35    HB3  ARG   6           HB1      ARG   6   9.193  -3.817   4.539
   36    HG2  ARG   6           HG2      ARG   6   7.665  -5.621   5.352
   37    HG3  ARG   6           HG1      ARG   6   9.064  -6.376   6.118
   38    HD2  ARG   6           HD2      ARG   6   7.918  -5.046   7.760
   39    HD3  ARG   6           HD1      ARG   6   9.448  -4.261   7.367
   40    HE   ARG   6           HE       ARG   6   7.195  -3.312   5.836
   41   HH11  ARG   6          HH11      ARG   6   9.059  -2.899   8.778
   42   HH12  ARG   6          HH12      ARG   6   8.573  -1.249   8.997
   43   HH21  ARG   6          HH21      ARG   6   6.547  -1.152   6.142
   44   HH22  ARG   6          HH22      ARG   6   7.155  -0.251   7.495
   45    H    ASN   7           HN       ASN   7   9.605  -5.814   0.905
   46    HA   ASN   7           HA       ASN   7  12.152  -4.494   0.511
   47    HB2  ASN   7           HB2      ASN   7  11.429  -6.531  -0.813
   48    HB3  ASN   7           HB1      ASN   7  10.272  -5.488  -1.635
   49   HD21  ASN   7          HD21      ASN   7  12.539  -6.958  -2.755
   50   HD22  ASN   7          HD22      ASN   7  13.551  -5.775  -3.507
   51    H    LEU   8           HN       LEU   8  11.170  -2.535   1.506
   52    HA   LEU   8           HA       LEU   8   9.664  -0.952  -0.425
   53    HB2  LEU   8           HB2      LEU   8   9.474   0.711   1.420
   54    HB3  LEU   8           HB1      LEU   8   8.749  -0.842   1.774
   55    HG   LEU   8           HG       LEU   8  11.021  -1.326   2.980
   56   HD11  LEU   8          HD11      LEU   8  10.965   1.686   3.060
   57   HD12  LEU   8          HD12      LEU   8  12.156   0.704   2.208
   58   HD13  LEU   8          HD13      LEU   8  12.049   0.633   3.967
   59   HD21  LEU   8          HD21      LEU   8   8.896   0.507   4.070
   60   HD22  LEU   8          HD22      LEU   8  10.081  -0.354   5.047
   61   HD23  LEU   8          HD23      LEU   8   8.895  -1.256   4.105
   62    H    ASP   9           HN       ASP   9  12.599  -1.802  -0.297
   63    HA   ASP   9           HA       ASP   9  14.117   0.615  -0.158
   64    HB2  ASP   9           HB2      ASP   9  15.073  -1.670   0.216
   65    HB3  ASP   9           HB1      ASP   9  14.862  -1.994  -1.499
   66    H    GLU  10           HN       GLU  10  12.515  -1.226  -2.648
   67    HA   GLU  10           HA       GLU  10  13.348   0.652  -4.718
   68    HB2  GLU  10           HB2      GLU  10  11.776  -1.919  -4.790
   69    HB3  GLU  10           HB1      GLU  10  11.917  -0.862  -6.188
   70    HG2  GLU  10           HG2      GLU  10  14.199  -2.163  -4.726
   71    HG3  GLU  10           HG1      GLU  10  13.522  -2.688  -6.269
   72    H    CYS  11           HN       CYS  11  11.246   0.824  -2.361
   73    HA   CYS  11           HA       CYS  11   9.026   1.889  -3.957
   74    HB2  CYS  11           HB2      CYS  11   8.561   0.156  -2.193
   75    HB3  CYS  11           HB1      CYS  11   9.112   1.308  -0.992
   76    H    GLU  12           HN       GLU  12   9.867   3.855  -4.510
   77    HA   GLU  12           HA       GLU  12  11.350   5.537  -2.823
   78    HB2  GLU  12           HB2      GLU  12  11.330   5.679  -5.291
   79    HB3  GLU  12           HB1      GLU  12   9.673   6.264  -5.226
   80    HG2  GLU  12           HG2      GLU  12  10.441   8.225  -3.963
   81    HG3  GLU  12           HG1      GLU  12  12.100   7.648  -4.114
   82    H    VAL  13           HN       VAL  13   7.929   5.113  -3.297
   83    HA   VAL  13           HA       VAL  13   7.187   7.547  -2.058
   84    HB   VAL  13           HB       VAL  13   5.621   6.550  -3.547
   85   HG11  VAL  13          HG11      VAL  13   6.268   4.235  -3.347
   86   HG12  VAL  13          HG12      VAL  13   4.533   4.410  -3.099
   87   HG13  VAL  13          HG13      VAL  13   5.599   4.167  -1.717
   88   HG21  VAL  13          HG21      VAL  13   3.619   6.617  -2.252
   89   HG22  VAL  13          HG22      VAL  13   4.755   7.765  -1.543
   90   HG23  VAL  13          HG23      VAL  13   4.495   6.195  -0.783
   91    H    CYS  14           HN       CYS  14   7.665   4.237  -0.859
   92    HA   CYS  14           HA       CYS  14   6.970   4.762   1.831
   93    HB2  CYS  14           HB2      CYS  14   8.549   2.705   0.425
   94    HB3  CYS  14           HB1      CYS  14   8.986   2.964   2.107
   95    H    ARG  15           HN       ARG  15   9.797   5.376  -0.064
   96    HA   ARG  15           HA       ARG  15  11.581   6.073   2.017
   97    HB2  ARG  15           HB2      ARG  15  12.203   5.487  -0.318
   98    HB3  ARG  15           HB1      ARG  15  11.515   7.009  -0.853
   99    HG2  ARG  15           HG2      ARG  15  13.178   8.221   0.437
  100    HG3  ARG  15           HG1      ARG  15  13.868   6.692   0.990
  101    HD2  ARG  15           HD2      ARG  15  13.732   7.722  -1.838
  102    HD3  ARG  15           HD1      ARG  15  15.180   7.486  -0.860
  103    HE   ARG  15           HE       ARG  15  14.163   5.009  -0.924
  104   HH11  ARG  15          HH11      ARG  15  14.764   7.327  -3.470
  105   HH12  ARG  15          HH12      ARG  15  14.962   6.117  -4.697
  106   HH21  ARG  15          HH21      ARG  15  14.429   3.408  -2.532
  107   HH22  ARG  15          HH22      ARG  15  14.761   3.890  -4.169
  108    H    ASP  16           HN       ASP  16   9.349   7.908   0.008
  109    HA   ASP  16           HA       ASP  16   9.841  10.404   1.314
  110    HB2  ASP  16           HB2      ASP  16   7.743   9.438  -0.610
  111    HB3  ASP  16           HB1      ASP  16   7.629  11.029   0.133
  112    H    GLY  17           HN       GLY  17   8.547   7.748   2.596
  113    HA2  GLY  17           HA2      GLY  17   7.424   7.474   4.601
  114    HA3  GLY  17           HA1      GLY  17   7.234   9.221   4.685
  115    H    GLY  18           HN       GLY  18   6.197   7.478   1.883
  116    HA2  GLY  18           HA2      GLY  18   3.563   8.435   1.963
  117    HA3  GLY  18           HA1      GLY  18   4.133   7.108   0.967
  118    H    GLU  19           HN       GLU  19   1.593   7.332   2.209
  119    HA   GLU  19           HA       GLU  19   1.689   5.509   4.491
  120    HB2  GLU  19           HB2      GLU  19  -0.537   7.189   3.331
  121    HB3  GLU  19           HB1      GLU  19  -0.722   6.137   4.729
  122    HG2  GLU  19           HG2      GLU  19   0.972   7.463   5.927
  123    HG3  GLU  19           HG1      GLU  19   1.119   8.518   4.523
  124    H    LEU  20           HN       LEU  20   0.226   3.716   4.596
  125    HA   LEU  20           HA       LEU  20  -0.269   2.506   1.965
  126    HB2  LEU  20           HB2      LEU  20   0.375   1.363   4.657
  127    HB3  LEU  20           HB1      LEU  20  -0.466   0.388   3.471
  128    HG   LEU  20           HG       LEU  20   2.193   1.693   2.907
  129   HD11  LEU  20          HD11      LEU  20   2.424   0.185   4.820
  130   HD12  LEU  20          HD12      LEU  20   3.203  -0.477   3.382
  131   HD13  LEU  20          HD13      LEU  20   1.636  -1.100   3.902
  132   HD21  LEU  20          HD21      LEU  20   0.931   1.042   0.935
  133   HD22  LEU  20          HD22      LEU  20   0.673  -0.568   1.605
  134   HD23  LEU  20          HD23      LEU  20   2.297  -0.050   1.163
  135    H    PHE  21           HN       PHE  21  -2.295   2.070   1.363
  136    HA   PHE  21           HA       PHE  21  -4.407   2.341   3.399
  137    HB2  PHE  21           HB2      PHE  21  -4.588   2.776   0.402
  138    HB3  PHE  21           HB1      PHE  21  -5.913   2.989   1.551
  139    HD1  PHE  21           HD1      PHE  21  -5.583   4.729   3.408
  140    HD2  PHE  21           HD2      PHE  21  -3.145   4.532  -0.081
  141    HE1  PHE  21           HE1      PHE  21  -4.853   7.040   3.791
  142    HE2  PHE  21           HE2      PHE  21  -2.414   6.846   0.299
  143    HZ   PHE  21           HZ       PHE  21  -3.267   8.102   2.240
  144    H    CYS  22           HN       CYS  22  -2.940  -0.005   3.032
  145    HA   CYS  22           HA       CYS  22  -5.040  -1.825   2.103
  146    HB2  CYS  22           HB2      CYS  22  -2.096  -1.907   1.472
  147    HB3  CYS  22           HB1      CYS  22  -3.092  -3.359   1.400
  148    H    CYS  23           HN       CYS  23  -5.077  -3.844   3.154
  149    HA   CYS  23           HA       CYS  23  -4.144  -3.811   5.876
  150    HB2  CYS  23           HB2      CYS  23  -5.356  -5.863   6.152
  151    HB3  CYS  23           HB1      CYS  23  -6.344  -4.854   5.098
  152    H    ASP  24           HN       ASP  24  -2.915  -5.851   6.674
  153    HA   ASP  24           HA       ASP  24  -0.375  -5.741   5.564
  154    HB2  ASP  24           HB2      ASP  24  -1.626  -7.837   7.333
  155    HB3  ASP  24           HB1      ASP  24   0.069  -7.881   6.860
  156    H    THR  25           HN       THR  25  -2.930  -8.116   4.967
  157    HA   THR  25           HA       THR  25  -1.407  -9.939   3.497
  158    HB   THR  25           HB       THR  25  -4.336  -9.364   3.077
  159    HG1  THR  25           HG1      THR  25  -3.084 -10.980   5.073
  160   HG21  THR  25          HG21      THR  25  -3.306 -10.953   1.506
  161   HG22  THR  25          HG22      THR  25  -4.460 -11.750   2.574
  162   HG23  THR  25          HG23      THR  25  -2.731 -11.915   2.868
  163    H    CYS  26           HN       CYS  26  -3.515  -7.292   2.310
  164    HA   CYS  26           HA       CYS  26  -2.876  -7.815  -0.419
  165    HB2  CYS  26           HB2      CYS  26  -4.071  -5.323   0.800
  166    HB3  CYS  26           HB1      CYS  26  -4.035  -5.701  -0.913
  167    H    SER  27           HN       SER  27  -1.533  -5.680   2.037
  168    HA   SER  27           HA       SER  27  -0.095  -4.001   0.267
  169    HB2  SER  27           HB2      SER  27  -0.590  -3.386   2.613
  170    HB3  SER  27           HB1      SER  27   0.496  -4.658   3.163
  171    HG   SER  27           HG       SER  27   1.180  -2.362   1.638
  172    H    ARG  28           HN       ARG  28   0.597  -7.088   1.776
  173    HA   ARG  28           HA       ARG  28   3.360  -7.073   1.039
  174    HB2  ARG  28           HB2      ARG  28   1.526  -9.246   2.044
  175    HB3  ARG  28           HB1      ARG  28   3.231  -9.512   1.699
  176    HG2  ARG  28           HG2      ARG  28   3.876  -7.935   3.394
  177    HG3  ARG  28           HG1      ARG  28   2.197  -7.469   3.660
  178    HD2  ARG  28           HD2      ARG  28   1.703  -9.751   4.423
  179    HD3  ARG  28           HD1      ARG  28   3.395 -10.187   4.189
  180    HE   ARG  28           HE       ARG  28   3.777  -8.264   5.869
  181   HH11  ARG  28          HH11      ARG  28   1.077 -10.496   5.920
  182   HH12  ARG  28          HH12      ARG  28   0.851 -10.380   7.636
  183   HH21  ARG  28          HH21      ARG  28   3.491  -8.124   8.131
  184   HH22  ARG  28          HH22      ARG  28   2.229  -9.041   8.894
  185    H    VAL  29           HN       VAL  29   0.438  -7.869  -0.596
  186    HA   VAL  29           HA       VAL  29   1.862  -9.441  -2.596
  187    HB   VAL  29           HB       VAL  29  -1.082  -8.775  -2.469
  188   HG11  VAL  29          HG11      VAL  29  -0.325  -9.319  -4.725
  189   HG12  VAL  29          HG12      VAL  29  -1.335 -10.610  -4.075
  190   HG13  VAL  29          HG13      VAL  29   0.417 -10.803  -4.127
  191   HG21  VAL  29          HG21      VAL  29   0.401 -11.243  -1.586
  192   HG22  VAL  29          HG22      VAL  29  -1.352 -11.106  -1.702
  193   HG23  VAL  29          HG23      VAL  29  -0.464 -10.106  -0.554
  194    H    PHE  30           HN       PHE  30   0.110  -6.372  -2.301
  195    HA   PHE  30           HA       PHE  30   1.157  -5.624  -4.958
  196    HB2  PHE  30           HB2      PHE  30  -1.488  -4.721  -3.783
  197    HB3  PHE  30           HB1      PHE  30  -0.858  -4.315  -5.375
  198    HD1  PHE  30           HD1      PHE  30  -0.392  -6.382  -6.946
  199    HD2  PHE  30           HD2      PHE  30  -2.993  -6.426  -3.572
  200    HE1  PHE  30           HE1      PHE  30  -1.577  -8.317  -7.886
  201    HE2  PHE  30           HE2      PHE  30  -4.174  -8.369  -4.505
  202    HZ   PHE  30           HZ       PHE  30  -3.470  -9.318  -6.667
  203    H    HIS  31           HN       HIS  31   2.770  -5.070  -2.972
  204    HA   HIS  31           HA       HIS  31   2.278  -2.992  -1.227
  205    HB2  HIS  31           HB2      HIS  31   4.253  -4.464  -1.142
  206    HB3  HIS  31           HB1      HIS  31   4.906  -3.659  -2.563
  207    HD1  HIS  31           HD1      HIS  31   3.832  -2.647   0.973
  208    HD2  HIS  31           HD2      HIS  31   6.628  -1.704  -1.950
  209    HE1  HIS  31           HE1      HIS  31   5.363  -0.901   1.990
  210    H    GLU  32           HN       GLU  32   3.586  -2.757  -4.519
  211    HA   GLU  32           HA       GLU  32   4.185   0.011  -4.389
  212    HB2  GLU  32           HB2      GLU  32   3.618  -1.742  -6.787
  213    HB3  GLU  32           HB1      GLU  32   4.312  -0.130  -6.859
  214    HG2  GLU  32           HG2      GLU  32   6.318  -0.831  -5.869
  215    HG3  GLU  32           HG1      GLU  32   5.616  -2.358  -5.334
  216    H    ASP  33           HN       ASP  33   1.485  -1.796  -5.744
  217    HA   ASP  33           HA       ASP  33   0.072   0.434  -6.753
  218    HB2  ASP  33           HB2      ASP  33  -0.859  -2.363  -6.073
  219    HB3  ASP  33           HB1      ASP  33  -1.831  -1.178  -6.937
  220    H    CYS  34           HN       CYS  34   0.291  -1.018  -3.638
  221    HA   CYS  34           HA       CYS  34  -2.149   0.093  -2.617
  222    HB2  CYS  34           HB2      CYS  34   0.165  -1.398  -1.434
  223    HB3  CYS  34           HB1      CYS  34  -0.978  -0.574  -0.373
  224    H    HIS  35           HN       HIS  35   0.744   1.504  -3.408
  225    HA   HIS  35           HA       HIS  35   0.369   3.666  -1.439
  226    HB2  HIS  35           HB2      HIS  35   2.659   3.074  -3.321
  227    HB3  HIS  35           HB1      HIS  35   2.550   4.523  -2.329
  228    HD1  HIS  35           HD1      HIS  35   2.962   4.215   0.249
  229    HD2  HIS  35           HD2      HIS  35   3.355   0.767  -2.025
  230    HE1  HIS  35           HE1      HIS  35   4.214   2.555   1.687
  231    H    ILE  36           HN       ILE  36   0.759   2.985  -4.873
  232    HA   ILE  36           HA       ILE  36  -0.668   5.451  -5.510
  233    HB   ILE  36           HB       ILE  36   0.968   5.536  -7.576
  234   HG12  ILE  36          HG12      ILE  36   3.354   5.091  -6.607
  235   HG13  ILE  36          HG11      ILE  36   2.522   3.992  -5.519
  236   HG21  ILE  36          HG21      ILE  36   2.417   7.122  -6.306
  237   HG22  ILE  36          HG22      ILE  36   1.603   6.596  -4.831
  238   HG23  ILE  36          HG23      ILE  36   0.687   7.388  -6.111
  239   HD11  ILE  36          HD11      ILE  36   1.668   2.751  -7.452
  240   HD12  ILE  36          HD12      ILE  36   3.430   2.800  -7.409
  241   HD13  ILE  36          HD13      ILE  36   2.544   3.843  -8.523
  242    HA   PRO  37           HA       PRO  37  -1.622   6.421  -7.071
  243    HB2  PRO  37           HB2      PRO  37  -4.205   6.566  -7.832
  244    HB3  PRO  37           HB1      PRO  37  -2.889   6.471  -9.022
  245    HG2  PRO  37           HG2      PRO  37  -4.684   4.288  -7.986
  246    HG3  PRO  37           HG1      PRO  37  -4.194   4.628  -9.659
  247    HD2  PRO  37           HD2      PRO  37  -3.011   2.707  -8.134
  248    HD3  PRO  37           HD1      PRO  37  -2.144   3.603  -9.401
  249    HA   PRO  38           HA       PRO  38  -3.421   5.858  -3.037
  250    HB2  PRO  38           HB2      PRO  38  -3.414   8.438  -2.235
  251    HB3  PRO  38           HB1      PRO  38  -1.940   7.467  -2.328
  252    HG2  PRO  38           HG2      PRO  38  -2.994   9.507  -4.245
  253    HG3  PRO  38           HG1      PRO  38  -1.324   9.225  -3.717
  254    HD2  PRO  38           HD2      PRO  38  -2.335   8.329  -6.107
  255    HD3  PRO  38           HD1      PRO  38  -1.000   7.538  -5.243
  256    H    VAL  39           HN       VAL  39  -5.432   5.956  -2.133
  257    HA   VAL  39           HA       VAL  39  -7.585   6.949  -3.746
  258    HB   VAL  39           HB       VAL  39  -7.850   4.839  -2.577
  259   HG11  VAL  39          HG11      VAL  39  -8.186   4.824  -0.096
  260   HG12  VAL  39          HG12      VAL  39  -7.504   6.448  -0.063
  261   HG13  VAL  39          HG13      VAL  39  -6.530   5.092  -0.627
  262   HG21  VAL  39          HG21      VAL  39  -9.846   6.163  -3.054
  263   HG22  VAL  39          HG22      VAL  39  -9.722   6.918  -1.467
  264   HG23  VAL  39          HG23      VAL  39 -10.042   5.191  -1.596
  265    H    GLU  40           HN       GLU  40  -6.959   9.188  -3.736
  266    HA   GLU  40           HA       GLU  40  -6.775  10.598  -1.240
  267    HB2  GLU  40           HB2      GLU  40  -6.774  11.644  -4.072
  268    HB3  GLU  40           HB1      GLU  40  -6.406  12.596  -2.641
  269    HG2  GLU  40           HG2      GLU  40  -4.510  11.052  -2.176
  270    HG3  GLU  40           HG1      GLU  40  -4.844  10.264  -3.718
  271    H    ALA  41           HN       ALA  41  -9.339   9.760  -3.260
  272    HA   ALA  41           HA       ALA  41 -11.052  11.974  -2.753
  273    HB1  ALA  41           HB1      ALA  41 -12.861  10.501  -3.502
  274    HB2  ALA  41           HB2      ALA  41 -11.755   9.127  -3.461
  275    HB3  ALA  41           HB3      ALA  41 -11.483  10.446  -4.599
  276    H    GLU  42           HN       GLU  42 -10.181   9.117  -1.027
  277    HA   GLU  42           HA       GLU  42 -11.331  10.106   1.384
  278    HB2  GLU  42           HB2      GLU  42 -12.635   7.939   1.790
  279    HB3  GLU  42           HB1      GLU  42 -13.357   9.133   0.723
  280    HG2  GLU  42           HG2      GLU  42 -12.578   7.855  -1.216
  281    HG3  GLU  42           HG1      GLU  42 -11.892   6.648  -0.131
  282    H    ARG  43           HN       ARG  43  -9.065  10.052   1.807
  283    HA   ARG  43           HA       ARG  43  -7.587   7.617   1.722
  284    HB2  ARG  43           HB2      ARG  43  -6.945  10.158   3.224
  285    HB3  ARG  43           HB1      ARG  43  -5.830   8.840   2.901
  286    HG2  ARG  43           HG2      ARG  43  -6.349   9.323   0.415
  287    HG3  ARG  43           HG1      ARG  43  -6.950  10.870   1.017
  288    HD2  ARG  43           HD2      ARG  43  -4.182   9.741   1.386
  289    HD3  ARG  43           HD1      ARG  43  -4.636  11.094   0.355
  290    HE   ARG  43           HE       ARG  43  -5.300  12.233   2.497
  291   HH11  ARG  43          HH11      ARG  43  -2.784   9.798   2.374
  292   HH12  ARG  43          HH12      ARG  43  -1.994  10.343   3.825
  293   HH21  ARG  43          HH21      ARG  43  -4.222  13.018   4.352
  294   HH22  ARG  43          HH22      ARG  43  -2.797  12.209   4.924
  295    H    THR  44           HN       THR  44  -8.099   5.981   2.978
  296    HA   THR  44           HA       THR  44  -8.506   6.498   5.842
  297    HB   THR  44           HB       THR  44 -10.014   4.514   5.876
  298    HG1  THR  44           HG1      THR  44  -9.162   3.670   3.819
  299   HG21  THR  44          HG21      THR  44 -10.958   6.777   5.755
  300   HG22  THR  44          HG22      THR  44 -11.951   5.625   4.860
  301   HG23  THR  44          HG23      THR  44 -10.871   6.721   3.993
  302    HA   PRO  45           HA       PRO  45  -4.820   3.811   5.502
  303    HB2  PRO  45           HB2      PRO  45  -4.394   4.680   8.281
  304    HB3  PRO  45           HB1      PRO  45  -3.326   4.829   6.881
  305    HG2  PRO  45           HG2      PRO  45  -4.565   6.966   7.957
  306    HG3  PRO  45           HG1      PRO  45  -4.248   6.834   6.217
  307    HD2  PRO  45           HD2      PRO  45  -6.805   6.371   7.720
  308    HD3  PRO  45           HD1      PRO  45  -6.547   7.170   6.150
  309    H    TRP  46           HN       TRP  46  -7.340   3.950   7.901
  310    HA   TRP  46           HA       TRP  46  -6.605   1.395   9.062
  311    HB2  TRP  46           HB2      TRP  46  -8.723   1.802  10.438
  312    HB3  TRP  46           HB1      TRP  46  -7.405   2.950  10.663
  313    HD1  TRP  46           HD1      TRP  46 -10.911   2.689   9.116
  314    HE1  TRP  46           HE1      TRP  46 -11.822   5.062   8.739
  315    HE3  TRP  46           HE3      TRP  46  -6.719   5.371  10.301
  316    HZ2  TRP  46           HZ2      TRP  46 -10.895   7.713   8.919
  317    HZ3  TRP  46           HZ3      TRP  46  -6.820   7.829  10.169
  318    HH2  TRP  46           HH2      TRP  46  -8.862   8.971   9.491
  319    H    ASN  47           HN       ASN  47  -7.979   2.139   6.260
  320    HA   ASN  47           HA       ASN  47  -9.738  -0.220   6.314
  321    HB2  ASN  47           HB2      ASN  47 -10.212   2.377   4.828
  322    HB3  ASN  47           HB1      ASN  47 -11.117   0.901   4.537
  323   HD21  ASN  47          HD21      ASN  47 -11.236   0.115   7.323
  324   HD22  ASN  47          HD22      ASN  47 -12.357   1.194   8.085
  325    H    CYS  48           HN       CYS  48  -9.397  -1.667   4.667
  326    HA   CYS  48           HA       CYS  48  -7.139  -1.079   2.927
  327    HB2  CYS  48           HB2      CYS  48  -7.303  -3.260   4.156
  328    HB3  CYS  48           HB1      CYS  48  -8.727  -3.650   3.197
  329    H    ILE  49           HN       ILE  49  -7.439  -0.279   0.944
  330    HA   ILE  49           HA       ILE  49 -10.074  -0.304  -0.233
  331    HB   ILE  49           HB       ILE  49  -9.000   0.926  -2.138
  332   HG12  ILE  49          HG12      ILE  49  -6.586   1.031  -0.327
  333   HG13  ILE  49          HG11      ILE  49  -6.697   0.011  -1.758
  334   HG21  ILE  49          HG21      ILE  49  -8.652   2.091   0.620
  335   HG22  ILE  49          HG22      ILE  49 -10.127   2.108  -0.346
  336   HG23  ILE  49          HG23      ILE  49  -8.711   3.012  -0.882
  337   HD11  ILE  49          HD11      ILE  49  -6.932   1.994  -3.153
  338   HD12  ILE  49          HD12      ILE  49  -5.449   2.054  -2.200
  339   HD13  ILE  49          HD13      ILE  49  -6.847   3.018  -1.722
  340    H    PHE  50           HN       PHE  50  -7.159  -2.125  -0.524
  341    HA   PHE  50           HA       PHE  50  -7.777  -3.129  -3.134
  342    HB2  PHE  50           HB2      PHE  50  -5.528  -3.413  -1.297
  343    HB3  PHE  50           HB1      PHE  50  -5.949  -4.924  -2.112
  344    HD1  PHE  50           HD2      PHE  50  -5.038  -1.387  -2.668
  345    HD2  PHE  50           HD1      PHE  50  -5.478  -5.247  -4.406
  346    HE1  PHE  50           HE2      PHE  50  -3.867  -0.611  -4.684
  347    HE2  PHE  50           HE1      PHE  50  -4.303  -4.479  -6.420
  348    HZ   PHE  50           HZ       PHE  50  -3.622  -2.149  -6.630
  349    H    CYS  51           HN       CYS  51  -8.412  -4.153   0.154
  350    HA   CYS  51           HA       CYS  51  -9.348  -6.739  -0.442
  351    HB2  CYS  51           HB2      CYS  51  -9.875  -4.793   1.757
  352    HB3  CYS  51           HB1      CYS  51 -11.004  -6.127   1.560
  353    H    ARG  52           HN       ARG  52 -10.881  -3.576  -0.748
  354    HA   ARG  52           HA       ARG  52 -13.410  -4.722  -1.530
  355    HB2  ARG  52           HB2      ARG  52 -12.456  -1.854  -1.629
  356    HB3  ARG  52           HB1      ARG  52 -14.105  -2.386  -1.909
  357    HG2  ARG  52           HG2      ARG  52 -14.245  -3.183   0.396
  358    HG3  ARG  52           HG1      ARG  52 -12.583  -2.657   0.678
  359    HD2  ARG  52           HD2      ARG  52 -14.142  -1.005   1.527
  360    HD3  ARG  52           HD1      ARG  52 -13.244  -0.350   0.159
  361    HE   ARG  52           HE       ARG  52 -15.899  -1.499  -0.314
  362   HH11  ARG  52          HH11      ARG  52 -13.823   1.327  -0.169
  363   HH12  ARG  52          HH12      ARG  52 -14.950   2.347  -1.001
  364   HH21  ARG  52          HH21      ARG  52 -17.373  -0.149  -1.400
  365   HH22  ARG  52          HH22      ARG  52 -16.967   1.515  -1.687
  366    H    MET  53           HN       MET  53 -10.502  -3.843  -3.052
  367    HA   MET  53           HA       MET  53 -11.704  -3.405  -5.665
  368    HB2  MET  53           HB2      MET  53  -9.797  -2.023  -5.002
  369    HB3  MET  53           HB1      MET  53  -8.809  -3.460  -4.795
  370    HG2  MET  53           HG2      MET  53  -8.942  -3.919  -7.174
  371    HG3  MET  53           HG1      MET  53  -9.990  -2.519  -7.398
  372    HE1  MET  53           HE1      MET  53  -6.631  -1.385  -9.078
  373    HE2  MET  53           HE2      MET  53  -8.368  -1.593  -9.298
  374    HE3  MET  53           HE3      MET  53  -7.332  -3.004  -9.083
  375    H    LYS  54           HN       LYS  54  -9.736  -5.798  -4.006
  376    HA   LYS  54           HA       LYS  54  -9.328  -7.483  -6.257
  377    HB2  LYS  54           HB2      LYS  54  -7.946  -7.281  -4.113
  378    HB3  LYS  54           HB1      LYS  54  -9.164  -8.293  -3.357
  379    HG2  LYS  54           HG2      LYS  54  -8.645 -10.116  -4.843
  380    HG3  LYS  54           HG1      LYS  54  -7.531  -9.094  -5.757
  381    HD2  LYS  54           HD2      LYS  54  -6.141  -8.832  -3.751
  382    HD3  LYS  54           HD1      LYS  54  -7.245  -9.873  -2.854
  383    HE2  LYS  54           HE2      LYS  54  -5.685 -10.701  -5.298
  384    HE3  LYS  54           HE1      LYS  54  -5.219 -11.049  -3.635
  385    HZ1  LYS  54           HZ1      LYS  54  -7.293 -12.285  -3.374
  386    HZ2  LYS  54           HZ2      LYS  54  -6.338 -12.929  -4.615
  387    HZ3  LYS  54           HZ3      LYS  54  -7.684 -11.984  -4.992
  388    H    GLU  55           HN       GLU  55 -12.174  -6.781  -5.142
  389    HA   GLU  55           HA       GLU  55 -13.359  -9.392  -4.810
  390    HB2  GLU  55           HB2      GLU  55 -14.675  -6.727  -5.380
  391    HB3  GLU  55           HB1      GLU  55 -15.492  -8.193  -4.868
  392    HG2  GLU  55           HG2      GLU  55 -13.378  -6.894  -3.191
  393    HG3  GLU  55           HG1      GLU  55 -15.067  -6.397  -3.119
  394    H    SER  56           HN       SER  56 -12.294 -10.181  -6.821
  395    HA   SER  56           HA       SER  56 -13.236  -9.111  -9.324
  396    HB2  SER  56           HB2      SER  56 -11.878 -11.221 -10.139
  397    HB3  SER  56           HB1      SER  56 -11.040  -9.795  -9.528
  398    HG   SER  56           HG       SER  56 -11.565 -12.240  -8.195
  Start of MODEL   16
    1    H1   GLY   1           HT1      GLY   1  10.217 -10.671   2.661
    2    H2   GLY   1           HT2      GLY   1   9.511 -11.321   1.266
    3    H3   GLY   1           HT3      GLY   1  10.312  -9.834   1.191
    4    HA2  GLY   1           HA1      GLY   1  11.683 -11.567   0.243
    5    HA3  GLY   1           HA2      GLY   1  12.414 -10.900   1.697
    6    H    ALA   2           HN       ALA   2  13.617 -12.929   1.745
    7    HA   ALA   2           HA       ALA   2  12.136 -15.349   2.350
    8    HB1  ALA   2           HB1      ALA   2  14.333 -16.415   2.475
    9    HB2  ALA   2           HB2      ALA   2  15.110 -14.838   2.342
   10    HB3  ALA   2           HB3      ALA   2  14.170 -15.472   0.992
   11    H    MET   3           HN       MET   3  13.681 -12.786   4.022
   12    HA   MET   3           HA       MET   3  12.959 -14.017   6.578
   13    HB2  MET   3           HB2      MET   3  15.384 -14.418   6.216
   14    HB3  MET   3           HB1      MET   3  15.628 -12.685   6.050
   15    HG2  MET   3           HG2      MET   3  16.269 -13.421   8.262
   16    HG3  MET   3           HG1      MET   3  14.869 -12.357   8.354
   17    HE1  MET   3           HE1      MET   3  15.889 -14.294  10.718
   18    HE2  MET   3           HE2      MET   3  14.340 -14.887  11.317
   19    HE3  MET   3           HE3      MET   3  14.521 -13.192  10.866
   20    H    GLY   4           HN       GLY   4  11.173 -12.518   6.169
   21    HA2  GLY   4           HA2      GLY   4  10.425 -10.533   7.405
   22    HA3  GLY   4           HA1      GLY   4  11.905  -9.745   6.870
   23    H    MET   5           HN       MET   5  10.094  -8.167   6.206
   24    HA   MET   5           HA       MET   5   9.615  -8.656   3.368
   25    HB2  MET   5           HB2      MET   5   7.539  -9.270   4.614
   26    HB3  MET   5           HB1      MET   5   7.459  -7.618   5.215
   27    HG2  MET   5           HG2      MET   5   5.967  -7.968   3.321
   28    HG3  MET   5           HG1      MET   5   7.215  -6.780   2.952
   29    HE1  MET   5           HE1      MET   5   6.581  -7.032   0.369
   30    HE2  MET   5           HE2      MET   5   5.384  -8.272   0.738
   31    HE3  MET   5           HE3      MET   5   6.605  -8.567  -0.499
   32    H    ARG   6           HN       ARG   6  11.462  -7.219   3.350
   33    HA   ARG   6           HA       ARG   6  10.853  -4.426   3.988
   34    HB2  ARG   6           HB2      ARG   6  13.458  -5.702   3.136
   35    HB3  ARG   6           HB1      ARG   6  13.245  -4.018   3.593
   36    HG2  ARG   6           HG2      ARG   6  12.536  -4.780   5.848
   37    HG3  ARG   6           HG1      ARG   6  12.933  -6.431   5.365
   38    HD2  ARG   6           HD2      ARG   6  15.248  -5.697   4.902
   39    HD3  ARG   6           HD1      ARG   6  14.828  -4.088   5.490
   40    HE   ARG   6           HE       ARG   6  14.533  -6.433   7.234
   41   HH11  ARG   6          HH11      ARG   6  15.964  -3.307   6.551
   42   HH12  ARG   6          HH12      ARG   6  16.678  -3.155   8.125
   43   HH21  ARG   6          HH21      ARG   6  15.470  -6.226   9.300
   44   HH22  ARG   6          HH22      ARG   6  16.395  -4.813   9.687
   45    H    ASN   7           HN       ASN   7   9.317  -5.162   1.998
   46    HA   ASN   7           HA       ASN   7  10.556  -4.797  -0.577
   47    HB2  ASN   7           HB2      ASN   7   8.491  -6.202  -0.191
   48    HB3  ASN   7           HB1      ASN   7   7.598  -4.706   0.067
   49   HD21  ASN   7          HD21      ASN   7  10.171  -5.242  -2.274
   50   HD22  ASN   7          HD22      ASN   7   9.191  -5.008  -3.675
   51    H    LEU   8           HN       LEU   8   9.406  -2.802   1.885
   52    HA   LEU   8           HA       LEU   8   8.561  -0.591   0.297
   53    HB2  LEU   8           HB2      LEU   8   8.557   0.639   2.456
   54    HB3  LEU   8           HB1      LEU   8   7.604  -0.829   2.456
   55    HG   LEU   8           HG       LEU   8   9.751  -1.895   3.517
   56   HD11  LEU   8          HD11      LEU   8  11.018  -0.370   4.900
   57   HD12  LEU   8          HD12      LEU   8  10.099   0.998   4.278
   58   HD13  LEU   8          HD13      LEU   8  11.161   0.090   3.204
   59   HD21  LEU   8          HD21      LEU   8   7.579  -1.720   4.608
   60   HD22  LEU   8          HD22      LEU   8   7.926  -0.048   5.052
   61   HD23  LEU   8          HD23      LEU   8   8.885  -1.361   5.737
   62    H    ASP   9           HN       ASP   9  11.571  -1.826   0.834
   63    HA   ASP   9           HA       ASP   9  13.024   0.627   1.158
   64    HB2  ASP   9           HB2      ASP   9  13.807  -2.215   0.649
   65    HB3  ASP   9           HB1      ASP   9  14.984  -0.932   0.396
   66    H    GLU  10           HN       GLU  10  12.187  -1.474  -1.513
   67    HA   GLU  10           HA       GLU  10  13.548   0.095  -3.486
   68    HB2  GLU  10           HB2      GLU  10  11.333  -1.933  -3.856
   69    HB3  GLU  10           HB1      GLU  10  12.411  -1.333  -5.105
   70    HG2  GLU  10           HG2      GLU  10  14.293  -2.402  -4.092
   71    HG3  GLU  10           HG1      GLU  10  13.340  -2.859  -2.684
   72    H    CYS  11           HN       CYS  11  10.516   0.159  -1.936
   73    HA   CYS  11           HA       CYS  11   9.079   1.748  -3.800
   74    HB2  CYS  11           HB2      CYS  11   8.091   0.194  -2.166
   75    HB3  CYS  11           HB1      CYS  11   8.667   1.210  -0.863
   76    H    GLU  12           HN       GLU  12   9.898   3.716  -4.260
   77    HA   GLU  12           HA       GLU  12  11.428   5.273  -2.462
   78    HB2  GLU  12           HB2      GLU  12  10.108   5.986  -5.074
   79    HB3  GLU  12           HB1      GLU  12  11.131   7.092  -4.170
   80    HG2  GLU  12           HG2      GLU  12  11.969   4.441  -5.320
   81    HG3  GLU  12           HG1      GLU  12  12.372   6.033  -5.956
   82    H    VAL  13           HN       VAL  13   7.993   5.139  -3.134
   83    HA   VAL  13           HA       VAL  13   7.436   7.672  -1.966
   84    HB   VAL  13           HB       VAL  13   5.857   6.676  -3.538
   85   HG11  VAL  13          HG11      VAL  13   4.418   4.837  -2.911
   86   HG12  VAL  13          HG12      VAL  13   5.295   4.650  -1.394
   87   HG13  VAL  13          HG13      VAL  13   6.108   4.337  -2.928
   88   HG21  VAL  13          HG21      VAL  13   4.689   7.037  -0.789
   89   HG22  VAL  13          HG22      VAL  13   3.794   7.121  -2.306
   90   HG23  VAL  13          HG23      VAL  13   5.038   8.320  -1.947
   91    H    CYS  14           HN       CYS  14   7.598   4.365  -0.736
   92    HA   CYS  14           HA       CYS  14   6.779   4.992   1.905
   93    HB2  CYS  14           HB2      CYS  14   8.220   2.736   0.621
   94    HB3  CYS  14           HB1      CYS  14   8.410   2.923   2.358
   95    H    ARG  15           HN       ARG  15   9.767   5.214   0.166
   96    HA   ARG  15           HA       ARG  15  11.462   5.854   2.343
   97    HB2  ARG  15           HB2      ARG  15  12.301   5.137   0.141
   98    HB3  ARG  15           HB1      ARG  15  11.688   6.620  -0.572
   99    HG2  ARG  15           HG2      ARG  15  13.236   7.911   0.831
  100    HG3  ARG  15           HG1      ARG  15  13.879   6.402   1.481
  101    HD2  ARG  15           HD2      ARG  15  14.565   5.724  -0.763
  102    HD3  ARG  15           HD1      ARG  15  13.903   7.218  -1.422
  103    HE   ARG  15           HE       ARG  15  15.913   7.577   0.625
  104   HH11  ARG  15          HH11      ARG  15  15.276   7.251  -2.810
  105   HH12  ARG  15          HH12      ARG  15  16.755   8.033  -3.280
  106   HH21  ARG  15          HH21      ARG  15  17.860   8.587   0.006
  107   HH22  ARG  15          HH22      ARG  15  18.232   8.784  -1.678
  108    H    ASP  16           HN       ASP  16   9.429   7.764   0.199
  109    HA   ASP  16           HA       ASP  16  10.087  10.284   1.370
  110    HB2  ASP  16           HB2      ASP  16   7.775   9.399  -0.357
  111    HB3  ASP  16           HB1      ASP  16   7.942  11.049   0.232
  112    H    GLY  17           HN       GLY  17   8.606   7.739   2.757
  113    HA2  GLY  17           HA2      GLY  17   7.546   7.638   4.821
  114    HA3  GLY  17           HA1      GLY  17   7.424   9.392   4.808
  115    H    GLY  18           HN       GLY  18   6.272   7.519   2.122
  116    HA2  GLY  18           HA2      GLY  18   3.642   8.532   2.281
  117    HA3  GLY  18           HA1      GLY  18   4.174   7.211   1.254
  118    H    GLU  19           HN       GLU  19   1.677   7.257   2.397
  119    HA   GLU  19           HA       GLU  19   1.790   5.429   4.677
  120    HB2  GLU  19           HB2      GLU  19  -0.362   7.173   3.531
  121    HB3  GLU  19           HB1      GLU  19  -0.760   5.856   4.627
  122    HG2  GLU  19           HG2      GLU  19   1.040   8.199   5.215
  123    HG3  GLU  19           HG1      GLU  19  -0.596   7.956   5.827
  124    H    LEU  20           HN       LEU  20   0.240   3.660   4.722
  125    HA   LEU  20           HA       LEU  20  -0.136   2.438   2.079
  126    HB2  LEU  20           HB2      LEU  20   0.419   1.288   4.787
  127    HB3  LEU  20           HB1      LEU  20  -0.387   0.318   3.571
  128    HG   LEU  20           HG       LEU  20   2.293   1.623   3.109
  129   HD11  LEU  20          HD11      LEU  20   1.692  -1.186   4.036
  130   HD12  LEU  20          HD12      LEU  20   2.453   0.081   5.000
  131   HD13  LEU  20          HD13      LEU  20   3.278  -0.562   3.581
  132   HD21  LEU  20          HD21      LEU  20   0.810  -0.607   1.709
  133   HD22  LEU  20          HD22      LEU  20   2.445  -0.076   1.327
  134   HD23  LEU  20          HD23      LEU  20   1.087   1.019   1.083
  135    H    PHE  21           HN       PHE  21  -2.143   1.804   1.479
  136    HA   PHE  21           HA       PHE  21  -4.327   2.440   3.354
  137    HB2  PHE  21           HB2      PHE  21  -4.446   2.432   0.320
  138    HB3  PHE  21           HB1      PHE  21  -5.664   3.062   1.429
  139    HD1  PHE  21           HD1      PHE  21  -5.087   5.091   2.833
  140    HD2  PHE  21           HD2      PHE  21  -2.658   3.789  -0.418
  141    HE1  PHE  21           HE1      PHE  21  -3.992   7.284   2.771
  142    HE2  PHE  21           HE2      PHE  21  -1.566   5.990  -0.481
  143    HZ   PHE  21           HZ       PHE  21  -2.230   7.739   1.115
  144    H    CYS  22           HN       CYS  22  -2.904  -0.032   3.225
  145    HA   CYS  22           HA       CYS  22  -5.062  -1.843   2.419
  146    HB2  CYS  22           HB2      CYS  22  -2.132  -2.185   1.733
  147    HB3  CYS  22           HB1      CYS  22  -3.419  -3.322   1.336
  148    H    CYS  23           HN       CYS  23  -4.909  -3.974   3.401
  149    HA   CYS  23           HA       CYS  23  -3.981  -4.057   6.089
  150    HB2  CYS  23           HB2      CYS  23  -4.552  -6.489   4.388
  151    HB3  CYS  23           HB1      CYS  23  -4.756  -6.308   6.130
  152    H    ASP  24           HN       ASP  24  -2.329  -5.701   6.872
  153    HA   ASP  24           HA       ASP  24   0.158  -5.405   5.718
  154    HB2  ASP  24           HB2      ASP  24  -0.854  -7.704   7.400
  155    HB3  ASP  24           HB1      ASP  24   0.839  -7.468   6.983
  156    H    THR  25           HN       THR  25  -1.991  -8.220   5.385
  157    HA   THR  25           HA       THR  25  -0.423  -9.658   3.592
  158    HB   THR  25           HB       THR  25  -3.436  -9.660   3.764
  159    HG1  THR  25           HG1      THR  25  -1.419 -10.684   5.422
  160   HG21  THR  25          HG21      THR  25  -2.577 -10.867   1.824
  161   HG22  THR  25          HG22      THR  25  -3.222 -11.992   3.019
  162   HG23  THR  25          HG23      THR  25  -1.480 -11.776   2.862
  163    H    CYS  26           HN       CYS  26  -3.064  -7.362   2.956
  164    HA   CYS  26           HA       CYS  26  -3.016  -7.659   0.149
  165    HB2  CYS  26           HB2      CYS  26  -3.997  -5.298   1.770
  166    HB3  CYS  26           HB1      CYS  26  -4.435  -5.669   0.106
  167    H    SER  27           HN       SER  27  -1.281  -5.580   2.367
  168    HA   SER  27           HA       SER  27  -0.122  -3.864   0.412
  169    HB2  SER  27           HB2      SER  27  -0.253  -3.184   2.753
  170    HB3  SER  27           HB1      SER  27   0.764  -4.538   3.229
  171    HG   SER  27           HG       SER  27   2.167  -2.904   3.076
  172    H    ARG  28           HN       ARG  28   0.783  -6.969   1.789
  173    HA   ARG  28           HA       ARG  28   3.457  -6.876   0.764
  174    HB2  ARG  28           HB2      ARG  28   1.805  -9.130   1.900
  175    HB3  ARG  28           HB1      ARG  28   3.473  -9.321   1.381
  176    HG2  ARG  28           HG2      ARG  28   4.141  -7.597   3.021
  177    HG3  ARG  28           HG1      ARG  28   2.472  -7.522   3.581
  178    HD2  ARG  28           HD2      ARG  28   3.799  -8.944   5.035
  179    HD3  ARG  28           HD1      ARG  28   2.575  -9.891   4.193
  180    HE   ARG  28           HE       ARG  28   4.723 -10.191   2.599
  181   HH11  ARG  28          HH11      ARG  28   4.279 -10.557   6.045
  182   HH12  ARG  28          HH12      ARG  28   5.523 -11.753   6.210
  183   HH21  ARG  28          HH21      ARG  28   6.364 -11.774   2.808
  184   HH22  ARG  28          HH22      ARG  28   6.697 -12.458   4.369
  185    H    VAL  29           HN       VAL  29   0.380  -7.830  -0.460
  186    HA   VAL  29           HA       VAL  29   1.556  -9.356  -2.631
  187    HB   VAL  29           HB       VAL  29  -1.344  -8.696  -2.100
  188   HG11  VAL  29          HG11      VAL  29  -0.112 -10.674  -4.013
  189   HG12  VAL  29          HG12      VAL  29  -0.906  -9.166  -4.461
  190   HG13  VAL  29          HG13      VAL  29  -1.836 -10.464  -3.713
  191   HG21  VAL  29          HG21      VAL  29  -0.423 -10.087  -0.345
  192   HG22  VAL  29          HG22      VAL  29   0.245 -11.195  -1.543
  193   HG23  VAL  29          HG23      VAL  29  -1.503 -11.038  -1.365
  194    H    PHE  30           HN       PHE  30  -0.167  -6.293  -2.140
  195    HA   PHE  30           HA       PHE  30   0.557  -5.553  -4.905
  196    HB2  PHE  30           HB2      PHE  30  -1.909  -4.628  -3.415
  197    HB3  PHE  30           HB1      PHE  30  -1.488  -4.247  -5.079
  198    HD1  PHE  30           HD1      PHE  30  -1.266  -6.279  -6.678
  199    HD2  PHE  30           HD2      PHE  30  -3.358  -6.379  -2.968
  200    HE1  PHE  30           HE1      PHE  30  -2.536  -8.234  -7.452
  201    HE2  PHE  30           HE2      PHE  30  -4.631  -8.335  -3.738
  202    HZ   PHE  30           HZ       PHE  30  -4.307  -9.221  -5.945
  203    H    HIS  31           HN       HIS  31   2.397  -4.929  -3.051
  204    HA   HIS  31           HA       HIS  31   1.950  -2.635  -1.503
  205    HB2  HIS  31           HB2      HIS  31   3.879  -4.229  -1.278
  206    HB3  HIS  31           HB1      HIS  31   4.595  -3.476  -2.699
  207    HD1  HIS  31           HD1      HIS  31   3.393  -2.382   0.765
  208    HD2  HIS  31           HD2      HIS  31   6.248  -1.444  -2.105
  209    HE1  HIS  31           HE1      HIS  31   4.904  -0.620   1.805
  210    H    GLU  32           HN       GLU  32   3.290  -2.954  -4.765
  211    HA   GLU  32           HA       GLU  32   4.010  -0.234  -5.057
  212    HB2  GLU  32           HB2      GLU  32   3.518  -2.445  -7.042
  213    HB3  GLU  32           HB1      GLU  32   4.005  -0.831  -7.534
  214    HG2  GLU  32           HG2      GLU  32   5.598  -2.416  -5.560
  215    HG3  GLU  32           HG1      GLU  32   5.818  -2.607  -7.298
  216    H    ASP  33           HN       ASP  33   1.152  -2.074  -5.888
  217    HA   ASP  33           HA       ASP  33  -0.087   0.099  -7.303
  218    HB2  ASP  33           HB2      ASP  33  -0.447  -2.399  -7.738
  219    HB3  ASP  33           HB1      ASP  33  -1.480  -2.383  -6.314
  220    H    CYS  34           HN       CYS  34   0.041  -1.012  -4.051
  221    HA   CYS  34           HA       CYS  34  -2.455   0.018  -3.169
  222    HB2  CYS  34           HB2      CYS  34  -1.279  -1.728  -1.920
  223    HB3  CYS  34           HB1      CYS  34   0.052  -0.623  -1.587
  224    H    HIS  35           HN       HIS  35   0.693   1.416  -3.601
  225    HA   HIS  35           HA       HIS  35   0.076   3.791  -2.080
  226    HB2  HIS  35           HB2      HIS  35   2.366   3.121  -3.936
  227    HB3  HIS  35           HB1      HIS  35   2.235   4.639  -3.047
  228    HD1  HIS  35           HD1      HIS  35   2.502   4.467  -0.392
  229    HD2  HIS  35           HD2      HIS  35   3.150   0.930  -2.483
  230    HE1  HIS  35           HE1      HIS  35   3.633   2.881   1.219
  231    H    ILE  36           HN       ILE  36  -0.913   2.621  -4.961
  232    HA   ILE  36           HA       ILE  36  -1.186   5.253  -6.239
  233    HB   ILE  36           HB       ILE  36  -1.523   2.477  -7.404
  234   HG12  ILE  36          HG12      ILE  36   0.677   4.531  -7.745
  235   HG13  ILE  36          HG11      ILE  36   0.806   2.994  -6.898
  236   HG21  ILE  36          HG21      ILE  36  -1.556   5.138  -8.819
  237   HG22  ILE  36          HG22      ILE  36  -2.976   4.151  -8.474
  238   HG23  ILE  36          HG23      ILE  36  -1.726   3.549  -9.562
  239   HD11  ILE  36          HD11      ILE  36   0.408   1.819  -9.017
  240   HD12  ILE  36          HD12      ILE  36   1.839   2.846  -9.068
  241   HD13  ILE  36          HD13      ILE  36   0.348   3.374  -9.847
  242    HA   PRO  37           HA       PRO  37  -2.402   6.363  -7.483
  243    HB2  PRO  37           HB2      PRO  37  -4.155   8.383  -7.199
  244    HB3  PRO  37           HB1      PRO  37  -4.458   7.047  -8.327
  245    HG2  PRO  37           HG2      PRO  37  -5.550   7.499  -5.564
  246    HG3  PRO  37           HG1      PRO  37  -6.393   6.938  -7.022
  247    HD2  PRO  37           HD2      PRO  37  -5.498   5.266  -5.039
  248    HD3  PRO  37           HD1      PRO  37  -5.708   4.769  -6.732
  249    HA   PRO  38           HA       PRO  38  -0.265   8.324  -4.118
  250    HB2  PRO  38           HB2      PRO  38   0.597  10.567  -5.491
  251    HB3  PRO  38           HB1      PRO  38   1.421   9.004  -5.490
  252    HG2  PRO  38           HG2      PRO  38  -0.423  10.179  -7.526
  253    HG3  PRO  38           HG1      PRO  38   1.033   9.193  -7.767
  254    HD2  PRO  38           HD2      PRO  38  -1.453   8.161  -8.015
  255    HD3  PRO  38           HD1      PRO  38  -0.100   7.202  -7.367
  256    H    VAL  39           HN       VAL  39  -0.948   9.622  -2.527
  257    HA   VAL  39           HA       VAL  39  -3.472  10.765  -2.628
  258    HB   VAL  39           HB       VAL  39  -2.502  10.053  -0.533
  259   HG11  VAL  39          HG11      VAL  39  -0.802  11.403   0.622
  260   HG12  VAL  39          HG12      VAL  39  -0.614  12.377  -0.835
  261   HG13  VAL  39          HG13      VAL  39  -0.191  10.667  -0.857
  262   HG21  VAL  39          HG21      VAL  39  -3.120  13.002  -0.528
  263   HG22  VAL  39          HG22      VAL  39  -3.166  11.936   0.877
  264   HG23  VAL  39          HG23      VAL  39  -4.296  11.690  -0.454
  265    H    GLU  40           HN       GLU  40  -4.198  12.508  -3.542
  266    HA   GLU  40           HA       GLU  40  -2.392  14.782  -3.960
  267    HB2  GLU  40           HB2      GLU  40  -4.801  13.816  -5.472
  268    HB3  GLU  40           HB1      GLU  40  -4.283  15.491  -5.594
  269    HG2  GLU  40           HG2      GLU  40  -2.551  13.111  -6.215
  270    HG3  GLU  40           HG1      GLU  40  -3.430  14.064  -7.411
  271    H    ALA  41           HN       ALA  41  -5.797  14.058  -3.229
  272    HA   ALA  41           HA       ALA  41  -6.009  16.612  -1.839
  273    HB1  ALA  41           HB1      ALA  41  -8.395  16.158  -1.737
  274    HB2  ALA  41           HB2      ALA  41  -8.134  14.549  -2.410
  275    HB3  ALA  41           HB3      ALA  41  -7.804  15.978  -3.389
  276    H    GLU  42           HN       GLU  42  -7.077  13.292  -1.155
  277    HA   GLU  42           HA       GLU  42  -5.710  13.057   1.296
  278    HB2  GLU  42           HB2      GLU  42  -7.671  13.140   2.816
  279    HB3  GLU  42           HB1      GLU  42  -7.268  14.703   2.118
  280    HG2  GLU  42           HG2      GLU  42  -9.051  14.323   0.423
  281    HG3  GLU  42           HG1      GLU  42  -9.518  12.878   1.320
  282    H    ARG  43           HN       ARG  43  -5.737  10.973   1.996
  283    HA   ARG  43           HA       ARG  43  -7.824   9.168   1.046
  284    HB2  ARG  43           HB2      ARG  43  -4.864   8.716   0.613
  285    HB3  ARG  43           HB1      ARG  43  -6.075   7.451   0.473
  286    HG2  ARG  43           HG2      ARG  43  -7.178   8.894  -1.293
  287    HG3  ARG  43           HG1      ARG  43  -5.708   9.873  -1.266
  288    HD2  ARG  43           HD2      ARG  43  -5.626   8.191  -3.047
  289    HD3  ARG  43           HD1      ARG  43  -4.378   7.905  -1.835
  290    HE   ARG  43           HE       ARG  43  -6.819   6.449  -1.371
  291   HH11  ARG  43          HH11      ARG  43  -3.759   6.391  -3.089
  292   HH12  ARG  43          HH12      ARG  43  -3.668   4.658  -3.106
  293   HH21  ARG  43          HH21      ARG  43  -6.697   4.184  -1.401
  294   HH22  ARG  43          HH22      ARG  43  -5.342   3.405  -2.153
  295    H    THR  44           HN       THR  44  -8.269   7.535   2.486
  296    HA   THR  44           HA       THR  44  -7.134   7.952   5.127
  297    HB   THR  44           HB       THR  44  -9.042   6.494   5.874
  298    HG1  THR  44           HG1      THR  44 -10.486   5.779   4.416
  299   HG21  THR  44          HG21      THR  44  -9.221   8.931   5.919
  300   HG22  THR  44          HG22      THR  44 -10.766   8.207   5.471
  301   HG23  THR  44          HG23      THR  44  -9.741   8.937   4.234
  302    HA   PRO  45           HA       PRO  45  -4.551   4.314   4.571
  303    HB2  PRO  45           HB2      PRO  45  -3.915   4.685   7.416
  304    HB3  PRO  45           HB1      PRO  45  -2.846   4.737   6.011
  305    HG2  PRO  45           HG2      PRO  45  -3.500   6.956   7.394
  306    HG3  PRO  45           HG1      PRO  45  -3.214   6.981   5.644
  307    HD2  PRO  45           HD2      PRO  45  -5.808   7.002   7.147
  308    HD3  PRO  45           HD1      PRO  45  -5.340   7.899   5.683
  309    H    TRP  46           HN       TRP  46  -7.011   4.759   6.972
  310    HA   TRP  46           HA       TRP  46  -6.945   1.960   7.774
  311    HB2  TRP  46           HB2      TRP  46  -8.959   2.744   9.208
  312    HB3  TRP  46           HB1      TRP  46  -7.353   3.318   9.639
  313    HD1  TRP  46           HD1      TRP  46 -10.669   4.534   8.149
  314    HE1  TRP  46           HE1      TRP  46 -10.717   7.105   8.246
  315    HE3  TRP  46           HE3      TRP  46  -5.866   5.377   9.688
  316    HZ2  TRP  46           HZ2      TRP  46  -8.951   9.208   8.896
  317    HZ3  TRP  46           HZ3      TRP  46  -5.126   7.699  10.022
  318    HH2  TRP  46           HH2      TRP  46  -6.636   9.568   9.631
  319    H    ASN  47           HN       ASN  47  -7.556   2.588   5.066
  320    HA   ASN  47           HA       ASN  47 -10.118   1.200   4.879
  321    HB2  ASN  47           HB2      ASN  47 -10.630   3.583   4.495
  322    HB3  ASN  47           HB1      ASN  47  -9.400   3.648   3.242
  323   HD21  ASN  47          HD21      ASN  47  -9.784   2.629   1.265
  324   HD22  ASN  47          HD22      ASN  47 -11.379   2.175   0.765
  325    H    CYS  48           HN       CYS  48  -9.479  -0.678   3.947
  326    HA   CYS  48           HA       CYS  48  -7.180  -0.704   2.192
  327    HB2  CYS  48           HB2      CYS  48  -7.536  -2.562   3.786
  328    HB3  CYS  48           HB1      CYS  48  -9.058  -2.948   2.988
  329    H    ILE  49           HN       ILE  49  -7.301  -0.397   0.101
  330    HA   ILE  49           HA       ILE  49  -9.836  -0.100  -1.176
  331    HB   ILE  49           HB       ILE  49  -8.377   0.265  -3.258
  332   HG12  ILE  49          HG12      ILE  49  -6.218   0.432  -1.151
  333   HG13  ILE  49          HG11      ILE  49  -6.360  -0.876  -2.322
  334   HG21  ILE  49          HG21      ILE  49  -9.419   2.076  -2.028
  335   HG22  ILE  49          HG22      ILE  49  -7.790   2.540  -2.518
  336   HG23  ILE  49          HG23      ILE  49  -8.106   2.063  -0.850
  337   HD11  ILE  49          HD11      ILE  49  -5.974   0.673  -4.134
  338   HD12  ILE  49          HD12      ILE  49  -4.680   0.807  -2.942
  339   HD13  ILE  49          HD13      ILE  49  -5.951   2.026  -3.004
  340    H    PHE  50           HN       PHE  50  -7.401  -2.611  -1.081
  341    HA   PHE  50           HA       PHE  50  -8.373  -3.886  -3.472
  342    HB2  PHE  50           HB2      PHE  50  -6.334  -4.763  -1.424
  343    HB3  PHE  50           HB1      PHE  50  -6.775  -5.728  -2.833
  344    HD1  PHE  50           HD1      PHE  50  -6.306  -4.857  -5.118
  345    HD2  PHE  50           HD2      PHE  50  -4.915  -2.888  -1.612
  346    HE1  PHE  50           HE1      PHE  50  -4.705  -3.578  -6.475
  347    HE2  PHE  50           HE2      PHE  50  -3.319  -1.612  -2.959
  348    HZ   PHE  50           HZ       PHE  50  -3.211  -1.948  -5.395
  349    H    CYS  51           HN       CYS  51  -8.909  -4.224  -0.031
  350    HA   CYS  51           HA       CYS  51 -10.044  -6.803  -0.102
  351    HB2  CYS  51           HB2      CYS  51  -9.998  -4.560   1.830
  352    HB3  CYS  51           HB1      CYS  51 -11.321  -5.706   2.007
  353    H    ARG  52           HN       ARG  52 -11.592  -3.584  -0.235
  354    HA   ARG  52           HA       ARG  52 -14.159  -4.840  -0.590
  355    HB2  ARG  52           HB2      ARG  52 -14.999  -2.479  -0.666
  356    HB3  ARG  52           HB1      ARG  52 -14.163  -2.934   0.810
  357    HG2  ARG  52           HG2      ARG  52 -12.107  -1.848  -0.150
  358    HG3  ARG  52           HG1      ARG  52 -13.143  -1.209  -1.430
  359    HD2  ARG  52           HD2      ARG  52 -12.841   0.418   0.377
  360    HD3  ARG  52           HD1      ARG  52 -14.524  -0.086   0.237
  361    HE   ARG  52           HE       ARG  52 -12.845  -1.461   2.198
  362   HH11  ARG  52          HH11      ARG  52 -15.339   0.918   1.561
  363   HH12  ARG  52          HH12      ARG  52 -15.966   0.878   3.179
  364   HH21  ARG  52          HH21      ARG  52 -13.653  -1.502   4.324
  365   HH22  ARG  52          HH22      ARG  52 -14.995  -0.489   4.758
  366    H    MET  53           HN       MET  53 -11.791  -4.521  -2.699
  367    HA   MET  53           HA       MET  53 -13.666  -4.071  -4.926
  368    HB2  MET  53           HB2      MET  53 -10.664  -3.764  -4.821
  369    HB3  MET  53           HB1      MET  53 -11.585  -3.750  -6.318
  370    HG2  MET  53           HG2      MET  53 -12.752  -1.772  -5.653
  371    HG3  MET  53           HG1      MET  53 -12.032  -1.835  -4.046
  372    HE1  MET  53           HE1      MET  53  -9.634  -0.941  -7.892
  373    HE2  MET  53           HE2      MET  53 -11.367  -1.261  -7.872
  374    HE3  MET  53           HE3      MET  53 -10.229  -2.549  -7.484
  375    H    LYS  54           HN       LYS  54 -11.368  -6.180  -3.446
  376    HA   LYS  54           HA       LYS  54 -12.132  -8.339  -5.288
  377    HB2  LYS  54           HB2      LYS  54  -9.327  -7.812  -4.265
  378    HB3  LYS  54           HB1      LYS  54  -9.813  -9.180  -5.253
  379    HG2  LYS  54           HG2      LYS  54 -10.262  -7.729  -7.125
  380    HG3  LYS  54           HG1      LYS  54  -9.939  -6.300  -6.143
  381    HD2  LYS  54           HD2      LYS  54  -7.624  -7.109  -5.804
  382    HD3  LYS  54           HD1      LYS  54  -7.968  -8.462  -6.881
  383    HE2  LYS  54           HE2      LYS  54  -8.118  -5.546  -7.637
  384    HE3  LYS  54           HE1      LYS  54  -6.778  -6.626  -8.009
  385    HZ1  LYS  54           HZ1      LYS  54  -8.324  -8.001  -9.294
  386    HZ2  LYS  54           HZ2      LYS  54  -8.226  -6.428  -9.899
  387    HZ3  LYS  54           HZ3      LYS  54  -9.569  -6.899  -8.986
  388    H    GLU  55           HN       GLU  55 -13.577  -8.425  -3.238
  389    HA   GLU  55           HA       GLU  55 -12.262  -9.349  -0.843
  390    HB2  GLU  55           HB2      GLU  55 -14.302  -7.883  -0.847
  391    HB3  GLU  55           HB1      GLU  55 -15.223  -9.275  -1.395
  392    HG2  GLU  55           HG2      GLU  55 -14.682 -10.476   0.628
  393    HG3  GLU  55           HG1      GLU  55 -13.653  -9.149   1.168
  394    H    SER  56           HN       SER  56 -11.297 -11.249  -1.363
  395    HA   SER  56           HA       SER  56 -12.921 -13.599  -1.363
  396    HB2  SER  56           HB2      SER  56 -12.909 -12.868  -3.796
  397    HB3  SER  56           HB1      SER  56 -11.169 -13.148  -3.791
  398    HG   SER  56           HG       SER  56 -11.480 -15.252  -3.737
  Start of MODEL   17
    1    H1   GLY   1           HT1      GLY   1  18.250  -7.209   2.303
    2    H2   GLY   1           HT2      GLY   1  17.229  -7.923   3.445
    3    H3   GLY   1           HT3      GLY   1  16.945  -6.339   2.931
    4    HA2  GLY   1           HA1      GLY   1  16.755  -8.755   1.228
    5    HA3  GLY   1           HA2      GLY   1  15.388  -7.880   1.906
    6    H    ALA   2           HN       ALA   2  15.901  -8.349  -0.876
    7    HA   ALA   2           HA       ALA   2  16.112  -5.554  -1.764
    8    HB1  ALA   2           HB1      ALA   2  17.224  -7.947  -3.230
    9    HB2  ALA   2           HB2      ALA   2  18.172  -6.727  -2.380
   10    HB3  ALA   2           HB3      ALA   2  17.236  -6.281  -3.808
   11    H    MET   3           HN       MET   3  15.048  -8.808  -2.732
   12    HA   MET   3           HA       MET   3  12.785  -7.586  -4.163
   13    HB2  MET   3           HB2      MET   3  13.928 -10.381  -4.351
   14    HB3  MET   3           HB1      MET   3  12.537  -9.800  -5.253
   15    HG2  MET   3           HG2      MET   3  13.933  -8.180  -6.403
   16    HG3  MET   3           HG1      MET   3  15.333  -8.704  -5.468
   17    HE1  MET   3           HE1      MET   3  16.406 -11.101  -5.638
   18    HE2  MET   3           HE2      MET   3  15.863 -12.358  -6.749
   19    HE3  MET   3           HE3      MET   3  14.853 -11.897  -5.380
   20    H    GLY   4           HN       GLY   4  13.577  -8.984  -1.284
   21    HA2  GLY   4           HA2      GLY   4  10.830  -9.366  -0.531
   22    HA3  GLY   4           HA1      GLY   4  11.744 -10.869  -0.615
   23    H    MET   5           HN       MET   5  10.956 -10.616   1.770
   24    HA   MET   5           HA       MET   5  11.484 -10.364   3.966
   25    HB2  MET   5           HB2      MET   5  14.264  -9.998   2.836
   26    HB3  MET   5           HB1      MET   5  13.915 -10.136   4.551
   27    HG2  MET   5           HG2      MET   5  12.952 -12.370   4.142
   28    HG3  MET   5           HG1      MET   5  13.401 -12.228   2.447
   29    HE1  MET   5           HE1      MET   5  15.450 -11.035   5.631
   30    HE2  MET   5           HE2      MET   5  16.425 -12.473   5.930
   31    HE3  MET   5           HE3      MET   5  14.675 -12.538   6.132
   32    H    ARG   6           HN       ARG   6  10.191  -8.499   4.043
   33    HA   ARG   6           HA       ARG   6   9.664  -6.327   4.418
   34    HB2  ARG   6           HB2      ARG   6  12.595  -6.069   5.118
   35    HB3  ARG   6           HB1      ARG   6  11.354  -4.875   5.475
   36    HG2  ARG   6           HG2      ARG   6  10.233  -6.460   6.945
   37    HG3  ARG   6           HG1      ARG   6  11.445  -7.684   6.560
   38    HD2  ARG   6           HD2      ARG   6  11.962  -5.036   7.910
   39    HD3  ARG   6           HD1      ARG   6  11.927  -6.609   8.703
   40    HE   ARG   6           HE       ARG   6  13.809  -6.984   6.841
   41   HH11  ARG   6          HH11      ARG   6  13.326  -4.423   9.175
   42   HH12  ARG   6          HH12      ARG   6  15.006  -4.005   9.263
   43   HH21  ARG   6          HH21      ARG   6  16.026  -6.452   6.951
   44   HH22  ARG   6          HH22      ARG   6  16.550  -5.173   8.000
   45    H    ASN   7           HN       ASN   7   9.437  -6.485   2.016
   46    HA   ASN   7           HA       ASN   7  11.521  -5.178   0.471
   47    HB2  ASN   7           HB2      ASN   7  10.493  -7.163  -0.493
   48    HB3  ASN   7           HB1      ASN   7   8.902  -6.425  -0.380
   49   HD21  ASN   7          HD21      ASN   7  11.964  -6.366  -2.081
   50   HD22  ASN   7          HD22      ASN   7  11.398  -5.469  -3.450
   51    H    LEU   8           HN       LEU   8  11.369  -3.097   1.360
   52    HA   LEU   8           HA       LEU   8   9.351  -1.532  -0.071
   53    HB2  LEU   8           HB2      LEU   8   9.442   0.147   1.816
   54    HB3  LEU   8           HB1      LEU   8   8.562  -1.331   2.140
   55    HG   LEU   8           HG       LEU   8  11.421  -1.174   2.982
   56   HD11  LEU   8          HD11      LEU   8   9.110   0.122   4.425
   57   HD12  LEU   8          HD12      LEU   8  10.528   0.936   3.764
   58   HD13  LEU   8          HD13      LEU   8  10.703  -0.173   5.122
   59   HD21  LEU   8          HD21      LEU   8   8.955  -2.402   4.212
   60   HD22  LEU   8          HD22      LEU   8  10.611  -2.590   4.786
   61   HD23  LEU   8          HD23      LEU   8  10.139  -3.254   3.222
   62    H    ASP   9           HN       ASP   9  12.119  -2.399  -0.503
   63    HA   ASP   9           HA       ASP   9  13.787  -0.075  -0.144
   64    HB2  ASP   9           HB2      ASP   9  14.285  -2.719  -1.518
   65    HB3  ASP   9           HB1      ASP   9  15.499  -1.458  -1.325
   66    H    GLU  10           HN       GLU  10  12.108  -1.679  -2.762
   67    HA   GLU  10           HA       GLU  10  13.191   0.147  -4.740
   68    HB2  GLU  10           HB2      GLU  10  11.839  -1.191  -6.333
   69    HB3  GLU  10           HB1      GLU  10  12.950  -2.170  -5.385
   70    HG2  GLU  10           HG2      GLU  10  11.013  -2.661  -3.851
   71    HG3  GLU  10           HG1      GLU  10   9.978  -1.916  -5.065
   72    H    CYS  11           HN       CYS  11  11.075   0.537  -2.451
   73    HA   CYS  11           HA       CYS  11   8.985   1.820  -4.051
   74    HB2  CYS  11           HB2      CYS  11   8.357   0.076  -2.383
   75    HB3  CYS  11           HB1      CYS  11   9.010   1.097  -1.119
   76    H    GLU  12           HN       GLU  12   9.964   3.765  -4.516
   77    HA   GLU  12           HA       GLU  12  11.461   5.286  -2.666
   78    HB2  GLU  12           HB2      GLU  12  10.085   6.071  -5.230
   79    HB3  GLU  12           HB1      GLU  12  11.104   7.161  -4.301
   80    HG2  GLU  12           HG2      GLU  12  11.972   4.571  -5.564
   81    HG3  GLU  12           HG1      GLU  12  12.332   6.193  -6.148
   82    H    VAL  13           HN       VAL  13   8.049   5.034  -3.305
   83    HA   VAL  13           HA       VAL  13   7.372   7.464  -2.010
   84    HB   VAL  13           HB       VAL  13   5.807   6.533  -3.575
   85   HG11  VAL  13          HG11      VAL  13   5.473   4.200  -1.712
   86   HG12  VAL  13          HG12      VAL  13   6.336   4.165  -3.249
   87   HG13  VAL  13          HG13      VAL  13   4.605   4.483  -3.219
   88   HG21  VAL  13          HG21      VAL  13   4.640   6.344  -0.810
   89   HG22  VAL  13          HG22      VAL  13   3.760   6.663  -2.304
   90   HG23  VAL  13          HG23      VAL  13   4.916   7.844  -1.692
   91    H    CYS  14           HN       CYS  14   7.750   4.116  -0.891
   92    HA   CYS  14           HA       CYS  14   6.976   4.544   1.786
   93    HB2  CYS  14           HB2      CYS  14   8.604   2.548   0.357
   94    HB3  CYS  14           HB1      CYS  14   9.038   2.770   2.044
   95    H    ARG  15           HN       ARG  15   9.884   5.223   0.022
   96    HA   ARG  15           HA       ARG  15  11.557   5.891   2.206
   97    HB2  ARG  15           HB2      ARG  15  12.450   5.337   0.014
   98    HB3  ARG  15           HB1      ARG  15  11.632   6.719  -0.697
   99    HG2  ARG  15           HG2      ARG  15  13.040   8.209   0.675
  100    HG3  ARG  15           HG1      ARG  15  13.908   6.790   1.271
  101    HD2  ARG  15           HD2      ARG  15  14.522   6.221  -1.040
  102    HD3  ARG  15           HD1      ARG  15  13.692   7.668  -1.607
  103    HE   ARG  15           HE       ARG  15  15.581   8.422   0.317
  104   HH11  ARG  15          HH11      ARG  15  15.413   7.184  -2.965
  105   HH12  ARG  15          HH12      ARG  15  16.976   7.799  -3.407
  106   HH21  ARG  15          HH21      ARG  15  17.628   9.245  -0.275
  107   HH22  ARG  15          HH22      ARG  15  18.230   8.979  -1.876
  108    H    ASP  16           HN       ASP  16   9.408   7.771   0.136
  109    HA   ASP  16           HA       ASP  16   9.956  10.256   1.427
  110    HB2  ASP  16           HB2      ASP  16   7.932   9.325  -0.562
  111    HB3  ASP  16           HB1      ASP  16   7.656  10.849   0.276
  112    H    GLY  17           HN       GLY  17   8.379   7.602   2.563
  113    HA2  GLY  17           HA2      GLY  17   7.321   7.415   4.637
  114    HA3  GLY  17           HA1      GLY  17   7.137   9.164   4.671
  115    H    GLY  18           HN       GLY  18   6.134   7.290   1.915
  116    HA2  GLY  18           HA2      GLY  18   3.478   8.217   1.979
  117    HA3  GLY  18           HA1      GLY  18   4.068   6.875   1.015
  118    H    GLU  19           HN       GLU  19   1.562   7.230   2.489
  119    HA   GLU  19           HA       GLU  19   1.743   5.240   4.616
  120    HB2  GLU  19           HB2      GLU  19  -0.412   7.145   3.729
  121    HB3  GLU  19           HB1      GLU  19  -0.751   5.839   4.857
  122    HG2  GLU  19           HG2      GLU  19   1.297   8.008   5.281
  123    HG3  GLU  19           HG1      GLU  19  -0.325   7.997   5.970
  124    H    LEU  20           HN       LEU  20   0.404   3.400   4.660
  125    HA   LEU  20           HA       LEU  20  -0.142   2.322   1.993
  126    HB2  LEU  20           HB2      LEU  20   0.389   1.094   4.672
  127    HB3  LEU  20           HB1      LEU  20  -0.411   0.163   3.420
  128    HG   LEU  20           HG       LEU  20   2.269   1.478   2.988
  129   HD11  LEU  20          HD11      LEU  20   1.662  -1.307   3.977
  130   HD12  LEU  20          HD12      LEU  20   2.506  -0.038   4.859
  131   HD13  LEU  20          HD13      LEU  20   3.240  -0.750   3.423
  132   HD21  LEU  20          HD21      LEU  20   0.788  -0.755   1.593
  133   HD22  LEU  20          HD22      LEU  20   2.435  -0.245   1.221
  134   HD23  LEU  20          HD23      LEU  20   1.088   0.865   0.960
  135    H    PHE  21           HN       PHE  21  -2.145   1.734   1.342
  136    HA   PHE  21           HA       PHE  21  -4.336   2.122   3.278
  137    HB2  PHE  21           HB2      PHE  21  -4.285   2.609   0.286
  138    HB3  PHE  21           HB1      PHE  21  -5.738   2.712   1.284
  139    HD1  PHE  21           HD1      PHE  21  -5.905   4.477   3.042
  140    HD2  PHE  21           HD2      PHE  21  -2.689   4.347   0.249
  141    HE1  PHE  21           HE1      PHE  21  -5.388   6.830   3.527
  142    HE2  PHE  21           HE2      PHE  21  -2.170   6.685   0.735
  143    HZ   PHE  21           HZ       PHE  21  -3.454   7.885   2.550
  144    H    CYS  22           HN       CYS  22  -3.012  -0.284   3.101
  145    HA   CYS  22           HA       CYS  22  -5.150  -2.022   2.120
  146    HB2  CYS  22           HB2      CYS  22  -2.228  -2.156   1.419
  147    HB3  CYS  22           HB1      CYS  22  -3.241  -3.592   1.351
  148    H    CYS  23           HN       CYS  23  -5.027  -4.228   3.052
  149    HA   CYS  23           HA       CYS  23  -4.411  -4.305   5.820
  150    HB2  CYS  23           HB2      CYS  23  -4.674  -6.731   4.026
  151    HB3  CYS  23           HB1      CYS  23  -5.022  -6.623   5.749
  152    H    ASP  24           HN       ASP  24  -2.743  -5.756   6.823
  153    HA   ASP  24           HA       ASP  24  -0.179  -5.294   5.909
  154    HB2  ASP  24           HB2      ASP  24  -1.150  -7.601   7.609
  155    HB3  ASP  24           HB1      ASP  24   0.538  -7.142   7.416
  156    H    THR  25           HN       THR  25  -2.123  -8.229   5.448
  157    HA   THR  25           HA       THR  25  -0.316  -9.610   3.814
  158    HB   THR  25           HB       THR  25  -3.334  -9.753   3.714
  159    HG1  THR  25           HG1      THR  25  -3.027 -10.403   5.718
  160   HG21  THR  25          HG21      THR  25  -1.226 -11.784   2.961
  161   HG22  THR  25          HG22      THR  25  -2.238 -10.882   1.834
  162   HG23  THR  25          HG23      THR  25  -2.970 -12.048   2.935
  163    H    CYS  26           HN       CYS  26  -2.981  -7.414   2.935
  164    HA   CYS  26           HA       CYS  26  -2.724  -7.754   0.144
  165    HB2  CYS  26           HB2      CYS  26  -3.914  -5.472   1.735
  166    HB3  CYS  26           HB1      CYS  26  -4.073  -5.648  -0.010
  167    H    SER  27           HN       SER  27  -1.330  -5.424   2.395
  168    HA   SER  27           HA       SER  27  -0.127  -3.749   0.463
  169    HB2  SER  27           HB2      SER  27   0.652  -4.210   3.348
  170    HB3  SER  27           HB1      SER  27   1.197  -2.870   2.341
  171    HG   SER  27           HG       SER  27  -0.721  -2.599   3.820
  172    H    ARG  28           HN       ARG  28   0.841  -6.806   1.796
  173    HA   ARG  28           HA       ARG  28   3.592  -6.495   0.996
  174    HB2  ARG  28           HB2      ARG  28   2.898  -7.874   2.948
  175    HB3  ARG  28           HB1      ARG  28   2.111  -8.990   1.843
  176    HG2  ARG  28           HG2      ARG  28   4.277  -9.472   0.799
  177    HG3  ARG  28           HG1      ARG  28   5.058  -8.374   1.939
  178    HD2  ARG  28           HD2      ARG  28   5.296 -10.667   2.693
  179    HD3  ARG  28           HD1      ARG  28   4.258  -9.766   3.798
  180    HE   ARG  28           HE       ARG  28   3.221 -11.607   1.736
  181   HH11  ARG  28          HH11      ARG  28   3.119 -10.247   4.968
  182   HH12  ARG  28          HH12      ARG  28   1.779 -11.228   5.471
  183   HH21  ARG  28          HH21      ARG  28   1.454 -12.887   2.396
  184   HH22  ARG  28          HH22      ARG  28   0.822 -12.713   4.005
  185    H    VAL  29           HN       VAL  29   0.654  -7.607  -0.405
  186    HA   VAL  29           HA       VAL  29   2.037  -9.036  -2.542
  187    HB   VAL  29           HB       VAL  29  -0.931  -8.692  -2.086
  188   HG11  VAL  29          HG11      VAL  29   0.554 -10.533  -3.961
  189   HG12  VAL  29          HG12      VAL  29  -0.362  -9.103  -4.437
  190   HG13  VAL  29          HG13      VAL  29  -1.193 -10.485  -3.721
  191   HG21  VAL  29          HG21      VAL  29   0.895 -11.012  -1.480
  192   HG22  VAL  29          HG22      VAL  29  -0.862 -11.040  -1.355
  193   HG23  VAL  29          HG23      VAL  29   0.078  -9.984  -0.304
  194    H    PHE  30           HN       PHE  30  -0.167  -6.283  -2.127
  195    HA   PHE  30           HA       PHE  30   0.406  -5.499  -4.911
  196    HB2  PHE  30           HB2      PHE  30  -1.924  -4.603  -3.197
  197    HB3  PHE  30           HB1      PHE  30  -1.700  -4.309  -4.919
  198    HD1  PHE  30           HD1      PHE  30  -1.552  -6.421  -6.417
  199    HD2  PHE  30           HD2      PHE  30  -3.220  -6.396  -2.501
  200    HE1  PHE  30           HE1      PHE  30  -2.803  -8.469  -6.945
  201    HE2  PHE  30           HE2      PHE  30  -4.470  -8.449  -3.021
  202    HZ   PHE  30           HZ       PHE  30  -4.305  -9.473  -5.199
  203    H    HIS  31           HN       HIS  31   2.226  -4.975  -2.883
  204    HA   HIS  31           HA       HIS  31   2.041  -2.723  -1.354
  205    HB2  HIS  31           HB2      HIS  31   3.926  -4.388  -1.452
  206    HB3  HIS  31           HB1      HIS  31   4.516  -3.546  -2.878
  207    HD1  HIS  31           HD1      HIS  31   3.800  -2.774   0.793
  208    HD2  HIS  31           HD2      HIS  31   6.264  -1.586  -2.331
  209    HE1  HIS  31           HE1      HIS  31   5.475  -1.142   1.789
  210    H    GLU  32           HN       GLU  32   3.024  -2.869  -4.750
  211    HA   GLU  32           HA       GLU  32   3.881  -0.193  -4.960
  212    HB2  GLU  32           HB2      GLU  32   2.836  -2.044  -7.112
  213    HB3  GLU  32           HB1      GLU  32   3.737  -0.561  -7.395
  214    HG2  GLU  32           HG2      GLU  32   4.838  -2.882  -5.840
  215    HG3  GLU  32           HG1      GLU  32   5.045  -2.698  -7.579
  216    H    ASP  33           HN       ASP  33   0.802  -1.756  -5.723
  217    HA   ASP  33           HA       ASP  33  -0.371   0.687  -6.716
  218    HB2  ASP  33           HB2      ASP  33  -0.941  -1.662  -7.515
  219    HB3  ASP  33           HB1      ASP  33  -1.826  -1.861  -6.008
  220    H    CYS  34           HN       CYS  34  -0.167  -0.980  -3.697
  221    HA   CYS  34           HA       CYS  34  -2.445   0.216  -2.473
  222    HB2  CYS  34           HB2      CYS  34  -0.058  -1.282  -1.413
  223    HB3  CYS  34           HB1      CYS  34  -1.258  -0.577  -0.330
  224    H    HIS  35           HN       HIS  35   0.449   1.544  -3.409
  225    HA   HIS  35           HA       HIS  35   0.395   3.582  -1.300
  226    HB2  HIS  35           HB2      HIS  35   2.428   2.863  -3.396
  227    HB3  HIS  35           HB1      HIS  35   2.502   4.393  -2.524
  228    HD1  HIS  35           HD1      HIS  35   2.998   4.230   0.082
  229    HD2  HIS  35           HD2      HIS  35   3.257   0.664  -2.036
  230    HE1  HIS  35           HE1      HIS  35   4.253   2.608   1.564
  231    H    ILE  36           HN       ILE  36  -0.177   3.107  -4.717
  232    HA   ILE  36           HA       ILE  36  -0.641   5.994  -5.050
  233    HB   ILE  36           HB       ILE  36   0.680   4.138  -7.037
  234   HG12  ILE  36          HG12      ILE  36   1.880   6.424  -5.460
  235   HG13  ILE  36          HG11      ILE  36   2.090   4.721  -5.069
  236   HG21  ILE  36          HG21      ILE  36  -0.634   5.868  -8.131
  237   HG22  ILE  36          HG22      ILE  36   1.091   6.162  -8.351
  238   HG23  ILE  36          HG23      ILE  36   0.180   7.110  -7.177
  239   HD11  ILE  36          HD11      ILE  36   4.023   5.631  -6.243
  240   HD12  ILE  36          HD12      ILE  36   2.994   6.056  -7.613
  241   HD13  ILE  36          HD13      ILE  36   3.236   4.362  -7.180
  242    HA   PRO  37           HA       PRO  37  -1.612   7.385  -6.064
  243    HB2  PRO  37           HB2      PRO  37  -4.038   8.587  -6.059
  244    HB3  PRO  37           HB1      PRO  37  -3.151   8.237  -7.552
  245    HG2  PRO  37           HG2      PRO  37  -5.437   6.765  -6.314
  246    HG3  PRO  37           HG1      PRO  37  -5.113   7.104  -8.023
  247    HD2  PRO  37           HD2      PRO  37  -4.600   4.694  -6.811
  248    HD3  PRO  37           HD1      PRO  37  -3.745   5.285  -8.248
  249    HA   PRO  38           HA       PRO  38  -2.383   6.982  -1.698
  250    HB2  PRO  38           HB2      PRO  38  -1.401   9.716  -1.376
  251    HB3  PRO  38           HB1      PRO  38  -0.685   8.201  -0.822
  252    HG2  PRO  38           HG2      PRO  38   0.397   9.670  -2.822
  253    HG3  PRO  38           HG1      PRO  38   0.519   7.902  -2.758
  254    HD2  PRO  38           HD2      PRO  38  -1.322   9.618  -4.395
  255    HD3  PRO  38           HD1      PRO  38  -0.455   8.134  -4.852
  256    H    VAL  39           HN       VAL  39  -4.193   7.292  -0.571
  257    HA   VAL  39           HA       VAL  39  -6.065   9.361  -1.261
  258    HB   VAL  39           HB       VAL  39  -6.153   7.440   1.068
  259   HG11  VAL  39          HG11      VAL  39  -7.616   9.326   1.408
  260   HG12  VAL  39          HG12      VAL  39  -8.579   7.898   1.026
  261   HG13  VAL  39          HG13      VAL  39  -8.297   9.129  -0.206
  262   HG21  VAL  39          HG21      VAL  39  -7.389   7.188  -1.671
  263   HG22  VAL  39          HG22      VAL  39  -7.666   6.095  -0.317
  264   HG23  VAL  39          HG23      VAL  39  -6.062   6.219  -1.033
  265    H    GLU  40           HN       GLU  40  -5.141  11.324  -0.792
  266    HA   GLU  40           HA       GLU  40  -3.874  11.734   1.779
  267    HB2  GLU  40           HB2      GLU  40  -4.264  13.600  -0.562
  268    HB3  GLU  40           HB1      GLU  40  -3.396  14.021   0.906
  269    HG2  GLU  40           HG2      GLU  40  -1.760  12.276   0.464
  270    HG3  GLU  40           HG1      GLU  40  -2.647  11.799  -0.983
  271    H    ALA  41           HN       ALA  41  -6.966  12.083   0.468
  272    HA   ALA  41           HA       ALA  41  -7.958  14.228   2.007
  273    HB1  ALA  41           HB1      ALA  41  -9.412  11.776   1.014
  274    HB2  ALA  41           HB2      ALA  41  -9.217  13.296   0.139
  275    HB3  ALA  41           HB3      ALA  41 -10.174  13.246   1.619
  276    H    GLU  42           HN       GLU  42  -8.359  10.744   2.568
  277    HA   GLU  42           HA       GLU  42  -8.080  11.249   5.445
  278    HB2  GLU  42           HB2      GLU  42  -9.932   9.248   4.131
  279    HB3  GLU  42           HB1      GLU  42  -9.673   9.409   5.864
  280    HG2  GLU  42           HG2      GLU  42 -10.530  11.733   5.722
  281    HG3  GLU  42           HG1      GLU  42 -10.902  11.447   4.022
  282    H    ARG  43           HN       ARG  43  -6.014  10.600   5.719
  283    HA   ARG  43           HA       ARG  43  -4.913   8.420   4.193
  284    HB2  ARG  43           HB2      ARG  43  -3.631   9.986   6.432
  285    HB3  ARG  43           HB1      ARG  43  -2.807   8.969   5.259
  286    HG2  ARG  43           HG2      ARG  43  -3.599  10.506   3.468
  287    HG3  ARG  43           HG1      ARG  43  -4.233  11.565   4.729
  288    HD2  ARG  43           HD2      ARG  43  -1.926  11.639   5.701
  289    HD3  ARG  43           HD1      ARG  43  -1.363  10.778   4.269
  290    HE   ARG  43           HE       ARG  43  -2.840  13.207   3.737
  291   HH11  ARG  43          HH11      ARG  43   0.313  11.795   4.292
  292   HH12  ARG  43          HH12      ARG  43   1.170  13.088   3.517
  293   HH21  ARG  43          HH21      ARG  43  -1.707  14.914   2.721
  294   HH22  ARG  43          HH22      ARG  43   0.023  14.855   2.622
  295    H    THR  44           HN       THR  44  -6.735   7.110   5.308
  296    HA   THR  44           HA       THR  44  -6.030   6.175   7.973
  297    HB   THR  44           HB       THR  44  -8.174   4.910   7.815
  298    HG1  THR  44           HG1      THR  44  -7.956   5.027   5.337
  299   HG21  THR  44          HG21      THR  44  -8.137   7.159   8.778
  300   HG22  THR  44          HG22      THR  44  -9.638   6.883   7.896
  301   HG23  THR  44          HG23      THR  44  -8.359   7.859   7.176
  302    HA   PRO  45           HA       PRO  45  -3.866   2.740   5.994
  303    HB2  PRO  45           HB2      PRO  45  -3.342   1.845   8.732
  304    HB3  PRO  45           HB1      PRO  45  -2.199   2.338   7.479
  305    HG2  PRO  45           HG2      PRO  45  -2.681   3.837   9.679
  306    HG3  PRO  45           HG1      PRO  45  -2.254   4.545   8.111
  307    HD2  PRO  45           HD2      PRO  45  -4.938   4.320   9.424
  308    HD3  PRO  45           HD1      PRO  45  -4.249   5.663   8.483
  309    H    TRP  46           HN       TRP  46  -6.396   2.617   8.357
  310    HA   TRP  46           HA       TRP  46  -6.741  -0.262   8.038
  311    HB2  TRP  46           HB2      TRP  46  -8.580   0.047   9.743
  312    HB3  TRP  46           HB1      TRP  46  -6.966   0.468  10.303
  313    HD1  TRP  46           HD1      TRP  46 -10.326   2.071   9.374
  314    HE1  TRP  46           HE1      TRP  46 -10.403   4.443  10.359
  315    HE3  TRP  46           HE3      TRP  46  -5.507   2.409  11.063
  316    HZ2  TRP  46           HZ2      TRP  46  -8.658   6.217  11.683
  317    HZ3  TRP  46           HZ3      TRP  46  -4.797   4.484  12.182
  318    HH2  TRP  46           HH2      TRP  46  -6.338   6.346  12.480
  319    H    ASN  47           HN       ASN  47  -7.173   1.439   5.788
  320    HA   ASN  47           HA       ASN  47  -9.899   0.563   5.183
  321    HB2  ASN  47           HB2      ASN  47  -9.903   3.048   5.622
  322    HB3  ASN  47           HB1      ASN  47  -8.793   3.233   4.266
  323   HD21  ASN  47          HD21      ASN  47 -11.496   4.308   4.613
  324   HD22  ASN  47          HD22      ASN  47 -12.417   3.721   3.271
  325    H    CYS  48           HN       CYS  48  -9.358  -1.082   3.877
  326    HA   CYS  48           HA       CYS  48  -7.001  -0.896   2.203
  327    HB2  CYS  48           HB2      CYS  48  -7.449  -2.930   3.518
  328    HB3  CYS  48           HB1      CYS  48  -8.958  -3.158   2.645
  329    H    ILE  49           HN       ILE  49  -7.059  -0.268   0.180
  330    HA   ILE  49           HA       ILE  49  -9.548   0.185  -1.160
  331    HB   ILE  49           HB       ILE  49  -8.058   0.829  -3.113
  332   HG12  ILE  49          HG12      ILE  49  -5.889   0.550  -1.024
  333   HG13  ILE  49          HG11      ILE  49  -6.087  -0.508  -2.418
  334   HG21  ILE  49          HG21      ILE  49  -7.357   2.943  -2.047
  335   HG22  ILE  49          HG22      ILE  49  -7.723   2.242  -0.471
  336   HG23  ILE  49          HG23      ILE  49  -9.013   2.488  -1.645
  337   HD11  ILE  49          HD11      ILE  49  -4.345   1.124  -2.809
  338   HD12  ILE  49          HD12      ILE  49  -5.474   2.438  -2.483
  339   HD13  ILE  49          HD13      ILE  49  -5.702   1.407  -3.898
  340    H    PHE  50           HN       PHE  50  -7.206  -2.374  -1.133
  341    HA   PHE  50           HA       PHE  50  -8.058  -3.442  -3.670
  342    HB2  PHE  50           HB2      PHE  50  -5.960  -4.123  -1.727
  343    HB3  PHE  50           HB1      PHE  50  -6.684  -5.506  -2.556
  344    HD1  PHE  50           HD2      PHE  50  -4.768  -2.422  -2.963
  345    HD2  PHE  50           HD1      PHE  50  -6.421  -5.814  -4.928
  346    HE1  PHE  50           HE2      PHE  50  -3.370  -1.957  -4.931
  347    HE2  PHE  50           HE1      PHE  50  -5.021  -5.366  -6.886
  348    HZ   PHE  50           HZ       PHE  50  -3.629  -3.370  -6.977
  349    H    CYS  51           HN       CYS  51  -8.777  -4.045  -0.289
  350    HA   CYS  51           HA       CYS  51 -10.312  -6.390  -0.857
  351    HB2  CYS  51           HB2      CYS  51 -10.023  -4.636   1.567
  352    HB3  CYS  51           HB1      CYS  51 -11.316  -5.828   1.494
  353    H    ARG  52           HN       ARG  52 -11.214  -2.995  -0.143
  354    HA   ARG  52           HA       ARG  52 -13.938  -3.363  -0.775
  355    HB2  ARG  52           HB2      ARG  52 -12.265  -0.846  -0.786
  356    HB3  ARG  52           HB1      ARG  52 -14.016  -0.880  -0.935
  357    HG2  ARG  52           HG2      ARG  52 -14.146  -1.951   1.291
  358    HG3  ARG  52           HG1      ARG  52 -12.394  -1.788   1.435
  359    HD2  ARG  52           HD2      ARG  52 -12.589   0.630   1.266
  360    HD3  ARG  52           HD1      ARG  52 -14.335   0.490   1.056
  361    HE   ARG  52           HE       ARG  52 -13.334  -0.711   3.476
  362   HH11  ARG  52          HH11      ARG  52 -14.533   2.225   1.987
  363   HH12  ARG  52          HH12      ARG  52 -15.039   2.931   3.488
  364   HH21  ARG  52          HH21      ARG  52 -13.987   0.228   5.463
  365   HH22  ARG  52          HH22      ARG  52 -14.708   1.806   5.464
  366    H    MET  53           HN       MET  53 -11.257  -3.373  -2.783
  367    HA   MET  53           HA       MET  53 -12.336  -2.182  -5.116
  368    HB2  MET  53           HB2      MET  53  -9.955  -2.579  -4.975
  369    HB3  MET  53           HB1      MET  53 -10.211  -4.307  -4.774
  370    HG2  MET  53           HG2      MET  53  -9.446  -3.773  -7.014
  371    HG3  MET  53           HG1      MET  53 -11.071  -4.457  -7.039
  372    HE1  MET  53           HE1      MET  53 -11.388  -3.656  -9.501
  373    HE2  MET  53           HE2      MET  53  -9.791  -2.912  -9.537
  374    HE3  MET  53           HE3      MET  53 -11.204  -1.989 -10.044
  375    H    LYS  54           HN       LYS  54 -12.713  -5.267  -3.598
  376    HA   LYS  54           HA       LYS  54 -14.277  -6.247  -5.869
  377    HB2  LYS  54           HB2      LYS  54 -12.513  -7.735  -4.899
  378    HB3  LYS  54           HB1      LYS  54 -13.407  -7.739  -3.384
  379    HG2  LYS  54           HG2      LYS  54 -13.822  -9.758  -4.693
  380    HG3  LYS  54           HG1      LYS  54 -15.296  -8.811  -4.477
  381    HD2  LYS  54           HD2      LYS  54 -14.974  -7.849  -6.725
  382    HD3  LYS  54           HD1      LYS  54 -13.547  -8.863  -6.936
  383    HE2  LYS  54           HE2      LYS  54 -14.926 -10.859  -6.719
  384    HE3  LYS  54           HE1      LYS  54 -16.353  -9.856  -6.456
  385    HZ1  LYS  54           HZ1      LYS  54 -16.132  -8.970  -8.665
  386    HZ2  LYS  54           HZ2      LYS  54 -16.165 -10.658  -8.746
  387    HZ3  LYS  54           HZ3      LYS  54 -14.701  -9.834  -8.920
  388    H    GLU  55           HN       GLU  55 -15.766  -4.449  -5.161
  389    HA   GLU  55           HA       GLU  55 -17.403  -5.088  -2.852
  390    HB2  GLU  55           HB2      GLU  55 -18.655  -3.006  -3.539
  391    HB3  GLU  55           HB1      GLU  55 -16.972  -2.766  -3.095
  392    HG2  GLU  55           HG2      GLU  55 -16.331  -2.576  -5.393
  393    HG3  GLU  55           HG1      GLU  55 -17.955  -3.004  -5.928
  394    H    SER  56           HN       SER  56 -18.620  -6.836  -3.241
  395    HA   SER  56           HA       SER  56 -20.266  -6.819  -5.678
  396    HB2  SER  56           HB2      SER  56 -19.521  -9.228  -4.011
  397    HB3  SER  56           HB1      SER  56 -20.295  -9.220  -5.595
  398    HG   SER  56           HG       SER  56 -18.256  -8.033  -6.235
  Start of MODEL   18
    1    H1   GLY   1           HT1      GLY   1  13.589  -9.829  -6.533
    2    H2   GLY   1           HT2      GLY   1  12.457  -9.471  -5.331
    3    H3   GLY   1           HT3      GLY   1  12.486  -8.569  -6.759
    4    HA2  GLY   1           HA1      GLY   1  11.846 -10.521  -8.037
    5    HA3  GLY   1           HA2      GLY   1  11.795 -11.446  -6.545
    6    H    ALA   2           HN       ALA   2   9.813 -11.728  -5.771
    7    HA   ALA   2           HA       ALA   2   7.957  -9.491  -5.707
    8    HB1  ALA   2           HB1      ALA   2   7.518 -10.568  -7.885
    9    HB2  ALA   2           HB2      ALA   2   6.143 -10.678  -6.787
   10    HB3  ALA   2           HB3      ALA   2   7.178 -12.082  -7.045
   11    H    MET   3           HN       MET   3   9.473 -11.296  -3.844
   12    HA   MET   3           HA       MET   3   7.302 -11.687  -1.994
   13    HB2  MET   3           HB2      MET   3   7.414 -13.815  -3.403
   14    HB3  MET   3           HB1      MET   3   8.980 -14.105  -2.658
   15    HG2  MET   3           HG2      MET   3   7.892 -14.076  -0.438
   16    HG3  MET   3           HG1      MET   3   6.333 -13.892  -1.235
   17    HE1  MET   3           HE1      MET   3   9.376 -16.201  -0.528
   18    HE2  MET   3           HE2      MET   3   9.450 -16.118  -2.288
   19    HE3  MET   3           HE3      MET   3   9.017 -17.632  -1.494
   20    H    GLY   4           HN       GLY   4   9.351  -9.919  -1.875
   21    HA2  GLY   4           HA2      GLY   4  11.429 -11.103  -0.184
   22    HA3  GLY   4           HA1      GLY   4  11.457  -9.486  -0.873
   23    H    MET   5           HN       MET   5  11.619 -10.742   1.960
   24    HA   MET   5           HA       MET   5   9.448  -9.633   3.414
   25    HB2  MET   5           HB2      MET   5  12.247 -10.370   4.303
   26    HB3  MET   5           HB1      MET   5  10.962  -9.879   5.397
   27    HG2  MET   5           HG2      MET   5   9.633 -11.808   4.712
   28    HG3  MET   5           HG1      MET   5  10.908 -12.295   3.598
   29    HE1  MET   5           HE1      MET   5  11.426 -12.226   8.189
   30    HE2  MET   5           HE2      MET   5   9.954 -11.719   7.363
   31    HE3  MET   5           HE3      MET   5  11.428 -10.764   7.204
   32    H    ARG   6           HN       ARG   6   9.025  -7.586   3.843
   33    HA   ARG   6           HA       ARG   6   9.169  -5.333   3.877
   34    HB2  ARG   6           HB2      ARG   6  11.872  -6.060   4.992
   35    HB3  ARG   6           HB1      ARG   6  11.308  -4.398   4.892
   36    HG2  ARG   6           HG2      ARG   6   9.869  -6.594   6.361
   37    HG3  ARG   6           HG1      ARG   6  10.983  -5.452   7.112
   38    HD2  ARG   6           HD2      ARG   6   9.566  -3.602   6.552
   39    HD3  ARG   6           HD1      ARG   6   8.522  -4.631   5.575
   40    HE   ARG   6           HE       ARG   6   8.142  -5.809   7.848
   41   HH11  ARG   6          HH11      ARG   6   8.611  -2.368   7.397
   42   HH12  ARG   6          HH12      ARG   6   7.604  -1.929   8.735
   43   HH21  ARG   6          HH21      ARG   6   6.820  -5.235   9.613
   44   HH22  ARG   6          HH22      ARG   6   6.575  -3.560   9.998
   45    H    ASN   7           HN       ASN   7   9.501  -6.341   1.392
   46    HA   ASN   7           HA       ASN   7  11.791  -5.110   0.142
   47    HB2  ASN   7           HB2      ASN   7  10.872  -7.187  -0.809
   48    HB3  ASN   7           HB1      ASN   7   9.347  -6.366  -1.127
   49   HD21  ASN   7          HD21      ASN   7  12.751  -6.491  -1.993
   50   HD22  ASN   7          HD22      ASN   7  12.575  -5.741  -3.541
   51    H    LEU   8           HN       LEU   8  11.361  -3.050   1.050
   52    HA   LEU   8           HA       LEU   8   9.559  -1.502  -0.667
   53    HB2  LEU   8           HB2      LEU   8   9.492   0.109   1.370
   54    HB3  LEU   8           HB1      LEU   8   8.451  -1.300   1.344
   55    HG   LEU   8           HG       LEU   8  10.311  -2.450   2.712
   56   HD11  LEU   8          HD11      LEU   8  11.033   0.431   3.202
   57   HD12  LEU   8          HD12      LEU   8  12.034  -0.764   2.379
   58   HD13  LEU   8          HD13      LEU   8  11.652  -0.961   4.089
   59   HD21  LEU   8          HD21      LEU   8   9.376  -1.581   4.797
   60   HD22  LEU   8          HD22      LEU   8   8.118  -1.879   3.596
   61   HD23  LEU   8          HD23      LEU   8   8.662  -0.232   3.914
   62    H    ASP   9           HN       ASP   9  12.456  -2.281  -0.588
   63    HA   ASP   9           HA       ASP   9  13.955   0.140  -0.282
   64    HB2  ASP   9           HB2      ASP   9  14.614  -2.448  -1.708
   65    HB3  ASP   9           HB1      ASP   9  15.751  -1.124  -1.494
   66    H    GLU  10           HN       GLU  10  12.302  -1.520  -2.840
   67    HA   GLU  10           HA       GLU  10  13.138   0.401  -4.855
   68    HB2  GLU  10           HB2      GLU  10  11.916  -0.987  -6.427
   69    HB3  GLU  10           HB1      GLU  10  12.969  -1.991  -5.443
   70    HG2  GLU  10           HG2      GLU  10  11.128  -2.771  -4.140
   71    HG3  GLU  10           HG1      GLU  10  10.035  -1.616  -4.901
   72    H    CYS  11           HN       CYS  11  11.138   0.646  -2.429
   73    HA   CYS  11           HA       CYS  11   8.893   1.788  -3.929
   74    HB2  CYS  11           HB2      CYS  11   8.406   0.071  -2.174
   75    HB3  CYS  11           HB1      CYS  11   9.076   1.165  -0.977
   76    H    GLU  12           HN       GLU  12   9.765   3.715  -4.498
   77    HA   GLU  12           HA       GLU  12  11.366   5.364  -2.909
   78    HB2  GLU  12           HB2      GLU  12   9.485   6.248  -5.093
   79    HB3  GLU  12           HB1      GLU  12  10.942   7.070  -4.554
   80    HG2  GLU  12           HG2      GLU  12  12.290   5.186  -5.375
   81    HG3  GLU  12           HG1      GLU  12  10.818   4.410  -5.958
   82    H    VAL  13           HN       VAL  13   7.926   5.004  -3.175
   83    HA   VAL  13           HA       VAL  13   7.304   7.436  -1.865
   84    HB   VAL  13           HB       VAL  13   5.685   6.542  -3.363
   85   HG11  VAL  13          HG11      VAL  13   4.501   4.461  -2.984
   86   HG12  VAL  13          HG12      VAL  13   5.511   4.132  -1.579
   87   HG13  VAL  13          HG13      VAL  13   6.228   4.186  -3.189
   88   HG21  VAL  13          HG21      VAL  13   4.594   6.223  -0.581
   89   HG22  VAL  13          HG22      VAL  13   3.692   6.645  -2.037
   90   HG23  VAL  13          HG23      VAL  13   4.875   7.772  -1.374
   91    H    CYS  14           HN       CYS  14   7.744   4.093  -0.731
   92    HA   CYS  14           HA       CYS  14   6.991   4.570   1.955
   93    HB2  CYS  14           HB2      CYS  14   8.563   2.513   0.551
   94    HB3  CYS  14           HB1      CYS  14   8.996   2.751   2.237
   95    H    ARG  15           HN       ARG  15   9.932   5.066   0.179
   96    HA   ARG  15           HA       ARG  15  11.583   5.708   2.387
   97    HB2  ARG  15           HB2      ARG  15  11.812   6.358  -0.551
   98    HB3  ARG  15           HB1      ARG  15  13.075   6.695   0.628
   99    HG2  ARG  15           HG2      ARG  15  13.502   4.437   1.005
  100    HG3  ARG  15           HG1      ARG  15  11.961   3.938   0.313
  101    HD2  ARG  15           HD2      ARG  15  13.872   3.415  -1.145
  102    HD3  ARG  15           HD1      ARG  15  12.722   4.511  -1.899
  103    HE   ARG  15           HE       ARG  15  14.513   6.227  -0.894
  104   HH11  ARG  15          HH11      ARG  15  14.927   3.274  -2.732
  105   HH12  ARG  15          HH12      ARG  15  16.370   3.820  -3.523
  106   HH21  ARG  15          HH21      ARG  15  16.413   6.954  -1.952
  107   HH22  ARG  15          HH22      ARG  15  17.213   5.915  -3.088
  108    H    ASP  16           HN       ASP  16   9.571   7.592   0.226
  109    HA   ASP  16           HA       ASP  16  10.191  10.103   1.424
  110    HB2  ASP  16           HB2      ASP  16   9.346  10.063  -0.832
  111    HB3  ASP  16           HB1      ASP  16   7.884   9.224  -0.325
  112    H    GLY  17           HN       GLY  17   8.268   7.500   2.435
  113    HA2  GLY  17           HA2      GLY  17   7.326   7.353   4.593
  114    HA3  GLY  17           HA1      GLY  17   7.278   9.109   4.667
  115    H    GLY  18           HN       GLY  18   6.106   7.564   1.828
  116    HA2  GLY  18           HA2      GLY  18   3.532   8.669   1.989
  117    HA3  GLY  18           HA1      GLY  18   4.010   7.370   0.913
  118    H    GLU  19           HN       GLU  19   1.490   7.454   1.929
  119    HA   GLU  19           HA       GLU  19   1.420   5.717   4.280
  120    HB2  GLU  19           HB2      GLU  19  -0.665   7.418   2.926
  121    HB3  GLU  19           HB1      GLU  19  -1.038   6.324   4.250
  122    HG2  GLU  19           HG2      GLU  19   0.332   7.575   5.758
  123    HG3  GLU  19           HG1      GLU  19   0.983   8.549   4.441
  124    H    LEU  20           HN       LEU  20   0.213   3.835   4.331
  125    HA   LEU  20           HA       LEU  20  -0.256   2.565   1.735
  126    HB2  LEU  20           HB2      LEU  20   0.232   1.552   4.507
  127    HB3  LEU  20           HB1      LEU  20  -0.599   0.530   3.352
  128    HG   LEU  20           HG       LEU  20   2.114   1.725   2.797
  129   HD11  LEU  20          HD11      LEU  20   1.452  -0.978   3.962
  130   HD12  LEU  20          HD12      LEU  20   2.253   0.345   4.808
  131   HD13  LEU  20          HD13      LEU  20   3.048  -0.439   3.445
  132   HD21  LEU  20          HD21      LEU  20   0.591  -0.596   1.606
  133   HD22  LEU  20          HD22      LEU  20   2.229  -0.118   1.169
  134   HD23  LEU  20          HD23      LEU  20   0.878   0.965   0.837
  135    H    PHE  21           HN       PHE  21  -2.270   1.964   1.075
  136    HA   PHE  21           HA       PHE  21  -4.474   2.446   2.977
  137    HB2  PHE  21           HB2      PHE  21  -4.532   2.621  -0.053
  138    HB3  PHE  21           HB1      PHE  21  -5.898   2.927   1.021
  139    HD1  PHE  21           HD1      PHE  21  -5.713   4.831   2.685
  140    HD2  PHE  21           HD2      PHE  21  -2.998   4.335  -0.564
  141    HE1  PHE  21           HE1      PHE  21  -5.010   7.169   2.914
  142    HE2  PHE  21           HE2      PHE  21  -2.299   6.675  -0.332
  143    HZ   PHE  21           HZ       PHE  21  -3.305   8.096   1.407
  144    H    CYS  22           HN       CYS  22  -2.979   0.063   2.816
  145    HA   CYS  22           HA       CYS  22  -5.092  -1.816   2.067
  146    HB2  CYS  22           HB2      CYS  22  -2.179  -1.952   1.307
  147    HB3  CYS  22           HB1      CYS  22  -3.192  -3.393   1.363
  148    H    CYS  23           HN       CYS  23  -4.901  -3.875   3.151
  149    HA   CYS  23           HA       CYS  23  -3.953  -3.600   5.861
  150    HB2  CYS  23           HB2      CYS  23  -5.082  -5.674   6.286
  151    HB3  CYS  23           HB1      CYS  23  -6.123  -4.748   5.207
  152    H    ASP  24           HN       ASP  24  -2.672  -5.559   6.775
  153    HA   ASP  24           HA       ASP  24  -0.124  -5.501   5.694
  154    HB2  ASP  24           HB2      ASP  24  -1.439  -7.460   7.562
  155    HB3  ASP  24           HB1      ASP  24   0.235  -7.660   7.064
  156    H    THR  25           HN       THR  25  -2.666  -7.903   5.180
  157    HA   THR  25           HA       THR  25  -1.130  -9.778   3.778
  158    HB   THR  25           HB       THR  25  -4.081  -9.265   3.416
  159    HG1  THR  25           HG1      THR  25  -2.652 -10.621   5.473
  160   HG21  THR  25          HG21      THR  25  -2.431 -11.784   3.184
  161   HG22  THR  25          HG22      THR  25  -3.109 -10.868   1.839
  162   HG23  THR  25          HG23      THR  25  -4.180 -11.676   2.983
  163    H    CYS  26           HN       CYS  26  -3.291  -7.213   2.508
  164    HA   CYS  26           HA       CYS  26  -2.695  -7.885  -0.204
  165    HB2  CYS  26           HB2      CYS  26  -3.969  -5.377   0.893
  166    HB3  CYS  26           HB1      CYS  26  -3.943  -5.848  -0.797
  167    H    SER  27           HN       SER  27  -1.401  -5.561   2.100
  168    HA   SER  27           HA       SER  27   0.016  -3.940   0.285
  169    HB2  SER  27           HB2      SER  27  -0.359  -3.283   2.622
  170    HB3  SER  27           HB1      SER  27   0.648  -4.617   3.172
  171    HG   SER  27           HG       SER  27   1.964  -2.873   3.156
  172    H    ARG  28           HN       ARG  28   0.704  -7.034   1.742
  173    HA   ARG  28           HA       ARG  28   3.444  -7.148   1.038
  174    HB2  ARG  28           HB2      ARG  28   2.125  -8.550   2.760
  175    HB3  ARG  28           HB1      ARG  28   1.666  -9.546   1.389
  176    HG2  ARG  28           HG2      ARG  28   3.527 -10.578   2.424
  177    HG3  ARG  28           HG1      ARG  28   4.101  -9.860   0.915
  178    HD2  ARG  28           HD2      ARG  28   5.652  -9.440   2.772
  179    HD3  ARG  28           HD1      ARG  28   4.970  -7.945   2.133
  180    HE   ARG  28           HE       ARG  28   3.591  -9.090   4.413
  181   HH11  ARG  28          HH11      ARG  28   6.016  -6.815   3.311
  182   HH12  ARG  28          HH12      ARG  28   5.895  -5.817   4.726
  183   HH21  ARG  28          HH21      ARG  28   3.441  -7.799   6.265
  184   HH22  ARG  28          HH22      ARG  28   4.437  -6.386   6.418
  185    H    VAL  29           HN       VAL  29   0.501  -7.739  -0.696
  186    HA   VAL  29           HA       VAL  29   1.906  -9.237  -2.773
  187    HB   VAL  29           HB       VAL  29  -1.053  -8.696  -2.530
  188   HG11  VAL  29          HG11      VAL  29  -1.294 -10.514  -4.152
  189   HG12  VAL  29          HG12      VAL  29   0.461 -10.644  -4.265
  190   HG13  VAL  29          HG13      VAL  29  -0.351  -9.178  -4.816
  191   HG21  VAL  29          HG21      VAL  29  -1.193 -11.065  -1.807
  192   HG22  VAL  29          HG22      VAL  29  -0.357 -10.024  -0.656
  193   HG23  VAL  29          HG23      VAL  29   0.568 -11.098  -1.706
  194    H    PHE  30           HN       PHE  30   0.034  -6.262  -2.337
  195    HA   PHE  30           HA       PHE  30   0.865  -5.436  -5.048
  196    HB2  PHE  30           HB2      PHE  30  -1.683  -4.635  -3.612
  197    HB3  PHE  30           HB1      PHE  30  -1.203  -4.135  -5.229
  198    HD1  PHE  30           HD1      PHE  30  -0.866  -6.059  -6.961
  199    HD2  PHE  30           HD2      PHE  30  -3.058  -6.449  -3.332
  200    HE1  PHE  30           HE1      PHE  30  -2.066  -7.986  -7.893
  201    HE2  PHE  30           HE2      PHE  30  -4.255  -8.382  -4.257
  202    HZ   PHE  30           HZ       PHE  30  -3.759  -9.155  -6.541
  203    H    HIS  31           HN       HIS  31   2.629  -4.895  -3.196
  204    HA   HIS  31           HA       HIS  31   2.194  -2.879  -1.356
  205    HB2  HIS  31           HB2      HIS  31   4.163  -4.398  -1.448
  206    HB3  HIS  31           HB1      HIS  31   4.783  -3.454  -2.800
  207    HD1  HIS  31           HD1      HIS  31   3.608  -2.622   0.756
  208    HD2  HIS  31           HD2      HIS  31   6.604  -1.703  -1.971
  209    HE1  HIS  31           HE1      HIS  31   5.173  -1.009   1.931
  210    H    GLU  32           HN       GLU  32   3.404  -2.548  -4.686
  211    HA   GLU  32           HA       GLU  32   3.919   0.239  -4.468
  212    HB2  GLU  32           HB2      GLU  32   3.775  -1.717  -6.719
  213    HB3  GLU  32           HB1      GLU  32   3.789   0.002  -7.081
  214    HG2  GLU  32           HG2      GLU  32   5.865  -1.252  -5.325
  215    HG3  GLU  32           HG1      GLU  32   6.020  -1.228  -7.081
  216    H    ASP  33           HN       ASP  33   1.186  -1.650  -5.575
  217    HA   ASP  33           HA       ASP  33  -0.264   0.580  -6.637
  218    HB2  ASP  33           HB2      ASP  33  -1.065  -2.247  -5.952
  219    HB3  ASP  33           HB1      ASP  33  -2.216  -1.069  -6.569
  220    H    CYS  34           HN       CYS  34   0.143  -0.835  -3.539
  221    HA   CYS  34           HA       CYS  34  -2.299   0.244  -2.448
  222    HB2  CYS  34           HB2      CYS  34   0.009  -1.326  -1.324
  223    HB3  CYS  34           HB1      CYS  34  -1.218  -0.621  -0.267
  224    H    HIS  35           HN       HIS  35   0.571   1.642  -3.245
  225    HA   HIS  35           HA       HIS  35   0.348   3.663  -1.122
  226    HB2  HIS  35           HB2      HIS  35   2.509   3.122  -3.162
  227    HB3  HIS  35           HB1      HIS  35   2.479   4.568  -2.157
  228    HD1  HIS  35           HD1      HIS  35   3.021   4.240   0.395
  229    HD2  HIS  35           HD2      HIS  35   3.241   0.790  -1.901
  230    HE1  HIS  35           HE1      HIS  35   4.252   2.531   1.796
  231    H    ILE  36           HN       ILE  36   0.474   3.267  -4.628
  232    HA   ILE  36           HA       ILE  36  -0.802   5.897  -4.957
  233    HB   ILE  36           HB       ILE  36   1.239   4.635  -6.801
  234   HG12  ILE  36          HG12      ILE  36   1.565   6.984  -4.922
  235   HG13  ILE  36          HG11      ILE  36   2.218   5.370  -4.649
  236   HG21  ILE  36          HG21      ILE  36   0.022   7.394  -6.853
  237   HG22  ILE  36          HG22      ILE  36  -0.376   6.075  -7.951
  238   HG23  ILE  36          HG23      ILE  36   1.243   6.773  -7.962
  239   HD11  ILE  36          HD11      ILE  36   3.626   5.596  -6.619
  240   HD12  ILE  36          HD12      ILE  36   3.914   6.914  -5.483
  241   HD13  ILE  36          HD13      ILE  36   2.949   7.193  -6.932
  242    HA   PRO  37           HA       PRO  37  -1.870   6.975  -6.225
  243    HB2  PRO  37           HB2      PRO  37  -4.350   7.631  -6.960
  244    HB3  PRO  37           HB1      PRO  37  -3.106   7.256  -8.168
  245    HG2  PRO  37           HG2      PRO  37  -5.351   5.555  -7.162
  246    HG3  PRO  37           HG1      PRO  37  -4.713   5.712  -8.809
  247    HD2  PRO  37           HD2      PRO  37  -4.085   3.666  -7.022
  248    HD3  PRO  37           HD1      PRO  37  -3.136   4.105  -8.456
  249    HA   PRO  38           HA       PRO  38  -3.656   6.801  -2.105
  250    HB2  PRO  38           HB2      PRO  38  -3.484   9.750  -2.279
  251    HB3  PRO  38           HB1      PRO  38  -2.784   8.653  -1.084
  252    HG2  PRO  38           HG2      PRO  38  -1.244   9.854  -2.913
  253    HG3  PRO  38           HG1      PRO  38  -0.932   8.183  -2.396
  254    HD2  PRO  38           HD2      PRO  38  -2.257   9.177  -4.904
  255    HD3  PRO  38           HD1      PRO  38  -1.101   7.842  -4.691
  256    H    VAL  39           HN       VAL  39  -5.753   6.811  -1.476
  257    HA   VAL  39           HA       VAL  39  -7.770   7.698  -3.274
  258    HB   VAL  39           HB       VAL  39  -8.131   6.848  -0.404
  259   HG11  VAL  39          HG11      VAL  39 -10.061   6.848  -2.718
  260   HG12  VAL  39          HG12      VAL  39 -10.059   7.996  -1.382
  261   HG13  VAL  39          HG13      VAL  39 -10.403   6.294  -1.080
  262   HG21  VAL  39          HG21      VAL  39  -8.113   5.183  -2.914
  263   HG22  VAL  39          HG22      VAL  39  -8.639   4.616  -1.331
  264   HG23  VAL  39          HG23      VAL  39  -6.963   5.095  -1.581
  265    H    GLU  40           HN       GLU  40  -8.197   9.781  -3.549
  266    HA   GLU  40           HA       GLU  40  -7.720  11.709  -1.466
  267    HB2  GLU  40           HB2      GLU  40  -8.717  11.952  -4.298
  268    HB3  GLU  40           HB1      GLU  40  -8.608  13.330  -3.212
  269    HG2  GLU  40           HG2      GLU  40  -6.291  11.565  -3.966
  270    HG3  GLU  40           HG1      GLU  40  -6.672  13.110  -4.725
  271    H    ALA  41           HN       ALA  41  -9.311  10.545  -0.090
  272    HA   ALA  41           HA       ALA  41 -11.675  12.078   0.173
  273    HB1  ALA  41           HB1      ALA  41 -13.334  10.310  -0.160
  274    HB2  ALA  41           HB2      ALA  41 -12.061   9.215  -0.698
  275    HB3  ALA  41           HB3      ALA  41 -12.454  10.643  -1.652
  276    H    GLU  42           HN       GLU  42 -11.120   8.658   0.829
  277    HA   GLU  42           HA       GLU  42 -11.076   9.266   3.700
  278    HB2  GLU  42           HB2      GLU  42 -11.846   6.716   2.270
  279    HB3  GLU  42           HB1      GLU  42 -11.795   6.919   4.015
  280    HG2  GLU  42           HG2      GLU  42 -13.541   8.534   2.181
  281    HG3  GLU  42           HG1      GLU  42 -14.065   7.075   3.022
  282    H    ARG  43           HN       ARG  43  -8.839   9.670   3.775
  283    HA   ARG  43           HA       ARG  43  -7.023   7.555   2.971
  284    HB2  ARG  43           HB2      ARG  43  -6.490  10.189   4.356
  285    HB3  ARG  43           HB1      ARG  43  -5.246   9.064   3.832
  286    HG2  ARG  43           HG2      ARG  43  -6.262   9.337   1.495
  287    HG3  ARG  43           HG1      ARG  43  -7.079  10.750   2.166
  288    HD2  ARG  43           HD2      ARG  43  -4.101  10.270   2.091
  289    HD3  ARG  43           HD1      ARG  43  -4.998  11.391   1.072
  290    HE   ARG  43           HE       ARG  43  -5.582  12.177   3.618
  291   HH11  ARG  43          HH11      ARG  43  -2.625  11.687   1.813
  292   HH12  ARG  43          HH12      ARG  43  -1.738  12.896   2.688
  293   HH21  ARG  43          HH21      ARG  43  -4.416  13.767   4.777
  294   HH22  ARG  43          HH22      ARG  43  -2.757  14.073   4.378
  295    H    THR  44           HN       THR  44  -8.504   6.287   4.540
  296    HA   THR  44           HA       THR  44  -7.666   6.540   7.320
  297    HB   THR  44           HB       THR  44  -9.491   4.792   7.668
  298    HG1  THR  44           HG1      THR  44 -10.772   4.290   5.982
  299   HG21  THR  44          HG21      THR  44  -9.855   7.150   8.166
  300   HG22  THR  44          HG22      THR  44 -11.302   6.458   7.430
  301   HG23  THR  44          HG23      THR  44 -10.223   7.470   6.471
  302    HA   PRO  45           HA       PRO  45  -4.602   3.421   6.462
  303    HB2  PRO  45           HB2      PRO  45  -4.331   3.251   9.388
  304    HB3  PRO  45           HB1      PRO  45  -3.130   3.693   8.171
  305    HG2  PRO  45           HG2      PRO  45  -4.212   5.510   9.839
  306    HG3  PRO  45           HG1      PRO  45  -3.741   5.910   8.177
  307    HD2  PRO  45           HD2      PRO  45  -6.460   5.408   9.312
  308    HD3  PRO  45           HD1      PRO  45  -5.947   6.569   8.066
  309    H    TRP  46           HN       TRP  46  -7.293   2.956   8.636
  310    HA   TRP  46           HA       TRP  46  -6.707   0.110   8.903
  311    HB2  TRP  46           HB2      TRP  46  -8.685   0.132  10.469
  312    HB3  TRP  46           HB1      TRP  46  -7.341   1.157  10.960
  313    HD1  TRP  46           HD1      TRP  46 -10.926   1.373   9.602
  314    HE1  TRP  46           HE1      TRP  46 -11.825   3.740  10.042
  315    HE3  TRP  46           HE3      TRP  46  -6.635   3.568  11.321
  316    HZ2  TRP  46           HZ2      TRP  46 -10.850   6.206  10.999
  317    HZ3  TRP  46           HZ3      TRP  46  -6.707   5.940  11.974
  318    HH2  TRP  46           HH2      TRP  46  -8.766   7.228  11.811
  319    H    ASN  47           HN       ASN  47  -7.916   1.663   6.464
  320    HA   ASN  47           HA       ASN  47 -10.045  -0.318   6.003
  321    HB2  ASN  47           HB2      ASN  47  -9.912   2.557   5.082
  322    HB3  ASN  47           HB1      ASN  47 -10.992   1.380   4.349
  323   HD21  ASN  47          HD21      ASN  47 -11.595  -0.017   6.796
  324   HD22  ASN  47          HD22      ASN  47 -12.610   1.028   7.734
  325    H    CYS  48           HN       CYS  48  -9.447  -1.780   4.548
  326    HA   CYS  48           HA       CYS  48  -7.207  -1.160   2.795
  327    HB2  CYS  48           HB2      CYS  48  -7.278  -3.274   4.137
  328    HB3  CYS  48           HB1      CYS  48  -8.674  -3.783   3.196
  329    H    ILE  49           HN       ILE  49  -7.505  -0.512   0.759
  330    HA   ILE  49           HA       ILE  49 -10.129  -0.581  -0.425
  331    HB   ILE  49           HB       ILE  49  -9.011   0.460  -2.419
  332   HG12  ILE  49          HG12      ILE  49  -6.592   0.614  -0.617
  333   HG13  ILE  49          HG11      ILE  49  -6.742  -0.516  -1.959
  334   HG21  ILE  49          HG21      ILE  49  -8.613   2.623  -1.311
  335   HG22  ILE  49          HG22      ILE  49  -8.632   1.808   0.250
  336   HG23  ILE  49          HG23      ILE  49 -10.085   1.834  -0.748
  337   HD11  ILE  49          HD11      ILE  49  -6.887   1.349  -3.517
  338   HD12  ILE  49          HD12      ILE  49  -5.413   1.447  -2.550
  339   HD13  ILE  49          HD13      ILE  49  -6.787   2.489  -2.175
  340    H    PHE  50           HN       PHE  50  -7.238  -2.481  -0.639
  341    HA   PHE  50           HA       PHE  50  -7.943  -3.636  -3.177
  342    HB2  PHE  50           HB2      PHE  50  -5.605  -3.781  -1.424
  343    HB3  PHE  50           HB1      PHE  50  -6.024  -5.325  -2.173
  344    HD1  PHE  50           HD1      PHE  50  -5.979  -5.603  -4.572
  345    HD2  PHE  50           HD2      PHE  50  -4.886  -1.899  -2.786
  346    HE1  PHE  50           HE1      PHE  50  -4.991  -4.870  -6.701
  347    HE2  PHE  50           HE2      PHE  50  -3.900  -1.160  -4.908
  348    HZ   PHE  50           HZ       PHE  50  -3.951  -2.645  -6.873
  349    H    CYS  51           HN       CYS  51  -8.419  -4.452   0.194
  350    HA   CYS  51           HA       CYS  51  -9.248  -7.117  -0.178
  351    HB2  CYS  51           HB2      CYS  51  -9.695  -5.040   1.900
  352    HB3  CYS  51           HB1      CYS  51 -10.838  -6.378   1.863
  353    H    ARG  52           HN       ARG  52 -10.936  -4.052  -0.596
  354    HA   ARG  52           HA       ARG  52 -13.464  -5.366  -1.085
  355    HB2  ARG  52           HB2      ARG  52 -12.736  -2.450  -1.430
  356    HB3  ARG  52           HB1      ARG  52 -14.358  -3.123  -1.396
  357    HG2  ARG  52           HG2      ARG  52 -14.001  -3.815   0.941
  358    HG3  ARG  52           HG1      ARG  52 -12.402  -3.072   0.896
  359    HD2  ARG  52           HD2      ARG  52 -15.056  -1.682   0.575
  360    HD3  ARG  52           HD1      ARG  52 -13.959  -1.566   1.946
  361    HE   ARG  52           HE       ARG  52 -13.135  -0.651  -0.724
  362   HH11  ARG  52          HH11      ARG  52 -13.662  -0.016   2.687
  363   HH12  ARG  52          HH12      ARG  52 -12.977   1.578   2.617
  364   HH21  ARG  52          HH21      ARG  52 -12.244   1.438  -0.807
  365   HH22  ARG  52          HH22      ARG  52 -12.170   2.403   0.635
  366    H    MET  53           HN       MET  53 -10.736  -4.872  -2.854
  367    HA   MET  53           HA       MET  53 -12.236  -5.011  -5.381
  368    HB2  MET  53           HB2      MET  53 -11.122  -2.774  -4.987
  369    HB3  MET  53           HB1      MET  53  -9.580  -3.612  -5.035
  370    HG2  MET  53           HG2      MET  53 -10.014  -4.305  -7.327
  371    HG3  MET  53           HG1      MET  53 -11.581  -3.500  -7.282
  372    HE1  MET  53           HE1      MET  53  -8.156  -2.259  -5.740
  373    HE2  MET  53           HE2      MET  53  -7.526  -1.297  -7.077
  374    HE3  MET  53           HE3      MET  53  -7.692  -3.044  -7.248
  375    H    LYS  54           HN       LYS  54 -11.089  -7.026  -3.561
  376    HA   LYS  54           HA       LYS  54  -8.732  -8.091  -4.754
  377    HB2  LYS  54           HB2      LYS  54  -9.448  -8.533  -2.393
  378    HB3  LYS  54           HB1      LYS  54 -10.780  -9.492  -3.016
  379    HG2  LYS  54           HG2      LYS  54  -9.190 -11.053  -4.027
  380    HG3  LYS  54           HG1      LYS  54  -7.849 -10.098  -3.389
  381    HD2  LYS  54           HD2      LYS  54  -8.752 -10.488  -1.097
  382    HD3  LYS  54           HD1      LYS  54  -9.952 -11.571  -1.805
  383    HE2  LYS  54           HE2      LYS  54  -6.956 -11.906  -1.948
  384    HE3  LYS  54           HE1      LYS  54  -8.046 -12.809  -0.901
  385    HZ1  LYS  54           HZ1      LYS  54  -7.471 -14.079  -2.855
  386    HZ2  LYS  54           HZ2      LYS  54  -8.056 -12.860  -3.868
  387    HZ3  LYS  54           HZ3      LYS  54  -9.122 -13.711  -2.872
  388    H    GLU  55           HN       GLU  55 -12.130  -8.405  -5.269
  389    HA   GLU  55           HA       GLU  55 -11.648 -10.041  -7.637
  390    HB2  GLU  55           HB2      GLU  55 -12.233 -11.609  -5.837
  391    HB3  GLU  55           HB1      GLU  55 -13.693 -10.691  -5.506
  392    HG2  GLU  55           HG2      GLU  55 -14.413 -11.205  -7.860
  393    HG3  GLU  55           HG1      GLU  55 -13.048 -12.319  -7.943
  394    H    SER  56           HN       SER  56 -13.196  -9.701  -9.271
  395    HA   SER  56           HA       SER  56 -15.118  -7.545  -8.716
  396    HB2  SER  56           HB2      SER  56 -13.647  -8.041 -11.316
  397    HB3  SER  56           HB1      SER  56 -14.772  -6.724 -10.986
  398    HG   SER  56           HG       SER  56 -12.166  -7.136 -10.010
  Start of MODEL   19
    1    H1   GLY   1           HT1      GLY   1  17.522  -3.572   9.708
    2    H2   GLY   1           HT2      GLY   1  17.764  -4.299  11.213
    3    H3   GLY   1           HT3      GLY   1  16.375  -3.377  10.932
    4    HA2  GLY   1           HA1      GLY   1  17.062  -5.943   9.622
    5    HA3  GLY   1           HA2      GLY   1  15.847  -5.719  10.870
    6    H    ALA   2           HN       ALA   2  16.756  -4.409   7.697
    7    HA   ALA   2           HA       ALA   2  14.125  -4.927   6.656
    8    HB1  ALA   2           HB1      ALA   2  13.622  -2.612   6.047
    9    HB2  ALA   2           HB2      ALA   2  15.068  -2.067   6.897
   10    HB3  ALA   2           HB3      ALA   2  13.737  -2.792   7.798
   11    H    MET   3           HN       MET   3  16.641  -5.903   6.000
   12    HA   MET   3           HA       MET   3  17.023  -4.757   3.326
   13    HB2  MET   3           HB2      MET   3  18.807  -3.890   4.808
   14    HB3  MET   3           HB1      MET   3  19.276  -5.542   5.190
   15    HG2  MET   3           HG2      MET   3  19.786  -5.908   2.798
   16    HG3  MET   3           HG1      MET   3  19.411  -4.215   2.492
   17    HE1  MET   3           HE1      MET   3  21.808  -3.951   1.341
   18    HE2  MET   3           HE2      MET   3  22.130  -5.651   1.684
   19    HE3  MET   3           HE3      MET   3  23.313  -4.421   2.130
   20    H    GLY   4           HN       GLY   4  15.899  -6.493   2.430
   21    HA2  GLY   4           HA2      GLY   4  17.033  -8.471   1.199
   22    HA3  GLY   4           HA1      GLY   4  17.057  -9.161   2.814
   23    H    MET   5           HN       MET   5  14.666  -8.529   3.842
   24    HA   MET   5           HA       MET   5  12.879 -10.094   2.114
   25    HB2  MET   5           HB2      MET   5  11.817 -10.908   4.094
   26    HB3  MET   5           HB1      MET   5  13.548 -11.047   4.333
   27    HG2  MET   5           HG2      MET   5  11.753  -8.923   5.488
   28    HG3  MET   5           HG1      MET   5  12.459 -10.284   6.354
   29    HE1  MET   5           HE1      MET   5  14.348  -7.218   7.867
   30    HE2  MET   5           HE2      MET   5  13.397  -8.662   8.214
   31    HE3  MET   5           HE3      MET   5  12.658  -7.302   7.370
   32    H    ARG   6           HN       ARG   6  13.140  -7.287   1.744
   33    HA   ARG   6           HA       ARG   6  10.456  -6.400   2.562
   34    HB2  ARG   6           HB2      ARG   6  12.938  -4.683   2.391
   35    HB3  ARG   6           HB1      ARG   6  11.325  -4.118   2.796
   36    HG2  ARG   6           HG2      ARG   6  12.710  -6.210   4.434
   37    HG3  ARG   6           HG1      ARG   6  12.995  -4.490   4.695
   38    HD2  ARG   6           HD2      ARG   6  11.307  -5.221   6.231
   39    HD3  ARG   6           HD1      ARG   6  10.550  -4.192   5.021
   40    HE   ARG   6           HE       ARG   6  10.401  -7.005   4.412
   41   HH11  ARG   6          HH11      ARG   6   8.903  -4.341   6.121
   42   HH12  ARG   6          HH12      ARG   6   7.330  -5.074   6.153
   43   HH21  ARG   6          HH21      ARG   6   8.326  -7.982   4.468
   44   HH22  ARG   6          HH22      ARG   6   7.002  -7.136   5.208
   45    H    ASN   7           HN       ASN   7   9.234  -5.495   0.993
   46    HA   ASN   7           HA       ASN   7  10.356  -5.433  -1.714
   47    HB2  ASN   7           HB2      ASN   7   8.273  -6.725  -1.306
   48    HB3  ASN   7           HB1      ASN   7   7.468  -5.241  -0.814
   49   HD21  ASN   7          HD21      ASN   7   9.752  -5.458  -3.479
   50   HD22  ASN   7          HD22      ASN   7   8.602  -5.141  -4.728
   51    H    LEU   8           HN       LEU   8   9.849  -3.370   0.798
   52    HA   LEU   8           HA       LEU   8   8.903  -1.106  -0.733
   53    HB2  LEU   8           HB2      LEU   8   9.029   0.096   1.444
   54    HB3  LEU   8           HB1      LEU   8   7.993  -1.315   1.454
   55    HG   LEU   8           HG       LEU   8  10.358  -2.367   2.333
   56   HD11  LEU   8          HD11      LEU   8  10.112   0.381   3.539
   57   HD12  LEU   8          HD12      LEU   8  11.388  -0.151   2.444
   58   HD13  LEU   8          HD13      LEU   8  11.231  -0.884   4.040
   59   HD21  LEU   8          HD21      LEU   8   8.135  -1.167   3.976
   60   HD22  LEU   8          HD22      LEU   8   9.302  -2.361   4.542
   61   HD23  LEU   8          HD23      LEU   8   8.154  -2.784   3.271
   62    H    ASP   9           HN       ASP   9  11.720  -2.481  -0.781
   63    HA   ASP   9           HA       ASP   9  13.492  -0.311  -0.145
   64    HB2  ASP   9           HB2      ASP   9  13.893  -2.968  -1.491
   65    HB3  ASP   9           HB1      ASP   9  15.186  -1.777  -1.401
   66    H    GLU  10           HN       GLU  10  11.976  -1.587  -3.016
   67    HA   GLU  10           HA       GLU  10  13.263   0.436  -4.684
   68    HB2  GLU  10           HB2      GLU  10  11.287  -1.711  -5.471
   69    HB3  GLU  10           HB1      GLU  10  12.225  -0.705  -6.566
   70    HG2  GLU  10           HG2      GLU  10  13.334  -2.748  -4.654
   71    HG3  GLU  10           HG1      GLU  10  13.154  -2.944  -6.397
   72    H    CYS  11           HN       CYS  11  11.044   0.711  -2.567
   73    HA   CYS  11           HA       CYS  11   8.967   1.968  -4.206
   74    HB2  CYS  11           HB2      CYS  11   8.328   0.204  -2.578
   75    HB3  CYS  11           HB1      CYS  11   8.937   1.213  -1.281
   76    H    GLU  12           HN       GLU  12   9.812   3.942  -4.640
   77    HA   GLU  12           HA       GLU  12  11.366   5.560  -3.010
   78    HB2  GLU  12           HB2      GLU  12   9.373   6.414  -5.105
   79    HB3  GLU  12           HB1      GLU  12  10.679   7.404  -4.472
   80    HG2  GLU  12           HG2      GLU  12  12.320   6.136  -5.533
   81    HG3  GLU  12           HG1      GLU  12  11.222   4.780  -5.804
   82    H    VAL  13           HN       VAL  13   7.859   5.371  -3.299
   83    HA   VAL  13           HA       VAL  13   7.342   7.674  -1.764
   84    HB   VAL  13           HB       VAL  13   5.691   6.823  -3.310
   85   HG11  VAL  13          HG11      VAL  13   6.162   4.446  -3.108
   86   HG12  VAL  13          HG12      VAL  13   4.447   4.786  -2.899
   87   HG13  VAL  13          HG13      VAL  13   5.451   4.440  -1.494
   88   HG21  VAL  13          HG21      VAL  13   4.908   8.107  -1.379
   89   HG22  VAL  13          HG22      VAL  13   4.679   6.602  -0.488
   90   HG23  VAL  13          HG23      VAL  13   3.709   6.932  -1.924
   91    H    CYS  14           HN       CYS  14   7.901   4.316  -0.901
   92    HA   CYS  14           HA       CYS  14   7.066   4.571   1.810
   93    HB2  CYS  14           HB2      CYS  14   8.504   2.562   0.220
   94    HB3  CYS  14           HB1      CYS  14   8.953   2.617   1.919
   95    H    ARG  15           HN       ARG  15   9.979   5.280   0.063
   96    HA   ARG  15           HA       ARG  15  11.690   5.648   2.298
   97    HB2  ARG  15           HB2      ARG  15  11.847   7.015  -0.391
   98    HB3  ARG  15           HB1      ARG  15  13.155   6.842   0.772
   99    HG2  ARG  15           HG2      ARG  15  13.148   4.436   0.451
  100    HG3  ARG  15           HG1      ARG  15  11.792   4.578  -0.666
  101    HD2  ARG  15           HD2      ARG  15  13.180   5.955  -2.145
  102    HD3  ARG  15           HD1      ARG  15  14.537   5.761  -1.040
  103    HE   ARG  15           HE       ARG  15  13.966   3.223  -1.570
  104   HH11  ARG  15          HH11      ARG  15  14.242   5.968  -3.739
  105   HH12  ARG  15          HH12      ARG  15  14.781   5.010  -5.081
  106   HH21  ARG  15          HH21      ARG  15  14.665   1.966  -3.346
  107   HH22  ARG  15          HH22      ARG  15  15.028   2.746  -4.859
  108    H    ASP  16           HN       ASP  16   9.508   7.706   0.501
  109    HA   ASP  16           HA       ASP  16  10.034  10.079   1.991
  110    HB2  ASP  16           HB2      ASP  16   7.840   9.236   0.116
  111    HB3  ASP  16           HB1      ASP  16   7.734  10.753   1.003
  112    H    GLY  17           HN       GLY  17   8.530   7.245   2.864
  113    HA2  GLY  17           HA2      GLY  17   7.464   6.721   4.859
  114    HA3  GLY  17           HA1      GLY  17   7.421   8.438   5.247
  115    H    GLY  18           HN       GLY  18   6.224   7.225   2.218
  116    HA2  GLY  18           HA2      GLY  18   3.702   8.438   2.506
  117    HA3  GLY  18           HA1      GLY  18   4.143   7.268   1.276
  118    H    GLU  19           HN       GLU  19   1.627   7.405   2.408
  119    HA   GLU  19           HA       GLU  19   1.432   5.413   4.503
  120    HB2  GLU  19           HB2      GLU  19  -0.767   6.885   3.045
  121    HB3  GLU  19           HB1      GLU  19  -0.936   5.974   4.540
  122    HG2  GLU  19           HG2      GLU  19   0.599   7.599   5.630
  123    HG3  GLU  19           HG1      GLU  19   0.603   8.532   4.135
  124    H    LEU  20           HN       LEU  20  -0.116   3.653   4.298
  125    HA   LEU  20           HA       LEU  20  -0.207   2.531   1.579
  126    HB2  LEU  20           HB2      LEU  20   0.143   1.295   4.283
  127    HB3  LEU  20           HB1      LEU  20  -0.582   0.357   2.993
  128    HG   LEU  20           HG       LEU  20   2.102   1.679   2.664
  129   HD11  LEU  20          HD11      LEU  20   1.486  -1.053   3.781
  130   HD12  LEU  20          HD12      LEU  20   2.313   0.268   4.607
  131   HD13  LEU  20          HD13      LEU  20   3.077  -0.530   3.231
  132   HD21  LEU  20          HD21      LEU  20   0.722  -0.641   1.315
  133   HD22  LEU  20          HD22      LEU  20   2.375  -0.128   0.996
  134   HD23  LEU  20          HD23      LEU  20   1.030   0.948   0.618
  135    H    PHE  21           HN       PHE  21  -2.192   2.057   0.737
  136    HA   PHE  21           HA       PHE  21  -4.508   2.568   2.474
  137    HB2  PHE  21           HB2      PHE  21  -4.515   2.304  -0.542
  138    HB3  PHE  21           HB1      PHE  21  -5.737   3.067   0.480
  139    HD1  PHE  21           HD1      PHE  21  -4.695   5.023   2.022
  140    HD2  PHE  21           HD2      PHE  21  -3.141   3.698  -1.715
  141    HE1  PHE  21           HE1      PHE  21  -3.535   7.164   1.748
  142    HE2  PHE  21           HE2      PHE  21  -1.984   5.845  -1.996
  143    HZ   PHE  21           HZ       PHE  21  -2.176   7.581  -0.262
  144    H    CYS  22           HN       CYS  22  -3.007   0.197   2.638
  145    HA   CYS  22           HA       CYS  22  -5.036  -1.780   1.947
  146    HB2  CYS  22           HB2      CYS  22  -2.110  -1.868   1.233
  147    HB3  CYS  22           HB1      CYS  22  -3.061  -3.343   1.387
  148    H    CYS  23           HN       CYS  23  -4.800  -3.754   3.191
  149    HA   CYS  23           HA       CYS  23  -3.839  -3.242   5.882
  150    HB2  CYS  23           HB2      CYS  23  -5.041  -5.222   6.505
  151    HB3  CYS  23           HB1      CYS  23  -6.069  -4.377   5.346
  152    H    ASP  24           HN       ASP  24  -2.610  -5.238   6.891
  153    HA   ASP  24           HA       ASP  24  -0.072  -5.109   5.763
  154    HB2  ASP  24           HB2      ASP  24  -1.226  -7.023   7.772
  155    HB3  ASP  24           HB1      ASP  24   0.458  -7.097   7.273
  156    H    THR  25           HN       THR  25  -2.478  -7.675   5.438
  157    HA   THR  25           HA       THR  25  -0.860  -9.515   4.077
  158    HB   THR  25           HB       THR  25  -3.839  -9.156   3.750
  159    HG1  THR  25           HG1      THR  25  -2.273 -10.122   5.851
  160   HG21  THR  25          HG21      THR  25  -2.078 -11.590   3.445
  161   HG22  THR  25          HG22      THR  25  -2.818 -10.685   2.125
  162   HG23  THR  25          HG23      THR  25  -3.832 -11.557   3.273
  163    H    CYS  26           HN       CYS  26  -3.119  -7.080   2.761
  164    HA   CYS  26           HA       CYS  26  -2.565  -7.827   0.057
  165    HB2  CYS  26           HB2      CYS  26  -3.895  -5.324   1.107
  166    HB3  CYS  26           HB1      CYS  26  -3.927  -5.875  -0.559
  167    H    SER  27           HN       SER  27  -1.334  -5.401   2.269
  168    HA   SER  27           HA       SER  27  -0.044  -3.731   0.420
  169    HB2  SER  27           HB2      SER  27   0.672  -4.332   3.294
  170    HB3  SER  27           HB1      SER  27   1.320  -2.994   2.351
  171    HG   SER  27           HG       SER  27  -0.499  -2.461   3.718
  172    H    ARG  28           HN       ARG  28   0.850  -6.843   1.669
  173    HA   ARG  28           HA       ARG  28   3.611  -6.556   0.847
  174    HB2  ARG  28           HB2      ARG  28   2.039  -8.843   2.029
  175    HB3  ARG  28           HB1      ARG  28   3.727  -8.987   1.554
  176    HG2  ARG  28           HG2      ARG  28   4.381  -7.331   3.161
  177    HG3  ARG  28           HG1      ARG  28   2.696  -6.983   3.551
  178    HD2  ARG  28           HD2      ARG  28   3.686  -8.381   5.260
  179    HD3  ARG  28           HD1      ARG  28   2.431  -9.268   4.399
  180    HE   ARG  28           HE       ARG  28   4.819  -9.877   3.140
  181   HH11  ARG  28          HH11      ARG  28   3.423 -10.219   6.324
  182   HH12  ARG  28          HH12      ARG  28   4.303 -11.665   6.702
  183   HH21  ARG  28          HH21      ARG  28   6.010 -11.776   3.635
  184   HH22  ARG  28          HH22      ARG  28   5.793 -12.542   5.176
  185    H    VAL  29           HN       VAL  29   0.658  -7.548  -0.515
  186    HA   VAL  29           HA       VAL  29   1.950  -9.239  -2.512
  187    HB   VAL  29           HB       VAL  29  -0.999  -8.693  -2.170
  188   HG11  VAL  29          HG11      VAL  29  -0.375  -9.474  -4.401
  189   HG12  VAL  29          HG12      VAL  29  -1.292 -10.700  -3.528
  190   HG13  VAL  29          HG13      VAL  29   0.457 -10.855  -3.687
  191   HG21  VAL  29          HG21      VAL  29  -0.132  -9.750  -0.169
  192   HG22  VAL  29          HG22      VAL  29   0.659 -10.990  -1.143
  193   HG23  VAL  29          HG23      VAL  29  -1.101 -10.895  -1.092
  194    H    PHE  30           HN       PHE  30  -0.083  -6.316  -2.325
  195    HA   PHE  30           HA       PHE  30   0.708  -5.717  -5.111
  196    HB2  PHE  30           HB2      PHE  30  -1.820  -4.775  -3.737
  197    HB3  PHE  30           HB1      PHE  30  -1.399  -4.580  -5.436
  198    HD1  PHE  30           HD1      PHE  30  -1.049  -6.823  -6.771
  199    HD2  PHE  30           HD2      PHE  30  -3.188  -6.501  -3.102
  200    HE1  PHE  30           HE1      PHE  30  -2.238  -8.914  -7.280
  201    HE2  PHE  30           HE2      PHE  30  -4.374  -8.593  -3.604
  202    HZ   PHE  30           HZ       PHE  30  -3.900  -9.804  -5.697
  203    H    HIS  31           HN       HIS  31   2.372  -5.040  -3.131
  204    HA   HIS  31           HA       HIS  31   2.034  -2.839  -1.564
  205    HB2  HIS  31           HB2      HIS  31   4.006  -4.370  -1.625
  206    HB3  HIS  31           HB1      HIS  31   4.575  -3.516  -3.053
  207    HD1  HIS  31           HD1      HIS  31   3.673  -2.639   0.557
  208    HD2  HIS  31           HD2      HIS  31   6.314  -1.568  -2.463
  209    HE1  HIS  31           HE1      HIS  31   5.273  -0.961   1.577
  210    H    GLU  32           HN       GLU  32   3.118  -2.794  -4.953
  211    HA   GLU  32           HA       GLU  32   3.769  -0.051  -5.004
  212    HB2  GLU  32           HB2      GLU  32   4.627  -1.654  -6.655
  213    HB3  GLU  32           HB1      GLU  32   3.001  -1.883  -7.283
  214    HG2  GLU  32           HG2      GLU  32   2.972   0.552  -7.857
  215    HG3  GLU  32           HG1      GLU  32   4.677   0.611  -7.411
  216    H    ASP  33           HN       ASP  33   0.825  -1.804  -5.887
  217    HA   ASP  33           HA       ASP  33  -0.492   0.526  -6.925
  218    HB2  ASP  33           HB2      ASP  33  -0.930  -1.920  -7.572
  219    HB3  ASP  33           HB1      ASP  33  -1.837  -2.033  -6.071
  220    H    CYS  34           HN       CYS  34  -0.143  -1.008  -3.866
  221    HA   CYS  34           HA       CYS  34  -2.438   0.133  -2.610
  222    HB2  CYS  34           HB2      CYS  34   0.028  -1.271  -1.594
  223    HB3  CYS  34           HB1      CYS  34  -1.171  -0.592  -0.494
  224    H    HIS  35           HN       HIS  35   0.377   1.538  -3.660
  225    HA   HIS  35           HA       HIS  35   0.272   3.640  -1.609
  226    HB2  HIS  35           HB2      HIS  35   2.332   2.947  -3.695
  227    HB3  HIS  35           HB1      HIS  35   2.363   4.473  -2.813
  228    HD1  HIS  35           HD1      HIS  35   2.816   4.293  -0.186
  229    HD2  HIS  35           HD2      HIS  35   3.207   0.753  -2.330
  230    HE1  HIS  35           HE1      HIS  35   4.087   2.694   1.306
  231    H    ILE  36           HN       ILE  36  -1.211   2.948  -4.405
  232    HA   ILE  36           HA       ILE  36  -1.198   5.735  -5.367
  233    HB   ILE  36           HB       ILE  36  -1.724   3.208  -6.949
  234   HG12  ILE  36          HG12      ILE  36   0.637   5.106  -7.000
  235   HG13  ILE  36          HG11      ILE  36   0.642   3.478  -6.333
  236   HG21  ILE  36          HG21      ILE  36  -1.530   6.064  -7.899
  237   HG22  ILE  36          HG22      ILE  36  -3.015   5.123  -7.763
  238   HG23  ILE  36          HG23      ILE  36  -1.768   4.642  -8.913
  239   HD11  ILE  36          HD11      ILE  36   0.210   4.195  -9.225
  240   HD12  ILE  36          HD12      ILE  36   0.222   2.563  -8.558
  241   HD13  ILE  36          HD13      ILE  36   1.691   3.539  -8.522
  242    HA   PRO  37           HA       PRO  37  -2.452   7.176  -6.484
  243    HB2  PRO  37           HB2      PRO  37  -4.282   8.935  -5.012
  244    HB3  PRO  37           HB1      PRO  37  -4.049   8.784  -6.762
  245    HG2  PRO  37           HG2      PRO  37  -6.299   7.937  -5.538
  246    HG3  PRO  37           HG1      PRO  37  -5.627   7.111  -6.958
  247    HD2  PRO  37           HD2      PRO  37  -5.399   6.374  -4.052
  248    HD3  PRO  37           HD1      PRO  37  -5.739   5.329  -5.453
  249    HA   PRO  38           HA       PRO  38   0.355   7.790  -3.142
  250    HB2  PRO  38           HB2      PRO  38   1.456  10.165  -4.103
  251    HB3  PRO  38           HB1      PRO  38   2.003   8.533  -4.500
  252    HG2  PRO  38           HG2      PRO  38   0.229  10.373  -6.040
  253    HG3  PRO  38           HG1      PRO  38   1.438   9.219  -6.633
  254    HD2  PRO  38           HD2      PRO  38  -1.196   8.691  -6.776
  255    HD3  PRO  38           HD1      PRO  38  -0.011   7.407  -6.439
  256    H    VAL  39           HN       VAL  39   0.665   9.049  -1.327
  257    HA   VAL  39           HA       VAL  39  -1.658  10.385  -0.419
  258    HB   VAL  39           HB       VAL  39   1.080  10.259   0.845
  259   HG11  VAL  39          HG11      VAL  39  -0.087  10.718   2.946
  260   HG12  VAL  39          HG12      VAL  39  -1.593  10.931   2.052
  261   HG13  VAL  39          HG13      VAL  39  -0.249  12.045   1.796
  262   HG21  VAL  39          HG21      VAL  39   0.121   8.046   0.424
  263   HG22  VAL  39          HG22      VAL  39  -1.333   8.522   1.301
  264   HG23  VAL  39          HG23      VAL  39   0.209   8.411   2.143
  265    H    GLU  40           HN       GLU  40  -2.215  12.435  -0.660
  266    HA   GLU  40           HA       GLU  40  -0.151  14.383  -1.389
  267    HB2  GLU  40           HB2      GLU  40  -3.163  14.567  -1.623
  268    HB3  GLU  40           HB1      GLU  40  -2.023  15.792  -2.158
  269    HG2  GLU  40           HG2      GLU  40  -1.133  14.325  -3.826
  270    HG3  GLU  40           HG1      GLU  40  -2.091  12.979  -3.215
  271    H    ALA  41           HN       ALA  41  -2.822  13.842   0.866
  272    HA   ALA  41           HA       ALA  41  -1.447  15.383   2.881
  273    HB1  ALA  41           HB1      ALA  41  -3.318  16.905   3.316
  274    HB2  ALA  41           HB2      ALA  41  -4.161  16.266   1.908
  275    HB3  ALA  41           HB3      ALA  41  -2.648  17.146   1.704
  276    H    GLU  42           HN       GLU  42  -1.852  12.756   2.948
  277    HA   GLU  42           HA       GLU  42  -2.614  11.022   4.199
  278    HB2  GLU  42           HB2      GLU  42  -3.920  13.183   5.854
  279    HB3  GLU  42           HB1      GLU  42  -3.736  11.501   6.334
  280    HG2  GLU  42           HG2      GLU  42  -1.315  11.739   6.271
  281    HG3  GLU  42           HG1      GLU  42  -1.486  13.421   5.767
  282    H    ARG  43           HN       ARG  43  -4.106   9.598   3.548
  283    HA   ARG  43           HA       ARG  43  -6.879  10.445   3.356
  284    HB2  ARG  43           HB2      ARG  43  -7.080   9.482   1.030
  285    HB3  ARG  43           HB1      ARG  43  -6.264  11.030   1.166
  286    HG2  ARG  43           HG2      ARG  43  -4.118   9.985   0.893
  287    HG3  ARG  43           HG1      ARG  43  -4.854   8.381   0.937
  288    HD2  ARG  43           HD2      ARG  43  -5.397  10.493  -1.146
  289    HD3  ARG  43           HD1      ARG  43  -4.310   9.121  -1.355
  290    HE   ARG  43           HE       ARG  43  -6.651   7.952  -0.659
  291   HH11  ARG  43          HH11      ARG  43  -5.750  10.260  -3.129
  292   HH12  ARG  43          HH12      ARG  43  -7.002   9.768  -4.224
  293   HH21  ARG  43          HH21      ARG  43  -8.291   7.290  -2.106
  294   HH22  ARG  43          HH22      ARG  43  -8.446   8.087  -3.643
  295    H    THR  44           HN       THR  44  -7.238   9.048   5.006
  296    HA   THR  44           HA       THR  44  -7.816   7.117   6.046
  297    HB   THR  44           HB       THR  44  -9.113   5.508   4.597
  298    HG1  THR  44           HG1      THR  44  -7.792   6.558   2.653
  299   HG21  THR  44          HG21      THR  44  -9.844   8.431   4.416
  300   HG22  THR  44          HG22      THR  44 -10.177   7.370   5.782
  301   HG23  THR  44          HG23      THR  44 -10.954   7.076   4.228
  302    HA   PRO  45           HA       PRO  45  -4.174   4.522   4.907
  303    HB2  PRO  45           HB2      PRO  45  -3.281   4.868   7.637
  304    HB3  PRO  45           HB1      PRO  45  -2.489   5.387   6.146
  305    HG2  PRO  45           HG2      PRO  45  -3.547   7.122   7.977
  306    HG3  PRO  45           HG1      PRO  45  -3.388   7.489   6.249
  307    HD2  PRO  45           HD2      PRO  45  -5.802   6.582   7.784
  308    HD3  PRO  45           HD1      PRO  45  -5.679   7.816   6.505
  309    H    TRP  46           HN       TRP  46  -6.594   4.520   7.334
  310    HA   TRP  46           HA       TRP  46  -6.021   1.748   8.107
  311    HB2  TRP  46           HB2      TRP  46  -7.944   2.243   9.783
  312    HB3  TRP  46           HB1      TRP  46  -6.377   2.999  10.064
  313    HD1  TRP  46           HD1      TRP  46  -9.918   3.862   8.803
  314    HE1  TRP  46           HE1      TRP  46 -10.264   6.400   9.043
  315    HE3  TRP  46           HE3      TRP  46  -5.197   5.201  10.265
  316    HZ2  TRP  46           HZ2      TRP  46  -8.744   8.660   9.742
  317    HZ3  TRP  46           HZ3      TRP  46  -4.733   7.580  10.698
  318    HH2  TRP  46           HH2      TRP  46  -6.468   9.269  10.440
  319    H    ASN  47           HN       ASN  47  -6.876   2.145   5.539
  320    HA   ASN  47           HA       ASN  47  -9.437   0.750   5.538
  321    HB2  ASN  47           HB2      ASN  47 -10.079   3.082   5.178
  322    HB3  ASN  47           HB1      ASN  47  -8.851   3.261   3.933
  323   HD21  ASN  47          HD21      ASN  47 -11.972   1.909   4.707
  324   HD22  ASN  47          HD22      ASN  47 -12.439   1.571   3.076
  325    H    CYS  48           HN       CYS  48  -9.242  -1.012   4.208
  326    HA   CYS  48           HA       CYS  48  -6.946  -0.989   2.390
  327    HB2  CYS  48           HB2      CYS  48  -7.202  -2.880   4.083
  328    HB3  CYS  48           HB1      CYS  48  -8.608  -3.408   3.161
  329    H    ILE  49           HN       ILE  49  -7.289  -0.645   0.310
  330    HA   ILE  49           HA       ILE  49  -9.984  -0.598  -0.714
  331    HB   ILE  49           HB       ILE  49  -8.833   0.065  -2.891
  332   HG12  ILE  49          HG12      ILE  49  -6.446   0.358  -1.066
  333   HG13  ILE  49          HG11      ILE  49  -6.607  -0.882  -2.305
  334   HG21  ILE  49          HG21      ILE  49  -9.891   1.701  -1.475
  335   HG22  ILE  49          HG22      ILE  49  -8.372   2.356  -2.085
  336   HG23  ILE  49          HG23      ILE  49  -8.473   1.764  -0.428
  337   HD11  ILE  49          HD11      ILE  49  -5.205   0.959  -3.053
  338   HD12  ILE  49          HD12      ILE  49  -6.530   2.092  -2.776
  339   HD13  ILE  49          HD13      ILE  49  -6.677   0.851  -4.020
  340    H    PHE  50           HN       PHE  50  -7.369  -2.826  -0.729
  341    HA   PHE  50           HA       PHE  50  -8.254  -4.149  -3.152
  342    HB2  PHE  50           HB2      PHE  50  -5.926  -4.533  -1.327
  343    HB3  PHE  50           HB1      PHE  50  -6.469  -5.908  -2.298
  344    HD1  PHE  50           HD2      PHE  50  -5.129  -2.486  -2.428
  345    HD2  PHE  50           HD1      PHE  50  -6.192  -5.945  -4.662
  346    HE1  PHE  50           HE2      PHE  50  -3.985  -1.563  -4.394
  347    HE2  PHE  50           HE1      PHE  50  -5.049  -5.027  -6.635
  348    HZ   PHE  50           HZ       PHE  50  -3.945  -2.831  -6.504
  349    H    CYS  51           HN       CYS  51  -8.558  -4.513   0.299
  350    HA   CYS  51           HA       CYS  51  -9.625  -7.128   0.295
  351    HB2  CYS  51           HB2      CYS  51  -9.548  -4.860   2.210
  352    HB3  CYS  51           HB1      CYS  51 -10.779  -6.087   2.479
  353    H    ARG  52           HN       ARG  52 -10.978  -4.044  -0.530
  354    HA   ARG  52           HA       ARG  52 -13.678  -5.147  -0.395
  355    HB2  ARG  52           HB2      ARG  52 -12.731  -2.295  -0.717
  356    HB3  ARG  52           HB1      ARG  52 -14.412  -2.799  -0.658
  357    HG2  ARG  52           HG2      ARG  52 -14.100  -3.624   1.616
  358    HG3  ARG  52           HG1      ARG  52 -12.400  -3.154   1.556
  359    HD2  ARG  52           HD2      ARG  52 -13.821  -1.519   2.744
  360    HD3  ARG  52           HD1      ARG  52 -13.002  -0.833   1.342
  361    HE   ARG  52           HE       ARG  52 -15.397  -1.565   0.336
  362   HH11  ARG  52          HH11      ARG  52 -14.557   0.229   3.220
  363   HH12  ARG  52          HH12      ARG  52 -15.913   1.305   3.099
  364   HH21  ARG  52          HH21      ARG  52 -17.198  -0.170   0.185
  365   HH22  ARG  52          HH22      ARG  52 -17.421   1.073   1.377
  366    H    MET  53           HN       MET  53 -11.475  -5.515  -2.526
  367    HA   MET  53           HA       MET  53 -12.294  -4.298  -4.898
  368    HB2  MET  53           HB2      MET  53 -11.067  -5.999  -6.082
  369    HB3  MET  53           HB1      MET  53 -10.172  -5.570  -4.634
  370    HG2  MET  53           HG2      MET  53 -10.790  -7.586  -3.548
  371    HG3  MET  53           HG1      MET  53 -11.977  -7.969  -4.793
  372    HE1  MET  53           HE1      MET  53  -8.189  -7.696  -3.878
  373    HE2  MET  53           HE2      MET  53  -8.284  -6.601  -5.257
  374    HE3  MET  53           HE3      MET  53  -7.401  -8.121  -5.396
  375    H    LYS  54           HN       LYS  54 -13.606  -7.038  -3.198
  376    HA   LYS  54           HA       LYS  54 -15.400  -8.379  -3.539
  377    HB2  LYS  54           HB2      LYS  54 -16.437  -6.145  -3.154
  378    HB3  LYS  54           HB1      LYS  54 -16.493  -5.909  -4.893
  379    HG2  LYS  54           HG2      LYS  54 -17.973  -7.855  -5.107
  380    HG3  LYS  54           HG1      LYS  54 -17.947  -8.053  -3.353
  381    HD2  LYS  54           HD2      LYS  54 -18.887  -5.780  -3.119
  382    HD3  LYS  54           HD1      LYS  54 -18.992  -5.667  -4.877
  383    HE2  LYS  54           HE2      LYS  54 -20.484  -7.625  -4.887
  384    HE3  LYS  54           HE1      LYS  54 -20.402  -7.680  -3.126
  385    HZ1  LYS  54           HZ1      LYS  54 -22.396  -6.563  -3.833
  386    HZ2  LYS  54           HZ2      LYS  54 -21.508  -5.459  -4.756
  387    HZ3  LYS  54           HZ3      LYS  54 -21.374  -5.450  -3.072
  388    H    GLU  55           HN       GLU  55 -14.054  -9.627  -5.066
  389    HA   GLU  55           HA       GLU  55 -15.370  -9.716  -7.679
  390    HB2  GLU  55           HB2      GLU  55 -12.400  -9.717  -7.201
  391    HB3  GLU  55           HB1      GLU  55 -13.115 -10.355  -8.671
  392    HG2  GLU  55           HG2      GLU  55 -14.193  -8.096  -8.981
  393    HG3  GLU  55           HG1      GLU  55 -13.156  -7.525  -7.673
  394    H    SER  56           HN       SER  56 -16.022 -11.692  -8.209
  395    HA   SER  56           HA       SER  56 -15.514 -13.906  -6.485
  396    HB2  SER  56           HB2      SER  56 -16.826 -15.147  -8.299
  397    HB3  SER  56           HB1      SER  56 -17.664 -13.821  -7.496
  398    HG   SER  56           HG       SER  56 -16.238 -13.498  -9.926
  Start of MODEL   20
    1    H1   GLY   1           HT1      GLY   1   6.278 -16.033   6.967
    2    H2   GLY   1           HT2      GLY   1   7.758 -15.843   7.759
    3    H3   GLY   1           HT3      GLY   1   7.709 -16.530   6.216
    4    HA2  GLY   1           HA1      GLY   1   8.482 -14.260   6.093
    5    HA3  GLY   1           HA2      GLY   1   6.939 -14.455   5.276
    6    H    ALA   2           HN       ALA   2   5.842 -12.644   5.551
    7    HA   ALA   2           HA       ALA   2   4.654 -10.978   6.518
    8    HB1  ALA   2           HB1      ALA   2   4.042 -11.100   8.882
    9    HB2  ALA   2           HB2      ALA   2   5.213 -12.397   9.121
   10    HB3  ALA   2           HB3      ALA   2   3.816 -12.651   8.077
   11    H    MET   3           HN       MET   3   7.086 -11.567   9.046
   12    HA   MET   3           HA       MET   3   7.829  -8.740   8.894
   13    HB2  MET   3           HB2      MET   3   7.257  -9.810  11.095
   14    HB3  MET   3           HB1      MET   3   8.674 -10.829  10.914
   15    HG2  MET   3           HG2      MET   3  10.110  -8.854  10.939
   16    HG3  MET   3           HG1      MET   3   8.689  -7.824  11.106
   17    HE1  MET   3           HE1      MET   3  11.295  -7.876  13.031
   18    HE2  MET   3           HE2      MET   3  10.529  -7.680  14.607
   19    HE3  MET   3           HE3      MET   3   9.969  -6.730  13.230
   20    H    GLY   4           HN       GLY   4   8.567 -10.905   6.955
   21    HA2  GLY   4           HA2      GLY   4  11.496 -10.556   7.103
   22    HA3  GLY   4           HA1      GLY   4  10.761 -12.059   6.559
   23    H    MET   5           HN       MET   5   9.598  -8.845   5.785
   24    HA   MET   5           HA       MET   5  10.542  -9.204   3.028
   25    HB2  MET   5           HB2      MET   5   8.147  -9.819   3.168
   26    HB3  MET   5           HB1      MET   5   7.790  -8.227   3.820
   27    HG2  MET   5           HG2      MET   5   8.590  -7.204   1.741
   28    HG3  MET   5           HG1      MET   5   8.916  -8.807   1.089
   29    HE1  MET   5           HE1      MET   5   5.311 -10.322   0.851
   30    HE2  MET   5           HE2      MET   5   6.394 -10.449   2.236
   31    HE3  MET   5           HE3      MET   5   7.033 -10.605   0.601
   32    H    ARG   6           HN       ARG   6  12.229  -7.763   3.761
   33    HA   ARG   6           HA       ARG   6  11.355  -4.993   4.135
   34    HB2  ARG   6           HB2      ARG   6  14.077  -6.261   4.460
   35    HB3  ARG   6           HB1      ARG   6  13.747  -4.549   4.672
   36    HG2  ARG   6           HG2      ARG   6  12.477  -6.746   6.292
   37    HG3  ARG   6           HG1      ARG   6  13.888  -5.815   6.793
   38    HD2  ARG   6           HD2      ARG   6  11.993  -4.844   7.856
   39    HD3  ARG   6           HD1      ARG   6  12.481  -3.744   6.569
   40    HE   ARG   6           HE       ARG   6  10.429  -5.623   5.804
   41   HH11  ARG   6          HH11      ARG   6  11.058  -2.502   7.263
   42   HH12  ARG   6          HH12      ARG   6   9.500  -1.858   6.850
   43   HH21  ARG   6          HH21      ARG   6   8.386  -4.770   5.250
   44   HH22  ARG   6          HH22      ARG   6   7.986  -3.143   5.713
   45    H    ASN   7           HN       ASN   7  10.643  -4.869   1.924
   46    HA   ASN   7           HA       ASN   7  12.871  -4.134   0.177
   47    HB2  ASN   7           HB2      ASN   7  12.084  -6.416  -0.464
   48    HB3  ASN   7           HB1      ASN   7  10.501  -5.721  -0.813
   49   HD21  ASN   7          HD21      ASN   7  10.574  -6.207  -3.012
   50   HD22  ASN   7          HD22      ASN   7  11.636  -5.387  -4.108
   51    H    LEU   8           HN       LEU   8  11.709  -2.227   1.487
   52    HA   LEU   8           HA       LEU   8   9.798  -1.022  -0.378
   53    HB2  LEU   8           HB2      LEU   8   9.671   0.819   1.359
   54    HB3  LEU   8           HB1      LEU   8   8.992  -0.733   1.803
   55    HG   LEU   8           HG       LEU   8  11.250  -1.155   2.983
   56   HD11  LEU   8          HD11      LEU   8  12.439   0.807   3.734
   57   HD12  LEU   8          HD12      LEU   8  11.353   1.851   2.820
   58   HD13  LEU   8          HD13      LEU   8  12.438   0.751   1.971
   59   HD21  LEU   8          HD21      LEU   8  10.450  -0.041   4.999
   60   HD22  LEU   8          HD22      LEU   8   9.129  -0.824   4.131
   61   HD23  LEU   8          HD23      LEU   8   9.339   0.925   4.029
   62    H    ASP   9           HN       ASP   9  12.714  -1.540  -0.629
   63    HA   ASP   9           HA       ASP   9  13.960   1.065  -0.739
   64    HB2  ASP   9           HB2      ASP   9  14.906  -1.679  -1.569
   65    HB3  ASP   9           HB1      ASP   9  15.868  -0.224  -1.801
   66    H    GLU  10           HN       GLU  10  12.221  -1.039  -2.816
   67    HA   GLU  10           HA       GLU  10  12.978   0.434  -5.209
   68    HB2  GLU  10           HB2      GLU  10  10.982  -1.816  -4.879
   69    HB3  GLU  10           HB1      GLU  10  11.550  -1.150  -6.403
   70    HG2  GLU  10           HG2      GLU  10  13.833  -1.899  -5.841
   71    HG3  GLU  10           HG1      GLU  10  13.196  -2.646  -4.377
   72    H    CYS  11           HN       CYS  11  11.002   0.902  -2.692
   73    HA   CYS  11           HA       CYS  11   8.835   2.128  -4.243
   74    HB2  CYS  11           HB2      CYS  11   8.312   0.403  -2.464
   75    HB3  CYS  11           HB1      CYS  11   8.907   1.555  -1.281
   76    H    GLU  12           HN       GLU  12   9.811   4.055  -4.783
   77    HA   GLU  12           HA       GLU  12  11.460   5.593  -3.125
   78    HB2  GLU  12           HB2      GLU  12   9.700   6.569  -5.373
   79    HB3  GLU  12           HB1      GLU  12  11.122   7.380  -4.734
   80    HG2  GLU  12           HG2      GLU  12  12.537   5.571  -5.533
   81    HG3  GLU  12           HG1      GLU  12  11.118   4.715  -6.136
   82    H    VAL  13           HN       VAL  13   8.016   5.493  -3.555
   83    HA   VAL  13           HA       VAL  13   7.423   7.903  -2.216
   84    HB   VAL  13           HB       VAL  13   5.804   6.954  -3.714
   85   HG11  VAL  13          HG11      VAL  13   4.642   4.894  -3.313
   86   HG12  VAL  13          HG12      VAL  13   5.529   4.641  -1.814
   87   HG13  VAL  13          HG13      VAL  13   6.374   4.587  -3.360
   88   HG21  VAL  13          HG21      VAL  13   3.787   6.975  -2.315
   89   HG22  VAL  13          HG22      VAL  13   4.894   8.287  -1.916
   90   HG23  VAL  13          HG23      VAL  13   4.803   6.865  -0.878
   91    H    CYS  14           HN       CYS  14   7.909   4.605  -1.074
   92    HA   CYS  14           HA       CYS  14   7.000   5.077   1.571
   93    HB2  CYS  14           HB2      CYS  14   8.419   2.923   0.186
   94    HB3  CYS  14           HB1      CYS  14   8.815   3.081   1.893
   95    H    ARG  15           HN       ARG  15   9.977   5.677  -0.066
   96    HA   ARG  15           HA       ARG  15  11.605   6.145   2.199
   97    HB2  ARG  15           HB2      ARG  15  11.727   7.254  -0.603
   98    HB3  ARG  15           HB1      ARG  15  12.957   7.566   0.613
   99    HG2  ARG  15           HG2      ARG  15  13.550   5.264   0.714
  100    HG3  ARG  15           HG1      ARG  15  12.173   4.810  -0.291
  101    HD2  ARG  15           HD2      ARG  15  14.273   4.813  -1.558
  102    HD3  ARG  15           HD1      ARG  15  13.129   6.001  -2.175
  103    HE   ARG  15           HE       ARG  15  14.885   7.188  -0.293
  104   HH11  ARG  15          HH11      ARG  15  14.802   5.975  -3.579
  105   HH12  ARG  15          HH12      ARG  15  16.017   7.073  -4.152
  106   HH21  ARG  15          HH21      ARG  15  16.497   8.632  -1.051
  107   HH22  ARG  15          HH22      ARG  15  16.984   8.576  -2.715
  108    H    ASP  16           HN       ASP  16   9.391   8.137   0.370
  109    HA   ASP  16           HA       ASP  16   9.869  10.495   1.944
  110    HB2  ASP  16           HB2      ASP  16   7.878   9.759  -0.184
  111    HB3  ASP  16           HB1      ASP  16   7.716  11.258   0.727
  112    H    GLY  17           HN       GLY  17   8.367   7.679   2.685
  113    HA2  GLY  17           HA2      GLY  17   7.437   7.852   5.050
  114    HA3  GLY  17           HA1      GLY  17   6.294   8.982   4.331
  115    H    GLY  18           HN       GLY  18   5.828   7.703   1.944
  116    HA2  GLY  18           HA2      GLY  18   4.280   6.262   1.042
  117    HA3  GLY  18           HA1      GLY  18   5.222   5.039   1.861
  118    H    GLU  19           HN       GLU  19   2.309   6.951   1.929
  119    HA   GLU  19           HA       GLU  19   1.389   5.721   4.382
  120    HB2  GLU  19           HB2      GLU  19  -0.014   7.497   2.376
  121    HB3  GLU  19           HB1      GLU  19  -0.725   6.935   3.884
  122    HG2  GLU  19           HG2      GLU  19   1.749   8.641   3.676
  123    HG3  GLU  19           HG1      GLU  19   0.128   9.249   4.003
  124    H    LEU  20           HN       LEU  20   0.438   3.797   4.457
  125    HA   LEU  20           HA       LEU  20  -0.353   2.523   1.942
  126    HB2  LEU  20           HB2      LEU  20   0.473   1.462   4.619
  127    HB3  LEU  20           HB1      LEU  20  -0.384   0.446   3.478
  128    HG   LEU  20           HG       LEU  20   2.220   1.829   2.828
  129   HD11  LEU  20          HD11      LEU  20   1.745  -0.992   3.784
  130   HD12  LEU  20          HD12      LEU  20   2.558   0.287   4.685
  131   HD13  LEU  20          HD13      LEU  20   3.280  -0.344   3.206
  132   HD21  LEU  20          HD21      LEU  20   0.920   1.201   0.873
  133   HD22  LEU  20          HD22      LEU  20   0.702  -0.429   1.511
  134   HD23  LEU  20          HD23      LEU  20   2.308   0.125   1.041
  135    H    PHE  21           HN       PHE  21  -2.372   1.802   1.571
  136    HA   PHE  21           HA       PHE  21  -4.343   2.085   3.747
  137    HB2  PHE  21           HB2      PHE  21  -4.737   2.713   0.805
  138    HB3  PHE  21           HB1      PHE  21  -6.000   2.786   2.036
  139    HD1  PHE  21           HD1      PHE  21  -5.665   4.391   3.986
  140    HD2  PHE  21           HD2      PHE  21  -3.343   4.558   0.414
  141    HE1  PHE  21           HE1      PHE  21  -5.006   6.691   4.521
  142    HE2  PHE  21           HE2      PHE  21  -2.693   6.864   0.946
  143    HZ   PHE  21           HZ       PHE  21  -3.523   7.936   3.002
  144    H    CYS  22           HN       CYS  22  -3.001  -0.247   3.327
  145    HA   CYS  22           HA       CYS  22  -5.130  -1.993   2.296
  146    HB2  CYS  22           HB2      CYS  22  -2.157  -2.318   1.836
  147    HB3  CYS  22           HB1      CYS  22  -3.400  -3.450   1.310
  148    H    CYS  23           HN       CYS  23  -5.153  -4.140   3.234
  149    HA   CYS  23           HA       CYS  23  -4.429  -4.378   5.956
  150    HB2  CYS  23           HB2      CYS  23  -4.801  -6.720   4.076
  151    HB3  CYS  23           HB1      CYS  23  -5.114  -6.667   5.807
  152    H    ASP  24           HN       ASP  24  -2.794  -5.921   6.844
  153    HA   ASP  24           HA       ASP  24  -0.234  -5.588   5.906
  154    HB2  ASP  24           HB2      ASP  24  -1.326  -7.953   7.444
  155    HB3  ASP  24           HB1      ASP  24   0.384  -7.585   7.251
  156    H    THR  25           HN       THR  25  -2.282  -8.449   5.355
  157    HA   THR  25           HA       THR  25  -0.563  -9.782   3.616
  158    HB   THR  25           HB       THR  25  -3.580  -9.861   3.547
  159    HG1  THR  25           HG1      THR  25  -3.430 -10.833   5.415
  160   HG21  THR  25          HG21      THR  25  -3.249 -12.145   2.705
  161   HG22  THR  25          HG22      THR  25  -1.503 -11.898   2.720
  162   HG23  THR  25          HG23      THR  25  -2.518 -10.954   1.630
  163    H    CYS  26           HN       CYS  26  -3.176  -7.478   2.875
  164    HA   CYS  26           HA       CYS  26  -2.949  -7.695   0.071
  165    HB2  CYS  26           HB2      CYS  26  -4.052  -5.418   1.732
  166    HB3  CYS  26           HB1      CYS  26  -4.300  -5.625   0.002
  167    H    SER  27           HN       SER  27  -1.372  -5.627   2.430
  168    HA   SER  27           HA       SER  27  -0.110  -3.893   0.555
  169    HB2  SER  27           HB2      SER  27  -0.439  -3.266   2.920
  170    HB3  SER  27           HB1      SER  27   0.658  -4.549   3.415
  171    HG   SER  27           HG       SER  27   1.303  -2.289   1.823
  172    H    ARG  28           HN       ARG  28   0.731  -6.966   2.009
  173    HA   ARG  28           HA       ARG  28   3.462  -6.929   1.178
  174    HB2  ARG  28           HB2      ARG  28   1.623  -9.051   2.249
  175    HB3  ARG  28           HB1      ARG  28   3.235  -9.455   1.680
  176    HG2  ARG  28           HG2      ARG  28   4.272  -8.223   3.367
  177    HG3  ARG  28           HG1      ARG  28   2.808  -7.311   3.728
  178    HD2  ARG  28           HD2      ARG  28   3.399  -9.045   5.427
  179    HD3  ARG  28           HD1      ARG  28   1.785  -9.212   4.746
  180    HE   ARG  28           HE       ARG  28   3.621 -10.800   3.293
  181   HH11  ARG  28          HH11      ARG  28   1.955 -10.662   6.363
  182   HH12  ARG  28          HH12      ARG  28   1.960 -12.381   6.590
  183   HH21  ARG  28          HH21      ARG  28   3.636 -13.067   3.588
  184   HH22  ARG  28          HH22      ARG  28   2.912 -13.753   5.011
  185    H    VAL  29           HN       VAL  29   0.465  -7.827  -0.307
  186    HA   VAL  29           HA       VAL  29   1.822  -9.285  -2.425
  187    HB   VAL  29           HB       VAL  29  -1.130  -8.736  -2.087
  188   HG11  VAL  29          HG11      VAL  29  -1.432 -10.509  -3.742
  189   HG12  VAL  29          HG12      VAL  29   0.317 -10.650  -3.915
  190   HG13  VAL  29          HG13      VAL  29  -0.503  -9.169  -4.409
  191   HG21  VAL  29          HG21      VAL  29   0.503 -11.181  -1.420
  192   HG22  VAL  29          HG22      VAL  29  -1.259 -11.095  -1.388
  193   HG23  VAL  29          HG23      VAL  29  -0.307 -10.112  -0.275
  194    H    PHE  30           HN       PHE  30  -0.084  -6.311  -2.016
  195    HA   PHE  30           HA       PHE  30   0.760  -5.522  -4.737
  196    HB2  PHE  30           HB2      PHE  30  -1.764  -4.600  -3.344
  197    HB3  PHE  30           HB1      PHE  30  -1.305  -4.301  -5.015
  198    HD1  PHE  30           HD1      PHE  30  -1.030  -6.459  -6.502
  199    HD2  PHE  30           HD2      PHE  30  -3.218  -6.290  -2.850
  200    HE1  PHE  30           HE1      PHE  30  -2.316  -8.441  -7.178
  201    HE2  PHE  30           HE2      PHE  30  -4.500  -8.274  -3.523
  202    HZ   PHE  30           HZ       PHE  30  -4.050  -9.353  -5.690
  203    H    HIS  31           HN       HIS  31   2.541  -4.895  -2.898
  204    HA   HIS  31           HA       HIS  31   2.059  -2.703  -1.236
  205    HB2  HIS  31           HB2      HIS  31   3.997  -4.189  -0.988
  206    HB3  HIS  31           HB1      HIS  31   4.670  -3.568  -2.491
  207    HD1  HIS  31           HD1      HIS  31   3.845  -2.350   1.027
  208    HD2  HIS  31           HD2      HIS  31   6.267  -1.412  -2.213
  209    HE1  HIS  31           HE1      HIS  31   5.410  -0.504   1.811
  210    H    GLU  32           HN       GLU  32   3.412  -2.770  -4.525
  211    HA   GLU  32           HA       GLU  32   4.059   0.003  -4.552
  212    HB2  GLU  32           HB2      GLU  32   3.696  -1.948  -6.830
  213    HB3  GLU  32           HB1      GLU  32   4.345  -0.325  -7.003
  214    HG2  GLU  32           HG2      GLU  32   6.234  -0.898  -5.607
  215    HG3  GLU  32           HG1      GLU  32   5.572  -2.510  -5.335
  216    H    ASP  33           HN       ASP  33   1.375  -1.882  -5.805
  217    HA   ASP  33           HA       ASP  33   0.085   0.332  -7.060
  218    HB2  ASP  33           HB2      ASP  33  -0.172  -2.140  -7.659
  219    HB3  ASP  33           HB1      ASP  33  -1.234  -2.262  -6.262
  220    H    CYS  34           HN       CYS  34   0.151  -0.951  -3.869
  221    HA   CYS  34           HA       CYS  34  -2.321   0.051  -2.913
  222    HB2  CYS  34           HB2      CYS  34  -0.936  -1.680  -1.722
  223    HB3  CYS  34           HB1      CYS  34   0.216  -0.410  -1.327
  224    H    HIS  35           HN       HIS  35   0.704   1.566  -3.578
  225    HA   HIS  35           HA       HIS  35   0.122   3.860  -1.892
  226    HB2  HIS  35           HB2      HIS  35   2.400   3.286  -3.798
  227    HB3  HIS  35           HB1      HIS  35   2.258   4.762  -2.845
  228    HD1  HIS  35           HD1      HIS  35   2.682   4.521  -0.244
  229    HD2  HIS  35           HD2      HIS  35   3.212   1.036  -2.433
  230    HE1  HIS  35           HE1      HIS  35   3.915   2.910   1.269
  231    H    ILE  36           HN       ILE  36  -1.002   2.835  -4.787
  232    HA   ILE  36           HA       ILE  36  -1.281   5.557  -5.855
  233    HB   ILE  36           HB       ILE  36  -0.715   3.117  -7.537
  234   HG12  ILE  36          HG12      ILE  36   1.136   5.429  -6.909
  235   HG13  ILE  36          HG11      ILE  36   1.243   3.836  -6.170
  236   HG21  ILE  36          HG21      ILE  36  -2.062   4.782  -8.673
  237   HG22  ILE  36          HG22      ILE  36  -0.439   4.741  -9.359
  238   HG23  ILE  36          HG23      ILE  36  -0.898   6.039  -8.258
  239   HD11  ILE  36          HD11      ILE  36   1.556   4.427  -9.105
  240   HD12  ILE  36          HD12      ILE  36   1.707   2.845  -8.340
  241   HD13  ILE  36          HD13      ILE  36   2.867   4.120  -7.966
  242    HA   PRO  37           HA       PRO  37  -2.561   6.780  -5.871
  243    HB2  PRO  37           HB2      PRO  37  -4.878   8.086  -5.722
  244    HB3  PRO  37           HB1      PRO  37  -4.269   7.517  -7.289
  245    HG2  PRO  37           HG2      PRO  37  -6.453   6.419  -5.591
  246    HG3  PRO  37           HG1      PRO  37  -6.298   6.435  -7.356
  247    HD2  PRO  37           HD2      PRO  37  -5.685   4.283  -5.603
  248    HD3  PRO  37           HD1      PRO  37  -5.343   4.376  -7.341
  249    HA   PRO  38           HA       PRO  38  -3.019   6.564  -1.453
  250    HB2  PRO  38           HB2      PRO  38  -1.807   8.868  -0.775
  251    HB3  PRO  38           HB1      PRO  38  -0.901   7.483  -1.398
  252    HG2  PRO  38           HG2      PRO  38  -1.823   9.947  -2.832
  253    HG3  PRO  38           HG1      PRO  38  -0.257   9.119  -2.934
  254    HD2  PRO  38           HD2      PRO  38  -2.248   8.804  -4.788
  255    HD3  PRO  38           HD1      PRO  38  -1.048   7.545  -4.424
  256    H    VAL  39           HN       VAL  39  -4.648   7.085  -0.108
  257    HA   VAL  39           HA       VAL  39  -6.592   9.065  -0.741
  258    HB   VAL  39           HB       VAL  39  -6.144   7.676   1.905
  259   HG11  VAL  39          HG11      VAL  39  -8.506   8.149   2.312
  260   HG12  VAL  39          HG12      VAL  39  -8.595   9.012   0.777
  261   HG13  VAL  39          HG13      VAL  39  -7.579   9.630   2.078
  262   HG21  VAL  39          HG21      VAL  39  -6.433   5.998   0.209
  263   HG22  VAL  39          HG22      VAL  39  -7.824   6.853  -0.454
  264   HG23  VAL  39          HG23      VAL  39  -7.921   6.118   1.146
  265    H    GLU  40           HN       GLU  40  -5.968  11.156  -0.723
  266    HA   GLU  40           HA       GLU  40  -3.615  11.903   0.704
  267    HB2  GLU  40           HB2      GLU  40  -4.058  12.716  -1.560
  268    HB3  GLU  40           HB1      GLU  40  -5.474  13.582  -0.981
  269    HG2  GLU  40           HG2      GLU  40  -4.088  15.015   0.378
  270    HG3  GLU  40           HG1      GLU  40  -2.649  14.116  -0.094
  271    H    ALA  41           HN       ALA  41  -7.040  12.828   1.012
  272    HA   ALA  41           HA       ALA  41  -6.339  14.754   3.065
  273    HB1  ALA  41           HB1      ALA  41  -9.042  14.056   1.935
  274    HB2  ALA  41           HB2      ALA  41  -7.998  15.363   1.382
  275    HB3  ALA  41           HB3      ALA  41  -8.677  15.406   3.007
  276    H    GLU  42           HN       GLU  42  -8.553  11.972   2.843
  277    HA   GLU  42           HA       GLU  42  -9.216  12.055   5.590
  278    HB2  GLU  42           HB2      GLU  42  -9.572   9.900   3.509
  279    HB3  GLU  42           HB1      GLU  42 -10.198   9.777   5.148
  280    HG2  GLU  42           HG2      GLU  42 -10.901  11.974   3.217
  281    HG3  GLU  42           HG1      GLU  42 -11.873  10.529   3.494
  282    H    ARG  43           HN       ARG  43  -6.943  10.082   3.743
  283    HA   ARG  43           HA       ARG  43  -5.372   8.547   4.363
  284    HB2  ARG  43           HB2      ARG  43  -4.968  10.614   6.528
  285    HB3  ARG  43           HB1      ARG  43  -3.816   9.351   6.114
  286    HG2  ARG  43           HG2      ARG  43  -3.779  10.318   3.785
  287    HG3  ARG  43           HG1      ARG  43  -4.679  11.689   4.437
  288    HD2  ARG  43           HD2      ARG  43  -2.887  12.131   6.023
  289    HD3  ARG  43           HD1      ARG  43  -2.000  10.727   5.430
  290    HE   ARG  43           HE       ARG  43  -2.603  12.586   3.347
  291   HH11  ARG  43          HH11      ARG  43  -0.404  11.963   5.998
  292   HH12  ARG  43          HH12      ARG  43   0.910  12.840   5.284
  293   HH21  ARG  43          HH21      ARG  43  -0.859  13.736   2.392
  294   HH22  ARG  43          HH22      ARG  43   0.651  13.860   3.236
  295    H    THR  44           HN       THR  44  -7.307   7.167   4.958
  296    HA   THR  44           HA       THR  44  -7.463   6.659   7.837
  297    HB   THR  44           HB       THR  44  -9.500   5.319   7.234
  298    HG1  THR  44           HG1      THR  44  -8.776   5.101   4.956
  299   HG21  THR  44          HG21      THR  44  -9.718   7.616   8.025
  300   HG22  THR  44          HG22      THR  44 -10.914   7.291   6.770
  301   HG23  THR  44          HG23      THR  44  -9.467   8.221   6.389
  302    HA   PRO  45           HA       PRO  45  -4.817   3.133   6.834
  303    HB2  PRO  45           HB2      PRO  45  -4.891   2.602   9.714
  304    HB3  PRO  45           HB1      PRO  45  -3.513   3.007   8.686
  305    HG2  PRO  45           HG2      PRO  45  -4.516   4.728  10.517
  306    HG3  PRO  45           HG1      PRO  45  -3.767   5.266   9.003
  307    HD2  PRO  45           HD2      PRO  45  -6.668   5.058   9.715
  308    HD3  PRO  45           HD1      PRO  45  -5.820   6.310   8.780
  309    H    TRP  46           HN       TRP  46  -7.814   3.172   8.540
  310    HA   TRP  46           HA       TRP  46  -8.053   0.262   8.425
  311    HB2  TRP  46           HB2      TRP  46 -10.242   0.709   9.641
  312    HB3  TRP  46           HB1      TRP  46  -8.775   1.119  10.522
  313    HD1  TRP  46           HD1      TRP  46 -11.743   2.768   8.723
  314    HE1  TRP  46           HE1      TRP  46 -11.965   5.189   9.556
  315    HE3  TRP  46           HE3      TRP  46  -7.497   3.040  11.558
  316    HZ2  TRP  46           HZ2      TRP  46 -10.530   6.978  11.194
  317    HZ3  TRP  46           HZ3      TRP  46  -6.995   5.148  12.725
  318    HH2  TRP  46           HH2      TRP  46  -8.477   7.073  12.544
  319    H    ASN  47           HN       ASN  47  -7.915   1.429   5.968
  320    HA   ASN  47           HA       ASN  47 -10.521   0.761   4.876
  321    HB2  ASN  47           HB2      ASN  47 -10.685   3.192   5.168
  322    HB3  ASN  47           HB1      ASN  47  -9.171   3.412   4.300
  323   HD21  ASN  47          HD21      ASN  47 -10.193   4.739   2.789
  324   HD22  ASN  47          HD22      ASN  47 -11.223   4.096   1.562
  325    H    CYS  48           HN       CYS  48  -9.524  -1.043   4.016
  326    HA   CYS  48           HA       CYS  48  -7.158  -0.802   2.386
  327    HB2  CYS  48           HB2      CYS  48  -7.544  -2.841   3.681
  328    HB3  CYS  48           HB1      CYS  48  -9.070  -3.105   2.850
  329    H    ILE  49           HN       ILE  49  -7.168  -0.189   0.343
  330    HA   ILE  49           HA       ILE  49  -9.604   0.270  -1.033
  331    HB   ILE  49           HB       ILE  49  -8.050   0.806  -2.996
  332   HG12  ILE  49          HG12      ILE  49  -5.979   0.617  -0.799
  333   HG13  ILE  49          HG11      ILE  49  -6.096  -0.476  -2.175
  334   HG21  ILE  49          HG21      ILE  49  -7.896   2.314  -0.390
  335   HG22  ILE  49          HG22      ILE  49  -9.079   2.529  -1.682
  336   HG23  ILE  49          HG23      ILE  49  -7.390   2.962  -1.949
  337   HD11  ILE  49          HD11      ILE  49  -5.528   2.479  -2.294
  338   HD12  ILE  49          HD12      ILE  49  -5.640   1.395  -3.682
  339   HD13  ILE  49          HD13      ILE  49  -4.351   1.181  -2.497
  340    H    PHE  50           HN       PHE  50  -7.285  -2.349  -1.091
  341    HA   PHE  50           HA       PHE  50  -8.238  -3.391  -3.594
  342    HB2  PHE  50           HB2      PHE  50  -6.404  -4.550  -1.496
  343    HB3  PHE  50           HB1      PHE  50  -6.869  -5.427  -2.955
  344    HD1  PHE  50           HD1      PHE  50  -6.197  -4.579  -5.174
  345    HD2  PHE  50           HD2      PHE  50  -4.847  -2.770  -1.570
  346    HE1  PHE  50           HE1      PHE  50  -4.434  -3.411  -6.420
  347    HE2  PHE  50           HE2      PHE  50  -3.085  -1.611  -2.807
  348    HZ   PHE  50           HZ       PHE  50  -2.877  -1.920  -5.237
  349    H    CYS  51           HN       CYS  51  -8.895  -4.047  -0.192
  350    HA   CYS  51           HA       CYS  51 -10.434  -6.381  -0.705
  351    HB2  CYS  51           HB2      CYS  51 -10.138  -4.565   1.663
  352    HB3  CYS  51           HB1      CYS  51 -11.451  -5.737   1.631
  353    H    ARG  52           HN       ARG  52 -11.410  -2.999  -0.039
  354    HA   ARG  52           HA       ARG  52 -14.123  -3.447  -0.634
  355    HB2  ARG  52           HB2      ARG  52 -14.376  -1.045  -0.678
  356    HB3  ARG  52           HB1      ARG  52 -13.318  -1.498   0.648
  357    HG2  ARG  52           HG2      ARG  52 -11.371  -0.894  -0.759
  358    HG3  ARG  52           HG1      ARG  52 -12.491  -0.340  -2.006
  359    HD2  ARG  52           HD2      ARG  52 -12.372   0.719   0.816
  360    HD3  ARG  52           HD1      ARG  52 -11.636   1.495  -0.585
  361    HE   ARG  52           HE       ARG  52 -14.127   1.370  -1.419
  362   HH11  ARG  52          HH11      ARG  52 -12.939   2.196   1.771
  363   HH12  ARG  52          HH12      ARG  52 -14.275   3.243   2.133
  364   HH21  ARG  52          HH21      ARG  52 -15.870   2.769  -0.952
  365   HH22  ARG  52          HH22      ARG  52 -15.937   3.579   0.582
  366    H    MET  53           HN       MET  53 -11.423  -3.194  -2.678
  367    HA   MET  53           HA       MET  53 -12.727  -2.188  -5.007
  368    HB2  MET  53           HB2      MET  53 -10.298  -2.065  -4.771
  369    HB3  MET  53           HB1      MET  53 -10.196  -3.818  -4.717
  370    HG2  MET  53           HG2      MET  53 -11.068  -3.899  -7.022
  371    HG3  MET  53           HG1      MET  53 -11.053  -2.138  -7.061
  372    HE1  MET  53           HE1      MET  53  -8.353  -1.543  -5.371
  373    HE2  MET  53           HE2      MET  53  -8.844  -0.681  -6.828
  374    HE3  MET  53           HE3      MET  53  -7.221  -1.360  -6.710
  375    H    LYS  54           HN       LYS  54 -12.219  -5.362  -3.632
  376    HA   LYS  54           HA       LYS  54 -14.153  -6.449  -5.506
  377    HB2  LYS  54           HB2      LYS  54 -11.896  -6.843  -6.508
  378    HB3  LYS  54           HB1      LYS  54 -11.462  -7.760  -5.072
  379    HG2  LYS  54           HG2      LYS  54 -12.078  -9.272  -6.838
  380    HG3  LYS  54           HG1      LYS  54 -13.296  -9.338  -5.561
  381    HD2  LYS  54           HD2      LYS  54 -14.684  -7.760  -6.882
  382    HD3  LYS  54           HD1      LYS  54 -13.497  -7.860  -8.182
  383    HE2  LYS  54           HE2      LYS  54 -13.897 -10.281  -8.331
  384    HE3  LYS  54           HE1      LYS  54 -15.107 -10.147  -7.054
  385    HZ1  LYS  54           HZ1      LYS  54 -16.170 -10.161  -9.194
  386    HZ2  LYS  54           HZ2      LYS  54 -15.232  -8.862  -9.726
  387    HZ3  LYS  54           HZ3      LYS  54 -16.363  -8.635  -8.492
  388    H    GLU  55           HN       GLU  55 -15.537  -6.609  -3.749
  389    HA   GLU  55           HA       GLU  55 -14.929  -8.820  -1.933
  390    HB2  GLU  55           HB2      GLU  55 -14.461  -6.787  -0.661
  391    HB3  GLU  55           HB1      GLU  55 -16.053  -6.155  -1.056
  392    HG2  GLU  55           HG2      GLU  55 -17.081  -8.009   0.182
  393    HG3  GLU  55           HG1      GLU  55 -15.475  -8.601   0.604
  394    H    SER  56           HN       SER  56 -16.382 -10.273  -2.543
  395    HA   SER  56           HA       SER  56 -19.185  -9.581  -2.299
  396    HB2  SER  56           HB2      SER  56 -19.660 -10.859  -4.463
  397    HB3  SER  56           HB1      SER  56 -18.979  -9.242  -4.632
  398    HG   SER  56           HG       SER  56 -16.895 -10.308  -4.813