*HEADER    IMMUNORECEPTOR                          11-APR-97   1AH1      
*TITLE     CTLA-4, NMR, 20 STRUCTURES                                    
*COMPND    MOL_ID: 1;                                                    
*COMPND   2 MOLECULE: CTLA-4;                                            
*COMPND   3 CHAIN: NULL;                                                 
*COMPND   4 FRAGMENT: EXTRACELLULAR N-TERMINAL IMMUNOGLOBULIN V-LIKE;    
*COMPND   5 SYNONYM: CD152;                                              
*COMPND   6 ENGINEERED: YES;                                             
*COMPND   7 BIOLOGICAL_UNIT: HOMODIMER;                                  
*COMPND   8 OTHER_DETAILS: TETRASACCHARIDE CORE                          
*COMPND   9 (GLCNAC, GLCNAC, FUCOSE, MANNOSE) ATTACHED AT N 78           
*COMPND  10 AND N 111                                                    
*SOURCE    MOL_ID: 1;                                                    
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                           
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                      
*SOURCE   4 EXPRESSION_SYSTEM: CHINESE HAMSTER OVARY CELLS (CHO),        
*SOURCE   5 CRICETULUS GRISEUS                                           
*KEYWDS    IMMUNORECEPTOR, T CELL RECEPTOR, IMMUNE RESPONSE,             
*KEYWDS   2 IMMUNOGLOBULIN                                               
*EXPDTA    NMR, 20 STRUCTURES                                            
*AUTHOR    W.J.METZLER,J.BAJORATH,W.FENDERSON,S.-Y.SHAW,R.PEACH,         
*AUTHOR   2 K.L.CONSTANTINE,J.NAEMURA,G.LEYTZE,T.B.LAVOIE,L.MUELLER,     
*AUTHOR   3 P.S.LINSLEY                                                  
*REVDAT   1   12-OCT-04 1AH1    0   

!  angle restraints for phi
!
assign (resid   2 and name c )  (resid   3 and name n )
       (resid   3 and name ca)  (resid   3 and name c )  10.0 -120.0 40.0 2 ! 8.3
assign (resid   8 and name c )  (resid   9 and name n )
       (resid   9 and name ca)  (resid   9 and name c )  10.0 -120.0 40.0 2 ! 8.0
assign (resid   9 and name c )  (resid  10 and name n )
       (resid  10 and name ca)  (resid  10 and name c )  10.0 -120.0 40.0 2 ! 8.0
assign (resid  15 and name c )  (resid  16 and name n )
       (resid  16 and name ca)  (resid  16 and name c )  10.0 -120.0 40.0 2 ! 8.1
assign (resid  16 and name c )  (resid  17 and name n )
       (resid  17 and name ca)  (resid  17 and name c )  10.0 -120.0 40.0 2 ! 8.3
assign (resid  17 and name c )  (resid  18 and name n )
       (resid  18 and name ca)  (resid  18 and name c )  10.0 -120.0 40.0 2 ! 8.0
assign (resid  20 and name c )  (resid  21 and name n )
       (resid  21 and name ca)  (resid  21 and name c )  10.0 -120.0 40.0 2 ! 8.6
assign (resid  21 and name c )  (resid  22 and name n )
       (resid  22 and name ca)  (resid  22 and name c )  10.0 -120.0 40.0 2 ! 8.6
assign (resid  22 and name c )  (resid  23 and name n )
       (resid  23 and name ca)  (resid  23 and name c )  10.0 -120.0 40.0 2 ! 8.0
assign (resid  29 and name c )  (resid  30 and name n )
       (resid  30 and name ca)  (resid  30 and name c )  10.0 -120.0 40.0 2 ! 8.9
assign (resid  30 and name c )  (resid  31 and name n )
       (resid  31 and name ca)  (resid  31 and name c )  10.0 -120.0 40.0 2 ! 8.2
assign (resid  31 and name c )  (resid  32 and name n )
       (resid  32 and name ca)  (resid  32 and name c )  10.0 -120.0 40.0 2 ! 8.8
assign (resid  33 and name c )  (resid  34 and name n )
       (resid  34 and name ca)  (resid  34 and name c )  10.0 -120.0 40.0 2 ! 9.4
assign (resid  34 and name c )  (resid  35 and name n )
       (resid  35 and name ca)  (resid  35 and name c )  10.0 -120.0 40.0 2 ! 8.2
assign (resid  36 and name c )  (resid  37 and name n )
       (resid  37 and name ca)  (resid  37 and name c )  10.0 -120.0 40.0 2 ! 9.6
assign (resid  38 and name c )  (resid  39 and name n )
       (resid  39 and name ca)  (resid  39 and name c )  10.0 -120.0 40.0 2 ! 8.8
assign (resid  43 and name c )  (resid  44 and name n )
       (resid  44 and name ca)  (resid  44 and name c )  10.0 -120.0 40.0 2 ! 8.8
assign (resid  44 and name c )  (resid  45 and name n )
       (resid  45 and name ca)  (resid  45 and name c )  10.0 -120.0 40.0 2 ! 8.0
assign (resid  45 and name c )  (resid  46 and name n )
       (resid  46 and name ca)  (resid  46 and name c )  10.0 -120.0 40.0 2 ! 8.2
assign (resid  46 and name c )  (resid  47 and name n )
       (resid  47 and name ca)  (resid  47 and name c )  10.0 -120.0 40.0 2 ! 8.6
assign (resid  50 and name c )  (resid  51 and name n )
       (resid  51 and name ca)  (resid  51 and name c )  10.0 -120.0 40.0 2 ! 9.5
assign (resid  55 and name c )  (resid  56 and name n )
       (resid  56 and name ca)  (resid  56 and name c )  10.0 -120.0 40.0 2 ! 8.2
assign (resid  58 and name c )  (resid  59 and name n )
       (resid  59 and name ca)  (resid  59 and name c )  10.0 -120.0 40.0 2 ! 8.1
assign (resid  68 and name c )  (resid  69 and name n )
       (resid  69 and name ca)  (resid  69 and name c )  10.0 -120.0 40.0 2 ! 9.7
assign (resid  75 and name c )  (resid  76 and name n )
       (resid  76 and name ca)  (resid  76 and name c )  10.0 -120.0 40.0 2 ! 8.0
assign (resid  76 and name c )  (resid  77 and name n )
       (resid  77 and name ca)  (resid  77 and name c )  10.0 -120.0 40.0 2 ! 8.5
assign (resid  77 and name c )  (resid  78 and name n )
       (resid  78 and name ca)  (resid  78 and name c )  10.0 -120.0 40.0 2 ! 8.0
assign (resid  78 and name c )  (resid  79 and name n )
       (resid  79 and name ca)  (resid  79 and name c )  10.0 -120.0 40.0 2 ! 8.0
assign (resid  79 and name c )  (resid  80 and name n )
       (resid  80 and name ca)  (resid  80 and name c )  10.0 -120.0 40.0 2 ! 8.9
assign (resid  80 and name c )  (resid  81 and name n )
       (resid  81 and name ca)  (resid  81 and name c )  10.0 -120.0 40.0 2 ! 8.5
assign (resid  83 and name c )  (resid  84 and name n )
       (resid  84 and name ca)  (resid  84 and name c )  10.0  -60.0 40.0 2 ! <5.0
assign (resid  85 and name c )  (resid  86 and name n )
       (resid  86 and name ca)  (resid  86 and name c )  10.0  -60.0 40.0 2 ! <5.0
assign (resid  86 and name c )  (resid  87 and name n )
       (resid  87 and name ca)  (resid  87 and name c )  10.0  -60.0 40.0 2 ! <5.0
assign (resid  87 and name c )  (resid  88 and name n )
       (resid  88 and name ca)  (resid  88 and name c )  10.0  -60.0 40.0 2 ! 5.6 
assign (resid  93 and name c )  (resid  94 and name n )
       (resid  94 and name ca)  (resid  94 and name c )  10.0 -120.0 40.0 2 ! 8.5
assign (resid  95 and name c )  (resid  96 and name n )
       (resid  96 and name ca)  (resid  96 and name c )  10.0 -120.0 40.0 2 ! 8.1
assign (resid  98 and name c )  (resid  99 and name n )
       (resid  99 and name ca)  (resid  99 and name c )  10.0 -120.0 40.0 2 ! 8.8
assign (resid 105 and name c )  (resid 106 and name n )
       (resid 106 and name ca)  (resid 106 and name c )  10.0 -120.0 40.0 2 ! 8.0
assign (resid 108 and name c )  (resid 109 and name n )
       (resid 109 and name ca)  (resid 109 and name c )  10.0 -120.0 40.0 2 ! 8.1
assign (resid 114 and name c )  (resid 115 and name n )
       (resid 115 and name ca)  (resid 115 and name c )  10.0 -120.0 40.0 2 ! 8.2
assign (resid 115 and name c )  (resid 116 and name n )
       (resid 116 and name ca)  (resid 116 and name c )  10.0 -120.0 40.0 2 ! 8.0
!
! chi 1 restraints for VAL, ILE and THR derived from CO-CH3 and N-CH3 J-values and noes
!
! THR
assign (resid  30 and name n )  (resid  30 and name ca)
       (resid  30 and name cb)  (resid  30 and name og1)  10.0   60.0 30.0 2 !
assign (resid  35 and name n )  (resid  35 and name ca)
       (resid  35 and name cb)  (resid  35 and name og1)  10.0  -60.0 30.0 2 !
assign (resid  45 and name n )  (resid  45 and name ca)
       (resid  45 and name cb)  (resid  45 and name og1)  10.0   60.0 30.0 2 !
assign (resid  51 and name n )  (resid  51 and name ca)
       (resid  51 and name cb)  (resid  51 and name og1)  10.0  -60.0 30.0 2 !
assign (resid  59 and name n )  (resid  59 and name ca)
       (resid  59 and name cb)  (resid  59 and name og1)  10.0   60.0 30.0 2 !
assign (resid  69 and name n )  (resid  69 and name ca)
       (resid  69 and name cb)  (resid  69 and name og1)  10.0  180.0 30.0 2 !
assign (resid  71 and name n )  (resid  71 and name ca)
       (resid  71 and name cb)  (resid  71 and name og1)  10.0  -60.0 30.0 2 !
assign (resid  80 and name n )  (resid  80 and name ca)
       (resid  80 and name cb)  (resid  80 and name og1)  10.0  -60.0 30.0 2 !
assign (resid 113 and name n )  (resid 113 and name ca)
       (resid 113 and name cb)  (resid 113 and name og1)  10.0  -60.0 30.0 2 !
! ILE
assign (resid  16 and name n )  (resid  16 and name ca)
       (resid  16 and name cb)  (resid  16 and name cg1)  10.0  -60.0 30.0 2 !
assign (resid  67 and name n )  (resid  67 and name ca)
       (resid  67 and name cb)  (resid  67 and name cg1)  10.0  -60.0 30.0 2 !
assign (resid  81 and name n )  (resid  81 and name ca)
       (resid  81 and name cb)  (resid  81 and name cg1)  10.0  -60.0 30.0 2 !
assign (resid  93 and name n )  (resid  93 and name ca)
       (resid  93 and name cb)  (resid  93 and name cg1)  10.0  -60.0 30.0 2 !
assign (resid 109 and name n )  (resid 109 and name ca)
       (resid 109 and name cb)  (resid 109 and name cg1)  10.0  -60.0 30.0 2 !
assign (resid 115 and name n )  (resid 115 and name ca)
       (resid 115 and name cb)  (resid 115 and name cg1)  10.0  -60.0 30.0 2 !
! VAL
assign (resid   3 and name n )  (resid   3 and name ca)
       (resid   3 and name cb)  (resid   3 and name cg1)  10.0  180.0 30.0 2 !
assign (resid   8 and name n )  (resid   8 and name ca)
       (resid   8 and name cb)  (resid   8 and name cg1)  10.0   60.0 30.0 2 !
assign (resid   9 and name n )  (resid   9 and name ca)
       (resid   9 and name cb)  (resid   9 and name cg1)  10.0  180.0 30.0 2 !
assign (resid  20 and name n )  (resid  20 and name ca)
       (resid  20 and name cb)  (resid  20 and name cg1)  10.0  180.0 30.0 2 !
assign (resid  44 and name n )  (resid  44 and name ca)
       (resid  44 and name cb)  (resid  44 and name cg1)  10.0  180.0 30.0 2 !
assign (resid  47 and name n )  (resid  47 and name ca)
       (resid  47 and name cb)  (resid  47 and name cg1)  10.0  180.0 30.0 2 !
assign (resid  77 and name n )  (resid  77 and name ca)
       (resid  77 and name cb)  (resid  77 and name cg1)  10.0  -60.0 30.0 2 !
! Hydrogen Bond Restraints for CTLA4ex
  assign (resid 108 and name O   ) (resid  96 and name N   ) 3.0 0.4 0.4 ! G-F
  assign (resid 108 and name O   ) (resid  96 and name HN  ) 2.0 0.4 0.4 ! G-F
  assign (resid 108 and name N   ) (resid  96 and name O   ) 3.0 0.4 0.4 ! G-F
  assign (resid 108 and name HN  ) (resid  96 and name O   ) 2.0 0.4 0.4 ! G-F
  assign (resid 113 and name O   ) (resid  92 and name N   ) 3.0 0.4 0.4 ! G-F
  assign (resid 113 and name O   ) (resid  92 and name HN  ) 2.0 0.4 0.4 ! G-F
  assign (resid 113 and name N   ) (resid  92 and name O   ) 3.0 0.4 0.4 ! G-F
  assign (resid 113 and name HN  ) (resid  92 and name O   ) 2.0 0.4 0.4 ! G-F
  assign (resid 115 and name O   ) (resid  90 and name N   ) 3.0 0.4 0.4 ! G-F
  assign (resid 115 and name O   ) (resid  90 and name HN  ) 2.0 0.4 0.4 ! G-F
  assign (resid 115 and name N   ) (resid  90 and name O   ) 3.0 0.4 0.4 ! G-F
  assign (resid 115 and name HN  ) (resid  90 and name O   ) 2.0 0.4 0.4 ! G-F
  assign (resid  97 and name O   ) (resid  33 and name N   ) 3.0 0.4 0.4 ! F-C
  assign (resid  97 and name O   ) (resid  33 and name HN  ) 2.0 0.4 0.4 ! F-C
  assign (resid  97 and name N   ) (resid  33 and name O   ) 3.0 0.4 0.4 ! F-C
  assign (resid  97 and name HN  ) (resid  33 and name O   ) 2.0 0.4 0.4 ! F-C
  assign (resid  95 and name O   ) (resid  35 and name N   ) 3.0 0.4 0.4 ! F-C
  assign (resid  95 and name O   ) (resid  35 and name HN  ) 2.0 0.4 0.4 ! F-C
  assign (resid  95 and name N   ) (resid  35 and name O   ) 3.0 0.4 0.4 ! F-C
  assign (resid  95 and name HN  ) (resid  35 and name O   ) 2.0 0.4 0.4 ! F-C
  assign (resid  93 and name O   ) (resid  37 and name N   ) 3.0 0.4 0.4 ! F-C
  assign (resid  93 and name O   ) (resid  37 and name HN  ) 2.0 0.4 0.4 ! F-C
  assign (resid  93 and name N   ) (resid  37 and name O   ) 3.0 0.4 0.4 ! F-C
  assign (resid  93 and name HN  ) (resid  37 and name O   ) 2.0 0.4 0.4 ! F-C
  assign (resid  91 and name O   ) (resid  39 and name N   ) 3.0 0.4 0.4 ! F-C
  assign (resid  91 and name O   ) (resid  39 and name HN  ) 2.0 0.4 0.4 ! F-C
  assign (resid  32 and name O   ) (resid  52 and name N   ) 3.0 0.4 0.4 ! C-C'
  assign (resid  32 and name O   ) (resid  52 and name HN  ) 2.0 0.4 0.4 ! C-C'
  assign (resid  34 and name N   ) (resid  50 and name O   ) 3.0 0.4 0.4 ! C-C'
  assign (resid  34 and name HN  ) (resid  50 and name O   ) 2.0 0.4 0.4 ! C-C'
  assign (resid  34 and name O   ) (resid  50 and name N   ) 3.0 0.4 0.4 ! C-C'
  assign (resid  34 and name O   ) (resid  50 and name HN  ) 2.0 0.4 0.4 ! C-C'
  assign (resid  36 and name N   ) (resid  48 and name O   ) 3.0 0.4 0.4 ! C-C'
  assign (resid  36 and name HN  ) (resid  48 and name O   ) 2.0 0.4 0.4 ! C-C'
  assign (resid  36 and name O   ) (resid  47 and name N   ) 3.0 0.4 0.4 ! C-C'
  assign (resid  36 and name O   ) (resid  47 and name HN  ) 2.0 0.4 0.4 ! C-C'
  assign (resid  38 and name N   ) (resid  45 and name O   ) 3.0 0.4 0.4 ! C-C'
  assign (resid  38 and name HN  ) (resid  45 and name O   ) 2.0 0.4 0.4 ! C-C'
  assign (resid  38 and name O   ) (resid  45 and name N   ) 3.0 0.4 0.4 ! C-C'
  assign (resid  38 and name O   ) (resid  45 and name HN  ) 2.0 0.4 0.4 ! C-C'
  assign (resid  40 and name N   ) (resid  43 and name O   ) 3.0 0.4 0.4 ! C-C'
  assign (resid  40 and name HN  ) (resid  43 and name O   ) 2.0 0.4 0.4 ! C-C'
  assign (resid  75 and name O   ) (resid  23 and name N   ) 3.0 0.4 0.4 ! B-E
  assign (resid  75 and name O   ) (resid  23 and name HN  ) 2.0 0.4 0.4 ! B-E
  assign (resid  77 and name N   ) (resid  21 and name O   ) 3.0 0.4 0.4 ! B-E
  assign (resid  77 and name HN  ) (resid  21 and name O   ) 2.0 0.4 0.4 ! B-E
  assign (resid  77 and name O   ) (resid  21 and name N   ) 3.0 0.4 0.4 ! B-E
  assign (resid  77 and name O   ) (resid  21 and name HN  ) 2.0 0.4 0.4 ! B-E
  assign (resid  79 and name N   ) (resid  19 and name O   ) 3.0 0.4 0.4 ! B-E
  assign (resid  79 and name HN  ) (resid  19 and name O   ) 2.0 0.4 0.4 ! B-E
  assign (resid  79 and name O   ) (resid  19 and name N   ) 3.0 0.4 0.4 ! B-E
  assign (resid  79 and name O   ) (resid  19 and name HN  ) 2.0 0.4 0.4 ! B-E
  assign (resid  81 and name N   ) (resid  17 and name O   ) 3.0 0.4 0.4 ! B-E
  assign (resid  81 and name HN  ) (resid  17 and name O   ) 2.0 0.4 0.4 ! B-E
  assign (resid  81 and name O   ) (resid  17 and name N   ) 3.0 0.4 0.4 ! B-E
  assign (resid  81 and name O   ) (resid  17 and name HN  ) 2.0 0.4 0.4 ! B-E
  assign (resid  71 and name N   ) (resid  78 and name O   ) 3.0 0.4 0.4 ! D-E
  assign (resid  71 and name HN  ) (resid  78 and name O   ) 2.0 0.4 0.4 ! D-E
  assign (resid  71 and name O   ) (resid  78 and name N   ) 3.0 0.4 0.4 ! D-E
  assign (resid  71 and name O   ) (resid  78 and name HN  ) 2.0 0.4 0.4 ! D-E
  assign (resid  69 and name N   ) (resid  80 and name O   ) 3.0 0.4 0.4 ! D-E
  assign (resid  69 and name HN  ) (resid  80 and name O   ) 2.0 0.4 0.4 ! D-E
! NOE restraints for CTLA4ex structure calculations in XPLOR
  assign (resid   2 and name HB* ) (resid  24 and name HB* ) 2.3 0.5 1.1 
  assign (resid   3 and name HA  ) (resid   3 and name HG* ) 2.0 0.2 1.0 
  assign (resid   3 and name HB  ) (resid   3 and name HG* ) 2.1 0.3 1.0
  assign (resid   3 and name HA  ) (resid  23 and name HA  ) 2.4 0.6 0.6
  assign (resid   3 and name HG* ) (resid  23 and name HA  ) 3.7 1.8 1.4 
  assign (resid   3 and name HG* ) (resid  23 and name HB* ) 2.6 0.8 1.1 
  assign (resid   3 and name HG* ) (resid 108 and name HA* ) 2.4 0.6 1.1 
  assign (resid   4 and name HB* ) (resid  22 and name HB* ) 2.5 0.7 1.1 
  assign (resid   4 and name HB* ) (resid  22 and name HG* ) 2.5 0.7 1.1 
  assign (resid   5 and name HA  ) (resid   5 and name HG* ) 2.3 0.5 0.5 
  assign (resid   5 and name HA  ) (resid   6 and name HD1 ) 2.3 0.5 0.6 
  assign (resid   5 and name HA  ) (resid   6 and name HD2 ) 2.3 0.5 0.6 
  assign (resid   6 and name HA  ) (resid   6 and name HB* ) 2.1 0.3 0.5 
  assign (resid   6 and name HB* ) (resid   6 and name HG* ) 2.5 0.7 0.6 
  assign (resid   6 and name HG* ) (resid   6 and name HD* ) 2.8 1.0 0.6 
  assign (resid   6 and name HG* ) (resid 113 and name HG2*) 2.6 0.8 1.1 
  assign (resid   7 and name HB* ) (resid   8 and name HB  ) 3.0 1.2 1.3 
  assign (resid   7 and name HA  ) (resid 113 and name HA  ) 2.4 0.6 0.6
  assign (resid   7 and name HA  ) (resid 113 and name HG2*) 3.7 1.9 1.4 
  assign (resid   8 and name HA  ) (resid   8 and name HB  ) 2.5 0.7 0.6
  assign (resid   8 and name HA  ) (resid   8 and name HG* ) 2.0 0.2 1.0
  assign (resid   8 and name HG* ) (resid   9 and name HA  ) 2.4 0.6 1.1 
  assign (resid   8 and name HA  ) (resid 113 and name HG2*) 2.9 1.1 1.2 
  assign (resid   8 and name HA  ) (resid 114 and name HB* ) 2.8 1.0 0.8
  assign (resid   8 and name HG1*) (resid 116 and name HD* ) 2.3 0.3 1.1 
  assign (resid   8 and name HG1*) (resid 116 and name HE* ) 2.1 0.3 1.0 
  assign (resid   8 and name HG2*) (resid 116 and name HD* ) 2.3 0.3 1.1 
  assign (resid   8 and name HG2*) (resid 116 and name HE* ) 2.1 0.3 1.0 
  assign (resid   9 and name HA  ) (resid   9 and name HB  ) 2.2 0.4 0.5 
  assign (resid   9 and name HA  ) (resid   9 and name HG* ) 2.2 0.4 1.0 
  assign (resid   9 and name HG* ) (resid  19 and name HA  ) 2.7 0.9 1.2
  assign (resid   9 and name HG* ) (resid  19 and name HB1 ) 2.9 1.1 1.2
  assign (resid   9 and name HG* ) (resid  19 and name HB2 ) 2.9 1.1 1.2
  assign (resid   9 and name HG* ) (resid  19 and name HD* ) 2.3 0.5 1.1
  assign (resid   9 and name HB  ) (resid 113 and name HG2*) 2.2 0.4 1.1
  assign (resid   9 and name HG* ) (resid 113 and name HB  ) 2.9 1.1 1.2
  assign (resid   9 and name HG* ) (resid 113 and name HG2*) 1.8 0.0 1.1
  assign (resid   9 and name HG* ) (resid 115 and name HA  ) 2.4 0.6 1.2
  assign (resid   9 and name HG* ) (resid 115 and name HG1*) 2.1 0.3 1.0
  assign (resid   9 and name HG* ) (resid 115 and name HG2*) 2.1 0.3 1.0
  assign (resid   9 and name HG* ) (resid 115 and name HD1*) 2.7 0.9 1.1
  assign (resid  10 and name HA  ) (resid  10 and name HB* ) 1.9 0.1 0.5
  assign (resid  10 and name HA  ) (resid  10 and name HG  ) 2.9 1.1 0.7
  assign (resid  10 and name HA  ) (resid  10 and name HD* ) 2.1 0.3 1.0
  assign (resid  10 and name HB* ) (resid  10 and name HD* ) 1.9 0.1 1.0
  assign (resid  10 and name HB* ) (resid 116 and name HD* ) 3.2 1.4 1.8
  assign (resid  10 and name HD* ) (resid 116 and name HB1 ) 2.4 0.6 1.1
  assign (resid  10 and name HD* ) (resid 116 and name HB2 ) 2.4 0.6 1.1
  assign (resid  10 and name HD* ) (resid 116 and name HD* ) 2.5 0.7 1.2
  assign (resid  10 and name HD* ) (resid 116 and name HE* ) 2.9 1.1 1.2
  assign (resid  11 and name HB* ) (resid  15 and name HA2 ) 2.2 0.4 1.0
  assign (resid  11 and name HA  ) (resid  17 and name HA  ) 2.7 0.9 0.7
  assign (resid  11 and name HA  ) (resid  17 and name HB* ) 2.5 0.7 1.1
  assign (resid  11 and name HB* ) (resid  17 and name HB* ) 2.2 0.4 1.0
  assign (resid  11 and name HB* ) (resid  84 and name HD* ) 2.4 0.6 1.1
  assign (resid  11 and name HB* ) (resid 115 and name HG2*) 2.3 0.5 1.1
  assign (resid  11 and name HB* ) (resid 115 and name HD1*) 3.1 1.3 1.3
  assign (resid  12 and name HA  ) (resid  12 and name HB* ) 2.0 0.2 0.5
  assign (resid  14 and name HA  ) (resid  14 and name HB* ) 2.1 0.3 0.5
  assign (resid  14 and name HA  ) (resid  14 and name HG* ) 2.4 0.6 0.6
  assign (resid  14 and name HA  ) (resid  14 and name HD* ) 2.5 0.7 0.6
  assign (resid  14 and name HB* ) (resid  14 and name HG* ) 1.9 0.1 0.5
  assign (resid  14 and name HB* ) (resid  14 and name HD* ) 2.2 0.4 0.6
  assign (resid  14 and name HG* ) (resid  14 and name HD* ) 2.1 0.3 0.5
  assign (resid  14 and name HA  ) (resid  16 and name HD1*) 2.9 1.1 0.8
  assign (resid  14 and name HD* ) (resid  16 and name HD1*) 2.7 0.9 0.7
  assign (resid  16 and name HA  ) (resid  16 and name HB  ) 2.9 1.1 0.7
  assign (resid  16 and name HA  ) (resid  16 and name HG1*) 2.4 0.6 1.1
  assign (resid  16 and name HA  ) (resid  16 and name HG2*) 2.1 0.3 1.0
  assign (resid  16 and name HA  ) (resid  16 and name HD1*) 2.1 0.3 1.0
  assign (resid  16 and name HB  ) (resid  16 and name HG1*) 2.5 0.7 1.1 
  assign (resid  16 and name HB  ) (resid  16 and name HD1*) 2.2 0.4 1.1
  assign (resid  16 and name HG2*) (resid  80 and name HA  ) 3.6 1.8 1.4 
  assign (resid  16 and name HG2*) (resid  82 and name HG* ) 2.6 0.8 1.1 
  assign (resid  16 and name HG1*) (resid  82 and name HA  ) 3.0 1.2 1.3 
  assign (resid  16 and name HD1*) (resid  82 and name HB* ) 2.2 0.4 1.1
  assign (resid  16 and name HG1*) (resid  82 and name HG* ) 2.7 0.9 1.2 
  assign (resid  16 and name HD1*) (resid  82 and name HG* ) 2.1 0.3 1.0
  assign (resid  17 and name HB* ) (resid  81 and name HB  ) 2.6 0.8 1.1 
  assign (resid  17 and name HB* ) (resid  81 and name HD1*) 2.4 0.6 1.1
  assign (resid  17 and name HB* ) (resid 115 and name HG1*) 1.9 0.1 1.0
  assign (resid  17 and name HB* ) (resid 115 and name HG2*) 2.2 0.4 1.0 
  assign (resid  17 and name HB* ) (resid 115 and name HD1*) 2.1 0.3 1.0
  assign (resid  18 and name HA  ) (resid  18 and name HB* ) 2.8 1.0 0.7 
  assign (resid  18 and name HA  ) (resid  80 and name HA  ) 2.1 0.3 0.6
  assign (resid  18 and name HB* ) (resid  80 and name HA  ) 2.8 1.0 0.7 
  assign (resid  18 and name HG2*) (resid  80 and name HA  ) 3.4 1.6 0.9
  assign (resid  19 and name HA  ) (resid  19 and name HB* ) 2.2 0.4 0.6 
  assign (resid  19 and name HB* ) (resid  19 and name HD* ) 2.1 0.3 0.5
  assign (resid  19 and name HD* ) (resid  21 and name HB* ) 3.2 1.4 0.8 
  assign (resid  19 and name HE* ) (resid  21 and name HB* ) 3.2 1.4 0.8
  assign (resid  19 and name HZ  ) (resid  36 and name HG* ) 3.2 1.2 1.3 
  assign (resid  19 and name HE* ) (resid  79 and name HD* ) 2.5 0.7 1.1
  assign (resid  19 and name HZ  ) (resid  79 and name HD* ) 3.0 1.2 1.2 
  assign (resid  19 and name HD* ) (resid 113 and name HG2*) 3.7 1.9 1.4
  assign (resid  19 and name HB* ) (resid 113 and name HG2*) 3.7 1.9 1.4 
  assign (resid  19 and name HE* ) (resid 115 and name HD1*) 3.7 1.9 1.4
  assign (resid  19 and name HZ  ) (resid 115 and name HD1*) 2.8 1.0 1.2 
  assign (resid  20 and name HA  ) (resid  20 and name HB  ) 2.3 0.5 0.6 
  assign (resid  20 and name HA  ) (resid  20 and name HG* ) 2.1 0.3 1.1
  assign (resid  20 and name HB  ) (resid  20 and name HG* ) 1.8 0.0 1.1 
  assign (resid  20 and name HG1*) (resid  76 and name HA  ) 3.0 1.2 1.3 
  assign (resid  20 and name HG1*) (resid  76 and name HB* ) 2.6 0.8 1.2
  assign (resid  20 and name HG1*) (resid  76 and name HG* ) 2.4 0.6 1.1 
  assign (resid  20 and name HG2*) (resid  78 and name HA  ) 2.6 0.8 1.1
  assign (resid  20 and name HG2*) (resid  78 and name HB* ) 2.9 1.1 1.2 
  assign (resid  21 and name HB* ) (resid  77 and name HG* ) 2.8 1.0 1.2
  assign (resid  22 and name HA  ) (resid  22 and name HB* ) 2.6 0.8 0.6 
  assign (resid  22 and name HA  ) (resid  22 and name HG* ) 2.5 0.7 0.6
  assign (resid  22 and name HA  ) (resid  76 and name HA  ) 2.1 0.3 0.5 
  assign (resid  22 and name HB* ) (resid  76 and name HA  ) 2.4 0.6 0.6
  assign (resid  23 and name HA  ) (resid  23 and name HB1 ) 2.6 0.8 0.6
  assign (resid  23 and name HA  ) (resid  23 and name HB2 ) 2.6 0.8 0.6
  assign (resid  23 and name HB* ) (resid  23 and name HD* ) 2.6 0.8 0.6
  assign (resid  23 and name HD* ) (resid  25 and name HB* ) 2.9 1.1 0.8
  assign (resid  23 and name HE* ) (resid  25 and name HB* ) 3.0 1.2 0.8 
  assign (resid  23 and name HD* ) (resid  32 and name HG* ) 2.7 0.9 1.2
  assign (resid  23 and name HE* ) (resid  75 and name HA  ) 3.2 1.4 1.8 
  assign (resid  23 and name HB* ) (resid  77 and name HG* ) 2.5 0.7 1.2 
  assign (resid  23 and name HD* ) (resid  77 and name HG1*) 2.4 0.6 1.2 
  assign (resid  23 and name HE* ) (resid  77 and name HG* ) 2.5 0.7 1.1 
  assign (resid  23 and name HB* ) (resid  96 and name HG* ) 2.5 0.7 1.1 
  assign (resid  23 and name HD* ) (resid  96 and name HG1*) 2.5 0.7 1.1
  assign (resid  23 and name HD* ) (resid  96 and name HG2*) 2.5 0.7 1.1 
  assign (resid  23 and name HE* ) (resid  98 and name HD* ) 2.6 0.8 1.2
  assign (resid  25 and name HA  ) (resid  25 and name HB* ) 2.3 0.5 0.6 
  assign (resid  25 and name HA  ) (resid  26 and name HD* ) 2.2 0.4 0.5
  assign (resid  25 and name HB* ) (resid  26 and name HD* ) 2.4 0.6 0.5 
  assign (resid  26 and name HA  ) (resid  26 and name HB* ) 1.9 0.1 0.5
  assign (resid  26 and name HB* ) (resid  26 and name HG* ) 2.0 0.2 0.5 
  assign (resid  26 and name HG* ) (resid  26 and name HD* ) 2.5 0.7 0.6
  assign (resid  28 and name HA  ) (resid  28 and name HB* ) 2.1 0.3 0.5 
  assign (resid  28 and name HA  ) (resid  28 and name HG* ) 2.5 0.7 0.6
  assign (resid  28 and name HB* ) (resid  28 and name HG* ) 1.9 0.1 0.5 
  assign (resid  28 and name HG* ) (resid  28 and name HE* ) 2.8 1.0 0.6
  assign (resid  29 and name HB* ) (resid  32 and name HG* ) 2.3 0.5 1.1 
  assign (resid  29 and name HB* ) (resid  98 and name HB* ) 3.0 1.2 1.4
  assign (resid  29 and name HB* ) (resid  98 and name HD* ) 2.4 0.6 1.1 
  assign (resid  30 and name HA  ) (resid  30 and name HB  ) 2.0 0.2 0.5
  assign (resid  30 and name HA  ) (resid  30 and name HG2*) 2.1 0.3 1.0 
  assign (resid  30 and name HG2*) (resid  31 and name HG2*) 3.0 1.2 1.3
  assign (resid  30 and name HG2*) (resid  53 and name HB* ) 3.2 1.4 1.3 
  assign (resid  30 and name HG2*) (resid  53 and name HE* ) 2.5 0.7 1.1
  assign (resid  31 and name HA  ) (resid  31 and name HB* ) 2.4 0.6 0.6 
  assign (resid  31 and name HA  ) (resid  31 and name HG* ) 2.9 1.1 0.7
  assign (resid  31 and name HB* ) (resid  51 and name HG2*) 2.5 0.7 1.1 
  assign (resid  31 and name HG* ) (resid  51 and name HG2*) 2.8 1.0 1.2 
  assign (resid  31 and name HA  ) (resid  53 and name HA  ) 2.4 0.6 0.7 
  assign (resid  32 and name HA  ) (resid  32 and name HG* ) 2.1 0.3 1.0
  assign (resid  32 and name HB  ) (resid  32 and name HG* ) 2.4 0.6 1.0 
  assign (resid  32 and name HG* ) (resid  34 and name HG* ) 1.9 0.1 1.0
  assign (resid  32 and name HG* ) (resid  77 and name HG* ) 2.1 0.3 1.1 
  assign (resid  32 and name HG* ) (resid  96 and name HG* ) 1.9 0.1 1.0
  assign (resid  32 and name HA  ) (resid  98 and name HA  ) 2.3 0.5 0.6 
  assign (resid  32 and name HG* ) (resid  98 and name HA  ) 2.6 0.8 1.2
  assign (resid  33 and name HA  ) (resid  33 and name HG* ) 2.6 0.8 0.6 
  assign (resid  33 and name HB* ) (resid  33 and name HD* ) 2.5 0.7 0.6
  assign (resid  33 and name HA  ) (resid  51 and name HA  ) 2.1 0.3 0.5 
  assign (resid  33 and name HA  ) (resid  51 and name HG2*) 2.5 0.7 1.1
  assign (resid  33 and name HG* ) (resid  51 and name HG2*) 2.9 1.1 1.2 
  assign (resid  33 and name HD* ) (resid  51 and name HG2*) 3.1 1.3 1.3
  assign (resid  33 and name HG* ) (resid  99 and name HE* ) 2.8 1.0 1.3 
  assign (resid  33 and name HD* ) (resid  99 and name HE* ) 2.8 1.0 1.3 
  assign (resid  33 and name HB* ) (resid 100 and name HD* ) 2.5 0.7 0.7
  assign (resid  34 and name HA  ) (resid  34 and name HB  ) 2.7 0.9 0.7 
  assign (resid  34 and name HA  ) (resid  34 and name HG* ) 2.2 0.4 1.0
  assign (resid  34 and name HB  ) (resid  34 and name HG* ) 1.9 0.1 1.0 
  assign (resid  34 and name HG* ) (resid  52 and name HD* ) 2.5 0.7 1.1
  assign (resid  34 and name HG* ) (resid  60 and name HE* ) 2.8 1.0 1.3 
  assign (resid  34 and name HG* ) (resid  72 and name HB* ) 2.6 0.8 1.1 
  assign (resid  34 and name HG* ) (resid  77 and name HB  ) 2.3 0.5 1.1
  assign (resid  34 and name HG* ) (resid  79 and name HD* ) 1.8 0.0 1.1 
  assign (resid  34 and name HA  ) (resid  96 and name HA  ) 2.1 0.3 0.5
  assign (resid  34 and name HA  ) (resid  96 and name HG* ) 2.7 0.9 1.2 
  assign (resid  34 and name HG* ) (resid  96 and name HA  ) 2.7 0.9 1.1
  assign (resid  34 and name HG* ) (resid  96 and name HG* ) 2.5 0.7 1.1
  assign (resid  35 and name HA  ) (resid  35 and name HB  ) 2.9 1.1 0.7 
  assign (resid  35 and name HA  ) (resid  35 and name HG2*) 2.2 0.4 1.1 
  assign (resid  35 and name HB  ) (resid  37 and name HD1*) 2.7 0.9 1.2 
  assign (resid  35 and name HG2*) (resid  37 and name HG  ) 2.7 0.9 1.2
  assign (resid  35 and name HG2*) (resid  37 and name HD1*) 2.1 0.3 1.0 
  assign (resid  35 and name HG2*) (resid  46 and name HB* ) 2.8 1.0 1.2
  assign (resid  35 and name HG2*) (resid  46 and name HG* ) 2.3 0.5 1.1 
  assign (resid  35 and name HA  ) (resid  49 and name HA  ) 2.0 0.2 0.5
  assign (resid  35 and name HA  ) (resid  49 and name HB* ) 2.3 0.5 0.6 
  assign (resid  35 and name HG2*) (resid  49 and name HA  ) 3.1 1.3 1.3
  assign (resid  35 and name HG2*) (resid  49 and name HB* ) 2.4 0.6 1.1 
  assign (resid  35 and name HB  ) (resid  95 and name HB* ) 2.8 1.0 0.6
  assign (resid  35 and name HB  ) (resid  95 and name HD* ) 2.2 0.4 0.6 
  assign (resid  36 and name HA  ) (resid  36 and name HB  ) 3.2 1.4 0.8
  assign (resid  36 and name HA  ) (resid  36 and name HG* ) 2.0 0.2 1.0 
  assign (resid  36 and name HB  ) (resid  36 and name HG* ) 2.1 0.3 1.0
  assign (resid  36 and name HA  ) (resid  37 and name HD* ) 3.2 1.4 1.3 
  assign (resid  36 and name HG* ) (resid  79 and name HG* ) 2.4 0.6 1.1
  assign (resid  36 and name HG* ) (resid  92 and name HB* ) 3.0 1.2 1.3 
  assign (resid  36 and name HG* ) (resid  92 and name HD* ) 2.5 0.7 1.2
  assign (resid  36 and name HG* ) (resid  92 and name HE* ) 2.9 1.1 1.2 
  assign (resid  36 and name HA  ) (resid  94 and name HA  ) 2.6 0.8 0.7
  assign (resid  36 and name HG* ) (resid  94 and name HA  ) 3.2 1.4 1.3 
  assign (resid  37 and name HA  ) (resid  37 and name HB* ) 2.3 0.5 0.6
  assign (resid  37 and name HA  ) (resid  37 and name HG  ) 2.9 1.1 0.7 
  assign (resid  37 and name HA  ) (resid  37 and name HD2*) 2.1 0.3 1.0
  assign (resid  37 and name HB* ) (resid  37 and name HD* ) 1.9 0.1 1.0 
  assign (resid  37 and name HA  ) (resid  46 and name HA  ) 2.3 0.5 0.6
  assign (resid  37 and name HD2*) (resid  46 and name HA  ) 1.9 0.1 1.0 
  assign (resid  37 and name HD2*) (resid  46 and name HG1 ) 2.3 0.5 1.1
  assign (resid  37 and name HD2*) (resid  46 and name HG2 ) 2.3 0.5 1.1
  assign (resid  37 and name HA  ) (resid  47 and name HG1*) 3.4 1.6 1.3 
  assign (resid  37 and name HD1*) (resid  93 and name HG1*) 2.5 0.7 1.1
  assign (resid  37 and name HD1*) (resid  95 and name HB* ) 3.4 1.6 1.3 
  assign (resid  38 and name HA  ) (resid  92 and name HA  ) 2.6 0.8 0.6 
  assign (resid  38 and name HD* ) (resid  92 and name HE* ) 3.2 1.4 0.8
  assign (resid  39 and name HA  ) (resid  39 and name HB* ) 2.4 0.6 0.6 
  assign (resid  39 and name HA  ) (resid  44 and name HG* ) 2.6 0.8 1.2
  assign (resid  39 and name HB1 ) (resid  44 and name HG* ) 2.7 0.9 1.2 
  assign (resid  39 and name HB2 ) (resid  44 and name HG* ) 2.7 0.9 1.2
  assign (resid  39 and name HB* ) (resid  91 and name HD* ) 2.6 0.8 1.2 
  assign (resid  39 and name HB* ) (resid  93 and name HD1*) 2.3 0.5 1.1
  assign (resid  41 and name HA  ) (resid  41 and name HB1 ) 2.3 0.5 0.5 
  assign (resid  41 and name HA  ) (resid  41 and name HB2 ) 2.3 0.5 0.5
  assign (resid  42 and name HA  ) (resid  42 and name HB* ) 2.3 0.5 0.5 
  assign (resid  43 and name HA  ) (resid  43 and name HB* ) 2.2 0.4 0.5
  assign (resid  43 and name HA  ) (resid  43 and name HG* ) 2.6 0.8 0.6
  assign (resid  43 and name HB* ) (resid  43 and name HG* ) 2.2 0.4 0.5 
  assign (resid  44 and name HA  ) (resid  44 and name HB  ) 2.7 0.9 0.6
  assign (resid  44 and name HA  ) (resid  44 and name HG* ) 2.1 0.3 1.0 
  assign (resid  44 and name HB  ) (resid  44 and name HG* ) 1.6 0.2 1.3
  assign (resid  45 and name HA  ) (resid  45 and name HB  ) 2.1 0.3 0.5 
  assign (resid  45 and name HA  ) (resid  45 and name HG2*) 2.0 0.2 1.0
  assign (resid  46 and name HA  ) (resid  46 and name HG* ) 2.8 1.0 0.7 
  assign (resid  47 and name HA  ) (resid  47 and name HB  ) 2.8 1.0 0.7
  assign (resid  47 and name HA  ) (resid  47 and name HG* ) 2.0 0.2 1.0 
  assign (resid  47 and name HB  ) (resid  47 and name HG* ) 1.9 0.1 1.0
  assign (resid  47 and name HG* ) (resid  48 and name HB* ) 2.8 1.0 1.2 
  assign (resid  47 and name HG* ) (resid  63 and name HB* ) 2.6 0.8 1.2
  assign (resid  47 and name HG* ) (resid  92 and name HE* ) 2.0 0.2 1.0 
  assign (resid  47 and name HG* ) (resid  92 and name HD* ) 2.7 0.9 1.2
  assign (resid  48 and name HB* ) (resid  60 and name HD* ) 3.2 1.2 0.8 
  assign (resid  50 and name HB* ) (resid  60 and name HD* ) 3.2 1.4 1.3
  assign (resid  50 and name HB* ) (resid  60 and name HE* ) 3.2 1.4 1.3 
  assign (resid  51 and name HA  ) (resid  51 and name HB  ) 2.5 0.7 0.6
  assign (resid  51 and name HA  ) (resid  51 and name HG2*) 2.0 0.2 1.0 
  assign (resid  51 and name HB  ) (resid  53 and name HE* ) 2.8 1.0 0.7
  assign (resid  51 and name HG2*) (resid  53 and name HE* ) 2.6 0.8 0.6 
  assign (resid  52 and name HA  ) (resid  52 and name HB* ) 2.8 1.0 0.7
  assign (resid  52 and name HB1 ) (resid  52 and name HD* ) 2.3 0.5 0.6 
  assign (resid  52 and name HB2 ) (resid  52 and name HD* ) 2.3 0.5 0.6
  assign (resid  52 and name HB* ) (resid  54 and name HE* ) 2.9 1.1 1.3 
  assign (resid  52 and name HD* ) (resid  54 and name HA  ) 2.5 0.7 0.7
  assign (resid  52 and name HD* ) (resid  54 and name HE* ) 3.0 1.2 1.2 
  assign (resid  53 and name HG* ) (resid  53 and name HE* ) 2.2 0.4 1.1
  assign (resid  54 and name HA  ) (resid  54 and name HB* ) 2.4 0.6 0.6 
  assign (resid  54 and name HA  ) (resid  54 and name HG* ) 2.5 0.7 0.7
  assign (resid  54 and name HA  ) (resid  54 and name HE* ) 2.8 1.0 1.2 
  assign (resid  54 and name HB* ) (resid  54 and name HG* ) 2.0 0.2 0.5
  assign (resid  54 and name HG* ) (resid  54 and name HE* ) 2.3 0.5 1.0 
  assign (resid  56 and name HA  ) (resid  56 and name HB* ) 2.1 0.3 0.5
  assign (resid  57 and name HA  ) (resid  57 and name HB* ) 2.1 0.3 0.5 
  assign (resid  57 and name HA  ) (resid  57 and name HG* ) 2.4 0.6 0.5
  assign (resid  57 and name HB* ) (resid  57 and name HG* ) 2.4 0.6 0.5 
  assign (resid  58 and name HA  ) (resid  58 and name HD* ) 2.1 0.3 1.1
  assign (resid  58 and name HB* ) (resid  58 and name HD* ) 2.0 0.2 1.2 
  assign (resid  58 and name HD* ) (resid  60 and name HE* ) 3.4 1.6 1.3
  assign (resid  59 and name HA  ) (resid  59 and name HB  ) 2.8 1.0 0.6
  assign (resid  59 and name HA  ) (resid  59 and name HG2*) 2.1 0.3 1.0 
  assign (resid  60 and name HA  ) (resid  60 and name HB* ) 2.7 0.9 0.6 
  assign (resid  60 and name HA  ) (resid  60 and name HD* ) 2.9 1.1 0.7
  assign (resid  60 and name HB1 ) (resid  60 and name HD* ) 2.8 1.0 0.7 
  assign (resid  60 and name HB2 ) (resid  60 and name HD* ) 2.8 1.0 0.7
  assign (resid  60 and name HD* ) (resid  69 and name HA  ) 3.4 1.6 0.9 
  assign (resid  60 and name HE* ) (resid  79 and name HD* ) 2.6 0.8 1.1
  assign (resid  60 and name HZ  ) (resid  79 and name HD* ) 2.4 0.6 1.1 
  assign (resid  63 and name HA  ) (resid  63 and name HB* ) 2.2 0.4 0.5
  assign (resid  64 and name HA  ) (resid  64 and name HB* ) 2.2 0.4 0.5 
  assign (resid  67 and name HA  ) (resid  67 and name HB  ) 2.5 0.7 0.6
  assign (resid  67 and name HA  ) (resid  67 and name HG2*) 2.1 0.3 1.1 
  assign (resid  67 and name HA  ) (resid  67 and name HD1*) 2.8 1.0 1.2
  assign (resid  67 and name HB  ) (resid  67 and name HG1*) 2.6 0.8 1.1 
  assign (resid  67 and name HB  ) (resid  67 and name HD1*) 2.2 0.4 1.1
  assign (resid  68 and name HA  ) (resid  81 and name HA  ) 2.8 1.4 0.7 
  assign (resid  68 and name HB* ) (resid  79 and name HD* ) 3.1 1.3 1.3
  assign (resid  69 and name HA  ) (resid  69 and name HG2*) 2.6 0.8 1.1
  assign (resid  71 and name HA  ) (resid  71 and name HB  ) 2.2 0.4 0.6 
  assign (resid  71 and name HA  ) (resid  71 and name HG2*) 2.0 0.2 1.1 
  assign (resid  71 and name HG2*) (resid  78 and name HB* ) 2.5 0.7 1.1
  assign (resid  72 and name HA  ) (resid  72 and name HB* ) 2.6 0.8 0.6 
  assign (resid  72 and name HA  ) (resid  77 and name HA  ) 2.1 0.3 0.5
  assign (resid  72 and name HA  ) (resid  77 and name HB  ) 2.9 1.1 0.7 
  assign (resid  72 and name HA  ) (resid  77 and name HG* ) 2.8 1.0 1.2
  assign (resid  72 and name HB* ) (resid  77 and name HG* ) 3.0 1.2 1.2
  assign (resid  73 and name HA  ) (resid  73 and name HB* ) 2.0 0.2 0.5 
  assign (resid  75 and name HA  ) (resid  75 and name HB* ) 2.1 0.3 0.5 
  assign (resid  76 and name HA  ) (resid  76 and name HB* ) 2.2 0.4 0.6
  assign (resid  77 and name HA  ) (resid  77 and name HB  ) 2.5 0.7 0.6 
  assign (resid  77 and name HA  ) (resid  77 and name HG* ) 2.2 0.4 1.0
  assign (resid  77 and name HB  ) (resid  77 and name HG* ) 1.9 0.1 0.5 
  assign (resid  77 and name HG* ) (resid  79 and name HG  ) 2.2 0.4 1.0
  assign (resid  77 and name HG* ) (resid  79 and name HD* ) 2.4 0.6 1.1 
  assign (resid  77 and name HG* ) (resid  96 and name HG* ) 2.2 0.4 1.1
  assign (resid  78 and name HA  ) (resid  78 and name HB* ) 2.9 1.1 0.7 
  assign (resid  79 and name HA  ) (resid  79 and name HB* ) 2.7 0.9 0.7
  assign (resid  79 and name HA  ) (resid  79 and name HG  ) 2.6 0.8 0.7 
  assign (resid  79 and name HA  ) (resid  79 and name HD* ) 1.9 0.1 1.0
  assign (resid  79 and name HB* ) (resid  79 and name HD* ) 2.6 0.8 1.1 
  assign (resid  79 and name HG  ) (resid  79 and name HD* ) 2.0 0.2 1.0
  assign (resid  80 and name HA  ) (resid  80 and name HB  ) 2.6 0.8 0.6
  assign (resid  80 and name HA  ) (resid  80 and name HG2*) 2.2 0.4 1.1 
  assign (resid  80 and name HG2*) (resid  82 and name HG* ) 2.4 0.6 1.0
  assign (resid  81 and name HA  ) (resid  81 and name HB  ) 3.2 1.4 0.8 
  assign (resid  81 and name HA  ) (resid  81 and name HG2*) 2.3 0.5 1.1
  assign (resid  81 and name HB  ) (resid  81 and name HG1*) 2.3 0.5 1.0
  assign (resid  81 and name HB  ) (resid  81 and name HD1*) 2.4 0.6 1.1 
  assign (resid  81 and name HG2*) (resid  81 and name HD1*) 2.1 0.3 1.0
  assign (resid  81 and name HG2*) (resid  84 and name HD* ) 2.6 0.8 1.2 
  assign (resid  81 and name HD1*) (resid  92 and name HD* ) 2.1 0.3 1.1
  assign (resid  81 and name HD1*) (resid  92 and name HE* ) 2.7 0.9 1.2 
  assign (resid  81 and name HG2*) (resid 115 and name HD1*) 3.0 1.2 1.3
  assign (resid  81 and name HD1*) (resid 115 and name HB  ) 3.0 1.2 1.3 
  assign (resid  81 and name HD1*) (resid 115 and name HD1*) 2.3 0.5 1.0
  assign (resid  82 and name HA  ) (resid  82 and name HB* ) 2.0 0.2 0.5 
  assign (resid  82 and name HA  ) (resid  82 and name HG* ) 2.5 0.7 0.6
  assign (resid  82 and name HB* ) (resid  82 and name HG* ) 1.5 0.3 0.9 
  assign (resid  84 and name HA  ) (resid  84 and name HB* ) 2.4 0.6 0.6
  assign (resid  84 and name HA  ) (resid  84 and name HD* ) 2.1 0.3 1.0 
  assign (resid  84 and name HB* ) (resid  84 and name HD* ) 1.9 0.1 1.0
  assign (resid  84 and name HD* ) (resid  88 and name HB* ) 2.3 0.5 1.1 
  assign (resid  84 and name HD* ) (resid 115 and name HB  ) 2.9 1.1 1.3
  assign (resid  84 and name HD* ) (resid 115 and name HG2*) 2.1 0.3 1.0 
  assign (resid  85 and name HA  ) (resid  85 and name HB* ) 2.5 0.7 0.7
  assign (resid  85 and name HA  ) (resid  85 and name HG* ) 2.0 0.2 0.5 
  assign (resid  85 and name HA  ) (resid  85 and name HD* ) 3.0 1.2 0.8
  assign (resid  85 and name HB* ) (resid  85 and name HG* ) 1.9 0.1 0.5
  assign (resid  85 and name HB* ) (resid  85 and name HD* ) 2.9 1.1 0.7 
  assign (resid  85 and name HG* ) (resid  85 and name HD* ) 2.3 0.5 0.5
  assign (resid  85 and name HB* ) (resid  87 and name HB* ) 2.4 0.6 0.6 
  assign (resid  86 and name HB* ) (resid  87 and name HB* ) 3.1 1.3 1.2
  assign (resid  87 and name HA  ) (resid  87 and name HB* ) 1.9 0.1 0.5 
  assign (resid  87 and name HB* ) (resid  87 and name HE* ) 3.1 1.3 1.3
  assign (resid  87 and name HG* ) (resid  87 and name HE* ) 3.0 1.2 1.3 
  assign (resid  88 and name HA  ) (resid  88 and name HB* ) 1.9 0.1 0.5
  assign (resid  89 and name HA  ) (resid  89 and name HB  ) 2.0 0.2 0.5 
  assign (resid  89 and name HA  ) (resid  89 and name HG2*) 2.0 0.2 1.0
  assign (resid  89 and name HG2*) (resid 116 and name HA  ) 2.2 0.4 1.0 
  assign (resid  89 and name HG2*) (resid 116 and name HB* ) 3.2 1.4 1.3 
  assign (resid  89 and name HG2*) (resid 116 and name HD* ) 2.5 0.7 1.1
  assign (resid  89 and name HG2*) (resid 116 and name HE* ) 3.2 1.4 1.3 
  assign (resid  91 and name HA  ) (resid  91 and name HB* ) 2.5 0.7 0.7
  assign (resid  91 and name HA  ) (resid  91 and name HG  ) 3.0 1.2 0.7 
  assign (resid  91 and name HA  ) (resid  91 and name HD* ) 1.9 0.1 1.0 
  assign (resid  91 and name HB* ) (resid  91 and name HD* ) 2.7 0.9 1.1
  assign (resid  91 and name HG  ) (resid  93 and name HD1*) 2.4 0.6 1.1 
  assign (resid  91 and name HD1*) (resid 112 and name HA* ) 2.0 0.2 1.0
  assign (resid  91 and name HD2*) (resid 112 and name HA* ) 2.0 0.2 1.0 
  assign (resid  91 and name HD* ) (resid 114 and name HB* ) 2.9 1.1 1.2
  assign (resid  91 and name HD* ) (resid 114 and name HG* ) 3.1 1.3 1.3
  assign (resid  92 and name HA  ) (resid  92 and name HB* ) 2.9 1.1 0.7 
  assign (resid  92 and name HA  ) (resid  92 and name HD* ) 3.0 1.2 0.8
  assign (resid  92 and name HB* ) (resid  92 and name HD* ) 2.8 1.0 0.6
  assign (resid  92 and name HD* ) (resid 115 and name HB  ) 1.8 0.0 3.2 
  assign (resid  92 and name HD* ) (resid 115 and name HD1*) 2.9 1.1 1.2 
  assign (resid  92 and name HE* ) (resid 115 and name HB  ) 3.0 1.2 0.8
  assign (resid  92 and name HE* ) (resid 115 and name HD1*) 3.2 1.4 1.3 
  assign (resid  93 and name HA  ) (resid  93 and name HG1*) 2.4 0.6 1.1
  assign (resid  93 and name HA  ) (resid  93 and name HG2*) 2.3 0.5 1.1 
  assign (resid  93 and name HA  ) (resid  93 and name HD1*) 2.5 0.7 1.1
  assign (resid  93 and name HB  ) (resid  93 and name HG1*) 2.4 0.6 1.1 
  assign (resid  93 and name HB  ) (resid  93 and name HD1*) 2.0 0.2 1.0
  assign (resid  93 and name HG2*) (resid  95 and name HD* ) 2.8 1.0 1.3 
  assign (resid  93 and name HA  ) (resid 112 and name HA1 ) 2.2 0.4 0.6
  assign (resid  93 and name HA  ) (resid 112 and name HA2 ) 2.2 0.4 0.6 
  assign (resid  93 and name HD1*) (resid 112 and name HA* ) 2.8 1.0 1.3
  assign (resid  95 and name HA  ) (resid  95 and name HB* ) 3.0 1.2 0.8 
  assign (resid  95 and name HA  ) (resid  95 and name HG* ) 2.7 0.9 0.7
  assign (resid  95 and name HA  ) (resid  95 and name HD* ) 2.3 0.5 0.6
  assign (resid  95 and name HA  ) (resid 109 and name HA  ) 2.2 0.4 0.5 
  assign (resid  95 and name HA  ) (resid 109 and name HD1*) 3.4 1.6 1.3
  assign (resid  95 and name HA  ) (resid 109 and name HG2*) 3.0 1.2 1.2 
  assign (resid  95 and name HB* ) (resid 109 and name HG2*) 2.3 0.5 1.1
  assign (resid  95 and name HD* ) (resid 109 and name HG2*) 2.6 0.8 1.2 
  assign (resid  95 and name HD* ) (resid 109 and name HD1*) 3.4 1.6 1.3
  assign (resid  95 and name HE* ) (resid 109 and name HD1*) 2.6 0.8 1.2 
  assign (resid  96 and name HA  ) (resid  96 and name HG* ) 2.0 0.2 0.9
  assign (resid  96 and name HB  ) (resid  96 and name HG* ) 2.1 0.3 1.0 
  assign (resid  96 and name HG* ) (resid  98 and name HD* ) 2.4 0.6 1.1
  assign (resid  96 and name HG* ) (resid 109 and name HA  ) 2.7 0.9 1.1 
  assign (resid  97 and name HB* ) (resid  99 and name HA  ) 2.8 1.0 0.7
  assign (resid  97 and name HG* ) (resid  99 and name HE* ) 3.1 1.3 1.3
  assign (resid  98 and name HA  ) (resid  98 and name HB* ) 2.3 0.5 0.5
  assign (resid  98 and name HA  ) (resid  98 and name HD* ) 2.3 0.5 1.1 
  assign (resid  98 and name HB* ) (resid  98 and name HD* ) 2.3 0.5 1.1 
  assign (resid  98 and name HG  ) (resid  98 and name HD* ) 2.1 0.3 1.1
  assign (resid  98 and name HB* ) (resid 104 and name HE* ) 3.0 1.2 0.7 
  assign (resid  98 and name HD* ) (resid 104 and name HE* ) 3.0 1.2 1.2 
  assign (resid  98 and name HD* ) (resid 106 and name HD* ) 1.8 0.0 1.1 
  assign (resid  99 and name HA  ) (resid  99 and name HB* ) 2.6 0.8 0.6
  assign (resid  99 and name HA  ) (resid  99 and name HG* ) 3.0 1.2 0.7 
  assign (resid  99 and name HA  ) (resid  99 and name HE* ) 2.7 0.9 1.1
  assign (resid  99 and name HG* ) (resid  99 and name HE* ) 2.4 0.6 1.1 
  assign (resid  99 and name HA  ) (resid 104 and name HD* ) 2.8 1.0 0.7
  assign (resid  99 and name HE* ) (resid 104 and name HD* ) 2.9 1.1 1.2
  assign (resid  99 and name HE* ) (resid 104 and name HE* ) 2.2 0.4 1.0 
  assign (resid 100 and name HA  ) (resid 100 and name HB* ) 2.1 0.3 0.5 
  assign (resid 100 and name HA  ) (resid 100 and name HD* ) 2.9 1.1 0.7 
  assign (resid 100 and name HB1 ) (resid 100 and name HD* ) 2.6 0.8 0.6
  assign (resid 100 and name HB2 ) (resid 100 and name HD* ) 2.6 0.8 0.6 
  assign (resid 103 and name HA  ) (resid 103 and name HB* ) 2.4 0.6 0.6 
  assign (resid 103 and name HA  ) (resid 103 and name HG* ) 2.2 0.4 0.6
  assign (resid 103 and name HG* ) (resid 103 and name HD* ) 2.4 0.6 0.6
  assign (resid 104 and name HA  ) (resid 104 and name HB* ) 3.0 1.2 0.7 
  assign (resid 104 and name HA  ) (resid 104 and name HD* ) 2.3 0.5 0.6
  assign (resid 104 and name HB1 ) (resid 104 and name HD* ) 2.4 0.6 0.6 
  assign (resid 104 and name HB2 ) (resid 104 and name HD* ) 2.4 0.6 0.6 
  assign (resid 105 and name HA  ) (resid 105 and name HB1 ) 2.5 0.7 0.6 
  assign (resid 105 and name HA  ) (resid 105 and name HB2 ) 2.5 0.7 0.6 
  assign (resid 105 and name HA  ) (resid 105 and name HD* ) 2.7 0.9 0.7 
  assign (resid 105 and name HB* ) (resid 105 and name HD* ) 2.5 0.7 0.6 
  assign (resid 105 and name HB* ) (resid 106 and name HD* ) 3.0 1.2 1.2 
  assign (resid 105 and name HD* ) (resid 106 and name HD* ) 2.8 1.0 1.2 
  assign (resid 106 and name HA  ) (resid 106 and name HB* ) 2.6 0.8 0.6 
  assign (resid 106 and name HA  ) (resid 106 and name HD* ) 2.2 0.4 1.1
  assign (resid 106 and name HB* ) (resid 106 and name HG  ) 2.1 0.3 0.5 
  assign (resid 106 and name HB* ) (resid 106 and name HD* ) 2.2 0.4 1.0 
  assign (resid 109 and name HA  ) (resid 109 and name HB  ) 2.9 1.1 0.7 
  assign (resid 109 and name HA  ) (resid 109 and name HG1*) 3.1 1.3 1.2 
  assign (resid 109 and name HA  ) (resid 109 and name HG2*) 2.3 0.5 1.0 
  assign (resid 109 and name HA  ) (resid 109 and name HD1*) 2.4 0.6 1.0 
  assign (resid 109 and name HB  ) (resid 109 and name HG1*) 2.0 0.2 1.0 
  assign (resid 109 and name HB  ) (resid 109 and name HD1*) 2.2 0.4 1.0 
  assign (resid 111 and name HA  ) (resid 111 and name HB* ) 2.0 0.2 0.5 
  assign (resid 113 and name HA  ) (resid 113 and name HB  ) 2.7 0.9 0.6
  assign (resid 113 and name HA  ) (resid 113 and name HG2*) 2.1 0.3 1.0 
  assign (resid 113 and name HG2*) (resid 115 and name HA  ) 2.7 0.9 1.2 
  assign (resid 113 and name HG2*) (resid 115 and name HG1*) 3.3 1.5 1.3 
  assign (resid 113 and name HG2*) (resid 115 and name HD1*) 3.3 1.5 1.3 
  assign (resid 114 and name HA  ) (resid 114 and name HB* ) 2.1 0.3 0.5 
  assign (resid 114 and name HA  ) (resid 114 and name HG* ) 2.9 1.1 0.7 
  assign (resid 114 and name HB* ) (resid 114 and name HG* ) 2.2 0.4 0.6 
  assign (resid 114 and name HB* ) (resid 116 and name HE* ) 2.7 0.9 0.6 
  assign (resid 114 and name HG* ) (resid 116 and name HE* ) 2.6 0.8 0.6 
  assign (resid 115 and name HA  ) (resid 115 and name HB  ) 3.1 1.3 0.7 
  assign (resid 115 and name HA  ) (resid 115 and name HG1*) 2.6 0.8 1.1 
  assign (resid 115 and name HA  ) (resid 115 and name HG2*) 2.3 0.5 1.0 
  assign (resid 115 and name HB  ) (resid 115 and name HG1*) 2.8 1.0 1.2
  assign (resid 115 and name HB  ) (resid 115 and name HD1*) 2.2 0.4 1.1 
  assign (resid 115 and name HG2*) (resid 115 and name HD1*) 2.1 0.3 1.0 
  assign (resid 116 and name HA  ) (resid 116 and name HB* ) 2.5 0.7 0.6 
  assign (resid 116 and name HA  ) (resid 116 and name HD* ) 2.4 0.6 0.5 
  assign (resid 116 and name HB* ) (resid 116 and name HD* ) 2.2 0.4 0.6 
  assign (resid 116 and name HB* ) (resid 118 and name HD1*) 2.9 1.1 1.2 
  assign (resid 117 and name HA  ) (resid 117 and name HB  ) 3.3 1.5 0.9 
  assign (resid 117 and name HA  ) (resid 117 and name HG* ) 1.9 0.1 1.0 
  assign (resid 117 and name HB  ) (resid 117 and name HG* ) 2.1 0.3 1.0
  assign (resid 117 and name HG* ) (resid 118 and name HB  ) 2.5 0.7 1.1 
  assign (resid 118 and name HA  ) (resid 118 and name HB  ) 2.4 0.6 0.6 
  assign (resid 118 and name HA  ) (resid 118 and name HG1*) 2.8 1.0 1.2 
  assign (resid 118 and name HA  ) (resid 118 and name HG2*) 2.2 0.4 1.0 
  assign (resid 118 and name HA  ) (resid 118 and name HD1*) 2.4 0.6 1.1
  assign (resid 118 and name HB  ) (resid 118 and name HG1*) 2.2 0.4 1.0 
  assign (resid 118 and name HB  ) (resid 118 and name HD1*) 2.2 0.4 1.1 
!
  assign (resid   2 and name HA  ) (resid   3 and name HN  ) 2.2 0.4 0.6
  assign (resid   3 and name HN  ) (resid   3 and name HB  ) 2.7 0.9 0.6
  assign (resid   3 and name HN  ) (resid   3 and name HG* ) 2.9 1.1 1.2 
  assign (resid   3 and name HA  ) (resid   4 and name HN  ) 2.2 0.4 0.5
  assign (resid   3 and name HG* ) (resid   4 and name HN  ) 2.7 0.9 1.2 
  assign (resid   4 and name HN  ) (resid   4 and name HB* ) 2.3 0.5 1.1 
  assign (resid   4 and name HA  ) (resid   5 and name HN  ) 2.1 0.3 0.5
  assign (resid   4 and name HB* ) (resid   5 and name HN  ) 2.4 0.6 1.2 
  assign (resid   3 and name HG* ) (resid 109 and name HN  ) 3.2 1.4 1.3 
  assign (resid   4 and name HN  ) (resid  22 and name HB* ) 3.4 1.6 0.9 
  assign (resid   4 and name HB* ) (resid  22 and name HN  ) 2.9 1.1 1.2 
  assign (resid   4 and name HN  ) (resid  23 and name HA  ) 3.1 1.3 0.8 
  assign (resid   5 and name HN  ) (resid   5 and name HB* ) 2.8 1.0 0.6 
  assign (resid   5 and name HN  ) (resid   5 and name HG* ) 2.6 0.8 0.6 
  assign (resid   5 and name HG* ) (resid   5 and name HE2*) 3.2 1.4 0.8 
  assign (resid   5 and name HB* ) (resid 112 and name HN  ) 3.5 1.7 0.8 
  assign (resid   5 and name HG* ) (resid 112 and name HN  ) 3.1 1.3 0.8 
  assign (resid   6 and name HA  ) (resid   8 and name HN  ) 3.1 1.3 0.7 
  assign (resid   6 and name HB* ) (resid   8 and name HN  ) 2.9 1.1 0.7 
  assign (resid   7 and name HN  ) (resid   7 and name HB* ) 3.1 1.3 1.3 
  assign (resid   7 and name HN  ) (resid   8 and name HN  ) 3.0 1.2 0.8 
  assign (resid   7 and name HB* ) (resid   8 and name HN  ) 2.4 0.6 1.1 
  assign (resid   7 and name HA  ) (resid 114 and name HN  ) 3.1 1.3 0.8 
  assign (resid   8 and name HN  ) (resid   8 and name HB  ) 2.3 0.5 0.6 
  assign (resid   8 and name HN  ) (resid   8 and name HB  ) 2.4 0.6 0.6 
  assign (resid   8 and name HN  ) (resid   8 and name HG* ) 2.5 0.7 1.1 
  assign (resid   8 and name HG* ) (resid   9 and name HN  ) 2.3 0.5 1.1 
  assign (resid   8 and name HN  ) (resid   9 and name HN  ) 3.3 1.5 0.8
  assign (resid   8 and name HA  ) (resid   9 and name HN  ) 2.3 0.5 0.5 
  assign (resid   8 and name HA  ) (resid 114 and name HN  ) 2.8 1.0 0.7 
  assign (resid   9 and name HN  ) (resid   9 and name HB  ) 2.5 0.7 0.6
  assign (resid   9 and name HA  ) (resid  10 and name HN  ) 2.1 0.3 0.6 
  assign (resid   9 and name HB  ) (resid  10 and name HN  ) 3.8 2.0 1.0 
  assign (resid   9 and name HG1*) (resid  10 and name HN  ) 2.6 0.8 1.2 
  assign (resid   9 and name HG2*) (resid  10 and name HN  ) 2.8 1.0 1.2 
  assign (resid   9 and name HN  ) (resid 114 and name HN  ) 3.4 1.2 0.8 
  assign (resid   9 and name HN  ) (resid 115 and name HA  ) 2.7 0.9 0.7 
  assign (resid   9 and name HN  ) (resid 113 and name HG2*) 2.7 0.9 1.2 
  assign (resid   9 and name HN  ) (resid 116 and name HN  ) 3.2 1.4 0.9 
  assign (resid  10 and name HN  ) (resid  10 and name HB* ) 2.3 0.5 0.6 
  assign (resid  10 and name HN  ) (resid  10 and name HG  ) 2.9 1.1 0.7
  assign (resid  10 and name HA  ) (resid  11 and name HN  ) 2.2 0.4 0.5
  assign (resid  10 and name HB* ) (resid  11 and name HN  ) 2.9 1.1 0.7
  assign (resid  10 and name HD* ) (resid  11 and name HN  ) 2.9 1.1 1.2 
  assign (resid  11 and name HN  ) (resid  11 and name HB* ) 2.4 0.6 1.1 
  assign (resid  11 and name HA  ) (resid  12 and name HN  ) 2.2 0.4 0.6 
  assign (resid  11 and name HB* ) (resid  12 and name HN  ) 2.7 0.9 1.2 
  assign (resid  11 and name HB* ) (resid  16 and name HN  ) 3.2 1.4 1.3 
  assign (resid  11 and name HN  ) (resid 116 and name HB* ) 3.2 1.4 0.8 
  assign (resid  11 and name HN  ) (resid 115 and name HG2*) 3.2 1.4 1.3 
  assign (resid  11 and name HN  ) (resid 116 and name HN  ) 3.1 1.3 0.7 
  assign (resid  12 and name HN  ) (resid  12 and name HB* ) 2.6 0.8 0.6 
  assign (resid  12 and name HN  ) (resid  16 and name HN  ) 3.2 1.4 0.8 
  assign (resid  12 and name HN  ) (resid  17 and name HA  ) 3.4 1.6 0.8 
  assign (resid  14 and name HA  ) (resid  15 and name HN  ) 2.8 1.0 0.7 
  assign (resid  15 and name HN  ) (resid  15 and name HA* ) 2.4 0.6 0.6
  assign (resid  15 and name HN  ) (resid  16 and name HN  ) 2.6 0.8 0.6 
  assign (resid  15 and name HA1 ) (resid  16 and name HN  ) 3.1 1.3 0.8 
  assign (resid  15 and name HA2 ) (resid  16 and name HN  ) 3.1 1.3 0.8 
  assign (resid  15 and name HA1 ) (resid  84 and name HN  ) 2.9 1.1 0.8 
  assign (resid  16 and name HN  ) (resid  16 and name HB  ) 2.6 0.8 0.6 
  assign (resid  16 and name HN  ) (resid  16 and name HG2*) 3.0 1.2 1.2 
  assign (resid  16 and name HN  ) (resid  16 and name HG1*) 2.9 1.1 1.3 
  assign (resid  16 and name HN  ) (resid  16 and name HD1*) 3.0 1.2 1.2 
  assign (resid  16 and name HN  ) (resid  17 and name HN  ) 3.2 1.4 0.8 
  assign (resid  16 and name HA  ) (resid  17 and name HN  ) 2.3 0.5 0.6 
  assign (resid  16 and name HG2*) (resid  17 and name HN  ) 2.6 0.8 1.2 
  assign (resid  17 and name HN  ) (resid  17 and name HB* ) 2.8 1.0 0.7 
  assign (resid  17 and name HA  ) (resid  18 and name HN  ) 2.2 0.4 0.5 
  assign (resid  17 and name HB* ) (resid  18 and name HN  ) 2.6 0.8 0.6
  assign (resid  17 and name HN  ) (resid  80 and name HG2*) 3.0 1.2 1.3 
  assign (resid  17 and name HN  ) (resid  81 and name HN  ) 2.9 1.1 0.7 
  assign (resid  17 and name HN  ) (resid  81 and name HD1*) 3.4 1.6 1.4 
  assign (resid  18 and name HN  ) (resid  18 and name HB* ) 3.0 1.2 0.7 
  assign (resid  18 and name HA  ) (resid  19 and name HN  ) 2.2 0.4 0.6 
  assign (resid  18 and name HB* ) (resid  19 and name HN  ) 3.0 1.2 0.7 
  assign (resid  18 and name HA  ) (resid  81 and name HN  ) 3.3 1.5 0.8 
  assign (resid  19 and name HN  ) (resid  19 and name HD* ) 3.4 1.6 0.9
  assign (resid  19 and name HB1 ) (resid  20 and name HN  ) 3.1 1.3 0.7 
  assign (resid  19 and name HB2 ) (resid  20 and name HN  ) 3.1 1.3 0.7 
  assign (resid  19 and name HN  ) (resid  79 and name HN  ) 3.0 1.2 0.7 
  assign (resid  19 and name HE* ) (resid  94 and name HN  ) 3.3 1.5 0.9 
  assign (resid  20 and name HN  ) (resid  20 and name HB  ) 2.5 0.7 0.6 
  assign (resid  20 and name HN  ) (resid  20 and name HG* ) 2.6 0.8 1.2 
  assign (resid  20 and name HA  ) (resid  21 and name HN  ) 2.2 0.4 0.5 
  assign (resid  20 and name HG* ) (resid  21 and name HN  ) 2.5 0.7 1.1
  assign (resid  20 and name HG* ) (resid  76 and name HE21) 3.3 1.5 1.3 
  assign (resid  20 and name HG* ) (resid  76 and name HE22) 3.1 1.3 1.3 
  assign (resid  20 and name HG* ) (resid  77 and name HN  ) 3.0 1.2 1.2 
  assign (resid  20 and name HG* ) (resid  78 and name HN  ) 2.6 0.8 1.2 
  assign (resid  21 and name HN  ) (resid  21 and name HB* ) 2.9 1.1 0.7 
  assign (resid  21 and name HA  ) (resid  22 and name HN  ) 2.2 0.4 0.5 
  assign (resid  21 and name HN  ) (resid  77 and name HN  ) 2.9 1.1 0.7 
  assign (resid  22 and name HN  ) (resid  22 and name HB* ) 2.8 1.0 0.7 
  assign (resid  22 and name HA  ) (resid  23 and name HN  ) 2.2 0.4 0.5
  assign (resid  22 and name HB* ) (resid  23 and name HN  ) 3.0 1.2 0.7 
  assign (resid  22 and name HG* ) (resid  23 and name HN  ) 3.0 1.2 0.7 
  assign (resid  22 and name HA  ) (resid  77 and name HN  ) 3.3 1.5 0.8 
  assign (resid  22 and name HB* ) (resid  77 and name HN  ) 3.3 1.5 0.8 
  assign (resid  23 and name HN  ) (resid  23 and name HD* ) 2.7 0.9 1.2 
  assign (resid  23 and name HN  ) (resid  24 and name HN  ) 3.3 1.5 0.9 
  assign (resid  23 and name HA  ) (resid  24 and name HN  ) 2.3 0.5 0.6 
  assign (resid  23 and name HB* ) (resid  24 and name HN  ) 2.4 0.6 0.6 
  assign (resid  23 and name HD* ) (resid  24 and name HN  ) 3.2 1.4 0.9 
  assign (resid  23 and name HE* ) (resid  24 and name HN  ) 3.9 2.1 1.0 
  assign (resid  23 and name HD* ) (resid  25 and name HN  ) 3.1 1.3 0.8 
  assign (resid  23 and name HN  ) (resid  75 and name HB* ) 2.9 1.1 0.7 
  assign (resid  23 and name HN  ) (resid  76 and name HA  ) 3.4 1.6 0.9 
  assign (resid  24 and name HN  ) (resid  24 and name HB* ) 2.2 0.4 1.1 
  assign (resid  24 and name HA  ) (resid  25 and name HN  ) 2.0 0.2 0.6
  assign (resid  24 and name HB* ) (resid  25 and name HN  ) 2.9 1.1 1.3
  assign (resid  25 and name HN  ) (resid  25 and name HB* ) 2.6 0.8 0.7 
  assign (resid  27 and name HN  ) (resid  27 and name HA* ) 2.9 1.1 0.7 
  assign (resid  28 and name HA  ) (resid  29 and name HN  ) 2.3 0.5 0.6 
  assign (resid  29 and name HN  ) (resid  29 and name HB* ) 2.4 0.6 1.0 
  assign (resid  29 and name HA  ) (resid  30 and name HN  ) 2.4 0.6 0.6 
  assign (resid  29 and name HB* ) (resid  30 and name HN  ) 3.0 1.2 1.2 
  assign (resid  29 and name HB* ) (resid  31 and name HN  ) 3.3 1.5 1.2 
  assign (resid  30 and name HN  ) (resid  30 and name HG2*) 3.2 1.4 1.3 
  assign (resid  30 and name HN  ) (resid  31 and name HN  ) 2.6 0.8 0.6 
  assign (resid  31 and name HN  ) (resid  31 and name HG* ) 3.0 1.2 1.2 
  assign (resid  31 and name HA  ) (resid  32 and name HN  ) 2.3 0.5 0.6 
  assign (resid  31 and name HB* ) (resid  99 and name HN  ) 3.3 1.5 0.8 
  assign (resid  31 and name HB* ) (resid 100 and name HN  ) 2.9 1.1 0.7
  assign (resid  32 and name HN  ) (resid  32 and name HB  ) 2.8 1.0 0.8 
  assign (resid  32 and name HN  ) (resid  32 and name HG* ) 3.4 1.6 1.3 
  assign (resid  32 and name HA  ) (resid  33 and name HN  ) 2.4 0.6 0.6 
  assign (resid  32 and name HG* ) (resid  33 and name HN  ) 2.6 0.8 0.7
  assign (resid  32 and name HN  ) (resid  52 and name HN  ) 3.3 1.5 0.9 
  assign (resid  33 and name HD* ) (resid  33 and name HE  ) 3.0 1.2 0.7
  assign (resid  33 and name HA  ) (resid  34 and name HN  ) 2.4 0.6 0.6 
  assign (resid  33 and name HG* ) (resid  34 and name HN  ) 3.1 1.3 0.8 
  assign (resid  33 and name HG* ) (resid  50 and name HN  ) 3.5 1.7 0.9 
  assign (resid  33 and name HN  ) (resid  97 and name HN  ) 3.1 1.3 0.8 
  assign (resid  33 and name HB* ) (resid  97 and name HN  ) 2.5 0.7 0.6 
  assign (resid  33 and name HN  ) (resid  99 and name HN  ) 3.7 1.9 0.9 
  assign (resid  33 and name HB* ) (resid 100 and name HN  ) 3.0 1.2 0.8 
  assign (resid  34 and name HN  ) (resid  34 and name HB  ) 2.8 1.0 0.8 
  assign (resid  34 and name HN  ) (resid  34 and name HG* ) 2.8 1.0 1.2 
  assign (resid  34 and name HA  ) (resid  35 and name HN  ) 2.3 0.5 0.5
  assign (resid  34 and name HG* ) (resid  35 and name HN  ) 2.8 1.0 1.2
  assign (resid  34 and name HN  ) (resid  50 and name HN  ) 3.1 1.3 0.7
  assign (resid  34 and name HG* ) (resid  50 and name HN  ) 3.4 1.6 1.3
  assign (resid  34 and name HN  ) (resid  51 and name HA  ) 3.3 1.5 0.8
  assign (resid  34 and name HB  ) (resid  95 and name HN  ) 3.1 1.3 0.8
  assign (resid  35 and name HN  ) (resid  35 and name HB  ) 3.1 1.3 0.8
  assign (resid  35 and name HA  ) (resid  36 and name HN  ) 2.2 0.4 0.5
  assign (resid  35 and name HG2*) (resid  36 and name HN  ) 2.7 0.9 1.2 
  assign (resid  35 and name HA  ) (resid  50 and name HN  ) 3.4 1.6 0.9 
  assign (resid  35 and name HN  ) (resid  95 and name HN  ) 3.0 0.5 0.8
  assign (resid  36 and name HN  ) (resid  36 and name HB  ) 2.7 0.9 0.7 
  assign (resid  36 and name HN  ) (resid  36 and name HG* ) 2.4 0.6 1.2 
  assign (resid  36 and name HA  ) (resid  37 and name HN  ) 2.3 0.5 0.5 
  assign (resid  36 and name HB  ) (resid  37 and name HN  ) 3.9 2.1 1.0
  assign (resid  36 and name HG* ) (resid  37 and name HN  ) 3.0 1.2 1.2
  assign (resid  36 and name HN  ) (resid  48 and name HN  ) 3.2 0.7 0.8 
  assign (resid  36 and name HB  ) (resid  48 and name HN  ) 2.8 1.0 0.7 
  assign (resid  36 and name HN  ) (resid  49 and name HA  ) 3.3 1.5 0.8 
  assign (resid  36 and name HG* ) (resid  95 and name HN  ) 3.1 1.3 1.3
  assign (resid  37 and name HN  ) (resid  37 and name HB* ) 2.5 0.7 0.7 
  assign (resid  37 and name HN  ) (resid  37 and name HD* ) 3.0 1.2 1.2 
  assign (resid  37 and name HA  ) (resid  38 and name HN  ) 2.4 0.6 0.6 
  assign (resid  37 and name HB* ) (resid  38 and name HN  ) 3.2 1.4 0.8 
  assign (resid  37 and name HD2*) (resid  38 and name HN  ) 2.6 0.8 1.1
  assign (resid  37 and name HD2*) (resid  46 and name HN  ) 3.0 1.2 1.2 
  assign (resid  37 and name HA  ) (resid  47 and name HN  ) 3.1 1.3 0.8 
  assign (resid  37 and name HD* ) (resid  47 and name HN  ) 3.4 1.6 1.4 
  assign (resid  37 and name HN  ) (resid  93 and name HN  ) 3.1 1.3 0.8 
  assign (resid  37 and name HN  ) (resid  93 and name HG1*) 3.2 1.4 1.3 
  assign (resid  38 and name HN  ) (resid  38 and name HB* ) 2.7 0.9 0.6 
  assign (resid  38 and name HA  ) (resid  39 and name HN  ) 2.4 0.6 0.6 
  assign (resid  38 and name HN  ) (resid  45 and name HN  ) 2.9 1.1 0.7 
  assign (resid  38 and name HN  ) (resid  46 and name HA  ) 3.9 2.1 1.0 
  assign (resid  38 and name HN  ) (resid  47 and name HG* ) 2.5 0.7 1.1 
  assign (resid  38 and name HA  ) (resid  93 and name HN  ) 3.4 1.6 0.9 
  assign (resid  39 and name HN  ) (resid  39 and name HB* ) 2.6 0.8 0.6 
  assign (resid  39 and name HG* ) (resid  39 and name HE2*) 3.2 1.4 0.8 
  assign (resid  39 and name HA  ) (resid  40 and name HN  ) 2.2 0.4 0.5 
  assign (resid  39 and name HB* ) (resid  40 and name HN  ) 2.7 0.9 0.7
  assign (resid  39 and name HN  ) (resid  91 and name HN  ) 3.5 1.7 0.9 
  assign (resid  39 and name HN  ) (resid  91 and name HD* ) 2.8 1.0 1.2 
  assign (resid  39 and name HE21) (resid  91 and name HG* ) 3.6 1.8 1.4 
  assign (resid  39 and name HE22) (resid  91 and name HG* ) 3.6 1.8 1.4 
  assign (resid  39 and name HN  ) (resid  92 and name HA  ) 3.5 1.7 0.9 
  assign (resid  39 and name HN  ) (resid  93 and name HD1*) 3.2 1.4 1.3 
  assign (resid  40 and name HN  ) (resid  40 and name HB* ) 2.7 0.9 1.1 
  assign (resid  40 and name HN  ) (resid  43 and name HN  ) 3.3 1.5 0.8 
  assign (resid  40 and name HN  ) (resid  44 and name HG* ) 2.8 1.0 1.2
  assign (resid  40 and name HB* ) (resid  45 and name HN  ) 3.7 1.9 1.4 
  assign (resid  42 and name HN  ) (resid  43 and name HN  ) 2.9 1.1 0.8 
  assign (resid  43 and name HN  ) (resid  43 and name HB* ) 2.6 0.8 0.6 
  assign (resid  43 and name HN  ) (resid  43 and name HG* ) 3.1 1.3 0.8 
  assign (resid  43 and name HG* ) (resid  43 and name HE2*) 3.3 1.5 0.9 
  assign (resid  43 and name HA  ) (resid  44 and name HN  ) 2.0 0.2 0.5
  assign (resid  43 and name HB* ) (resid  44 and name HN  ) 3.2 1.4 0.8
  assign (resid  43 and name HB1 ) (resid  44 and name HN  ) 3.2 1.4 0.8 
  assign (resid  43 and name HG* ) (resid  44 and name HN  ) 3.0 1.2 0.8 
  assign (resid  44 and name HN  ) (resid  44 and name HB  ) 2.5 0.7 0.7 
  assign (resid  44 and name HN  ) (resid  44 and name HG* ) 2.7 0.9 1.1 
  assign (resid  44 and name HA  ) (resid  45 and name HN  ) 2.2 0.4 0.5 
  assign (resid  44 and name HB  ) (resid  45 and name HN  ) 3.3 1.5 0.8 
  assign (resid  44 and name HG* ) (resid  45 and name HN  ) 2.5 0.7 1.1 
  assign (resid  45 and name HN  ) (resid  45 and name HB  ) 3.1 1.3 0.8 
  assign (resid  45 and name HN  ) (resid  45 and name HG2*) 3.2 1.4 1.4 
  assign (resid  45 and name HA  ) (resid  46 and name HN  ) 2.4 0.6 0.6 
  assign (resid  45 and name HG2*) (resid  46 and name HN  ) 3.1 1.3 1.3 
  assign (resid  46 and name HN  ) (resid  46 and name HB* ) 2.4 0.6 0.6 
  assign (resid  46 and name HA  ) (resid  47 and name HN  ) 2.5 0.7 0.7 
  assign (resid  46 and name HB* ) (resid  47 and name HN  ) 2.6 0.8 0.7 
  assign (resid  47 and name HN  ) (resid  47 and name HB  ) 2.6 0.8 0.6 
  assign (resid  47 and name HN  ) (resid  47 and name HG* ) 2.5 0.7 1.1 
  assign (resid  47 and name HN  ) (resid  48 and name HN  ) 2.5 0.7 0.7 
  assign (resid  47 and name HB  ) (resid  48 and name HN  ) 2.5 0.7 0.6
  assign (resid  47 and name HG* ) (resid  48 and name HN  ) 2.5 0.7 1.1
  assign (resid  48 and name HA  ) (resid  49 and name HN  ) 2.2 0.4 0.6 
  assign (resid  48 and name HB* ) (resid  49 and name HN  ) 2.7 0.9 0.7 
  assign (resid  49 and name HN  ) (resid  49 and name HB* ) 2.4 0.6 1.1 
  assign (resid  49 and name HA  ) (resid  50 and name HN  ) 2.3 0.5 0.6 
  assign (resid  49 and name HB* ) (resid  50 and name HN  ) 2.7 0.9 1.2 
  assign (resid  49 and name HN  ) (resid  60 and name HA  ) 2.7 0.9 0.7 
  assign (resid  49 and name HN  ) (resid  60 and name HD* ) 3.1 1.3 0.7 
  assign (resid  50 and name HN  ) (resid  50 and name HB* ) 3.1 1.3 1.3 
  assign (resid  50 and name HA  ) (resid  51 and name HN  ) 2.3 0.5 0.5 
  assign (resid  50 and name HB* ) (resid  51 and name HN  ) 2.8 1.0 1.2 
  assign (resid  50 and name HB* ) (resid  58 and name HN  ) 3.6 1.8 1.4 
  assign (resid  50 and name HB* ) (resid  59 and name HN  ) 3.0 1.2 1.2 
  assign (resid  51 and name HN  ) (resid  51 and name HB  ) 2.6 0.8 0.7 
  assign (resid  51 and name HN  ) (resid  51 and name HG2*) 3.0 1.2 1.3 
  assign (resid  51 and name HA  ) (resid  52 and name HN  ) 2.5 0.7 0.6 
  assign (resid  51 and name HG2*) (resid  52 and name HN  ) 3.5 1.7 1.3 
  assign (resid  52 and name HN  ) (resid  52 and name HB* ) 3.2 1.4 0.7 
  assign (resid  52 and name HN  ) (resid  52 and name HD* ) 3.2 1.4 0.8 
  assign (resid  56 and name HA  ) (resid  57 and name HN  ) 2.4 0.6 0.6 
  assign (resid  56 and name HB* ) (resid  57 and name HN  ) 2.2 0.4 0.6 
  assign (resid  57 and name HN  ) (resid  57 and name HB* ) 2.5 0.7 0.6 
  assign (resid  57 and name HA  ) (resid  58 and name HN  ) 2.4 0.6 0.6 
  assign (resid  57 and name HB* ) (resid  58 and name HN  ) 3.1 1.3 0.8 
  assign (resid  58 and name HN  ) (resid  58 and name HG  ) 3.0 1.2 0.8 
  assign (resid  58 and name HA  ) (resid  59 and name HN  ) 2.1 0.3 0.6 
  assign (resid  59 and name HN  ) (resid  59 and name HB  ) 2.6 0.8 0.6 
  assign (resid  59 and name HN  ) (resid  59 and name HG2*) 3.0 1.2 1.3 
  assign (resid  62 and name HA  ) (resid  63 and name HN  ) 2.4 0.6 0.6 
  assign (resid  62 and name HA  ) (resid  64 and name HN  ) 3.2 1.4 0.8 
  assign (resid  63 and name HN  ) (resid  63 and name HA  ) 2.0 0.2 0.5 
  assign (resid  63 and name HN  ) (resid  63 and name HB* ) 2.8 1.0 0.7
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  assign (resid  63 and name HA  ) (resid  64 and name HN  ) 2.4 0.6 0.6 
  assign (resid  63 and name HB1 ) (resid  64 and name HN  ) 3.5 1.7 0.9 
  assign (resid  63 and name HB2 ) (resid  64 and name HN  ) 3.5 1.7 0.8 
  assign (resid  64 and name HN  ) (resid  64 and name HB* ) 2.6 0.8 0.6 
  assign (resid  68 and name HA  ) (resid  69 and name HN  ) 2.6 0.8 0.6 
  assign (resid  69 and name HN  ) (resid  69 and name HG2*) 3.4 1.6 1.4 
  assign (resid  69 and name HN  ) (resid  80 and name HN  ) 3.0 1.2 0.7 
  assign (resid  71 and name HA  ) (resid  72 and name HN  ) 2.3 0.5 0.6 
  assign (resid  71 and name HB  ) (resid  72 and name HN  ) 2.8 1.0 0.7 
  assign (resid  71 and name HG2*) (resid  72 and name HN  ) 3.8 2.0 1.4 
  assign (resid  71 and name HN  ) (resid  78 and name HN  ) 3.1 1.3 0.7 
  assign (resid  72 and name HN  ) (resid  72 and name HB* ) 3.3 1.5 0.8 
  assign (resid  72 and name HA  ) (resid  73 and name HN  ) 2.3 0.5 0.6 
  assign (resid  72 and name HB* ) (resid  73 and name HN  ) 3.3 1.5 0.8 
  assign (resid  72 and name HA  ) (resid  78 and name HN  ) 3.0 1.2 0.7 
  assign (resid  73 and name HN  ) (resid  73 and name HB* ) 2.8 1.0 0.7 
  assign (resid  73 and name HN  ) (resid  76 and name HN  ) 2.8 1.0 0.7 
  assign (resid  74 and name HA1 ) (resid  76 and name HN  ) 3.7 1.9 0.9 
  assign (resid  74 and name HA2 ) (resid  76 and name HN  ) 3.7 1.9 0.9 
  assign (resid  75 and name HB* ) (resid  75 and name HD2*) 2.9 1.1 0.7 
  assign (resid  75 and name HN  ) (resid  76 and name HN  ) 3.1 1.3 0.7
  assign (resid  75 and name HA  ) (resid  76 and name HN  ) 2.6 0.8 0.7 
  assign (resid  75 and name HB* ) (resid  76 and name HN  ) 3.1 1.3 0.8 
  assign (resid  76 and name HN  ) (resid  76 and name HB* ) 2.4 0.6 0.6 
  assign (resid  76 and name HN  ) (resid  76 and name HG* ) 3.0 1.2 0.7 
  assign (resid  76 and name HB1 ) (resid  76 and name HE2*) 3.0 1.2 0.7 
  assign (resid  76 and name HB2 ) (resid  76 and name HE2*) 2.7 0.9 0.7 
  assign (resid  76 and name HG* ) (resid  76 and name HE2*) 3.2 1.4 0.8 
  assign (resid  76 and name HN  ) (resid  77 and name HN  ) 3.9 2.1 0.9 
  assign (resid  76 and name HA  ) (resid  77 and name HN  ) 2.3 0.5 0.5 
  assign (resid  77 and name HN  ) (resid  77 and name HB  ) 2.6 0.8 0.7 
  assign (resid  77 and name HN  ) (resid  77 and name HG* ) 2.8 1.0 1.2 
  assign (resid  77 and name HA  ) (resid  78 and name HN  ) 2.2 0.4 0.6 
  assign (resid  78 and name HN  ) (resid  78 and name HB* ) 2.8 1.0 0.6 
  assign (resid  78 and name HB* ) (resid  78 and name HD2*) 2.7 0.9 0.7 
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  assign (resid  79 and name HN  ) (resid  79 and name HB* ) 2.5 0.7 0.6 
  assign (resid  79 and name HN  ) (resid  79 and name HG  ) 2.9 1.1 0.8 
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  assign (resid  80 and name HN  ) (resid  80 and name HB  ) 2.7 0.9 0.6 
  assign (resid  80 and name HN  ) (resid  80 and name HG2*) 3.1 1.3 1.2
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  assign (resid  82 and name HG* ) (resid  83 and name HN  ) 3.6 1.8 0.9 
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  assign (resid  84 and name HN  ) (resid  84 and name HB* ) 2.7 0.9 0.7 
  assign (resid  84 and name HN  ) (resid  84 and name HG  ) 2.3 0.5 0.5 
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  assign (resid  89 and name HN  ) (resid  89 and name HA  ) 2.2 0.4 0.5 
  assign (resid  89 and name HN  ) (resid  89 and name HB  ) 2.3 0.5 0.6 
  assign (resid  89 and name HN  ) (resid  89 and name HG2*) 2.8 1.0 1.3 
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  assign (resid  89 and name HA  ) (resid  90 and name HN  ) 2.2 0.4 0.6
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  assign (resid 104 and name HE* ) (resid 106 and name HN  ) 3.3 1.5 0.8 
  assign (resid 105 and name HN  ) (resid 105 and name HB* ) 3.1 1.3 0.8 
  assign (resid 105 and name HN  ) (resid 105 and name HD* ) 3.3 1.5 0.8 
! assign (resid 105 and name HN  ) (resid 106 and name HN  ) 3.4 1.6 0.9 
  assign (resid 105 and name HA  ) (resid 106 and name HN  ) 2.3 0.5 0.5 
  assign (resid 105 and name HB* ) (resid 106 and name HN  ) 2.9 1.1 0.7 
  assign (resid 106 and name HN  ) (resid 106 and name HB* ) 2.4 0.6 0.6 
  assign (resid 106 and name HA  ) (resid 108 and name HN  ) 2.4 0.6 0.6 
  assign (resid 106 and name HG  ) (resid 108 and name HN  ) 3.0 1.2 0.8 
  assign (resid 106 and name HD* ) (resid 108 and name HN  ) 2.7 0.9 0.7 
  assign (resid 108 and name HN  ) (resid 108 and name HA* ) 2.8 1.0 0.7 
  assign (resid 108 and name HA* ) (resid 109 and name HN  ) 2.5 0.7 0.6 
  assign (resid 109 and name HN  ) (resid 109 and name HB  ) 2.7 0.9 0.6 
  assign (resid 109 and name HN  ) (resid 109 and name HG1*) 2.8 1.0 1.2 
  assign (resid 109 and name HN  ) (resid 109 and name HG2*) 2.8 1.0 1.2 
  assign (resid 109 and name HN  ) (resid 109 and name HD1*) 3.1 1.3 1.3 
  assign (resid 109 and name HA  ) (resid 110 and name HN  ) 2.4 0.6 0.6 
  assign (resid 109 and name HG2*) (resid 110 and name HN  ) 3.0 1.2 1.3
  assign (resid 110 and name HN  ) (resid 110 and name HA* ) 2.2 0.4 0.6 
  assign (resid 110 and name HA* ) (resid 111 and name HN  ) 2.3 0.5 0.6 
  assign (resid 110 and name HA* ) (resid 112 and name HN  ) 2.8 1.0 0.6 
  assign (resid 111 and name HN  ) (resid 111 and name HA  ) 2.2 0.4 0.6 
  assign (resid 111 and name HN  ) (resid 111 and name HB* ) 2.5 0.7 0.6 
  assign (resid 111 and name HB* ) (resid 111 and name HD2*) 2.6 0.8 0.6 
  assign (resid 111 and name HN  ) (resid 112 and name HN  ) 2.9 1.1 0.7 
  assign (resid 111 and name HB* ) (resid 112 and name HN  ) 3.0 1.2 0.8 
  assign (resid 112 and name HN  ) (resid 112 and name HA* ) 2.6 0.8 0.6 
  assign (resid 112 and name HN  ) (resid 113 and name HN  ) 3.6 1.8 0.9 
  assign (resid 112 and name HA* ) (resid 113 and name HN  ) 2.5 0.7 0.7 
  assign (resid 113 and name HN  ) (resid 113 and name HB  ) 2.7 0.9 0.6 
  assign (resid 113 and name HA  ) (resid 114 and name HN  ) 2.3 0.5 0.6 
  assign (resid 113 and name HG2*) (resid 114 and name HN  ) 3.0 1.2 1.2 
  assign (resid 114 and name HN  ) (resid 114 and name HB* ) 2.3 0.5 0.6 
  assign (resid 114 and name HN  ) (resid 114 and name HG* ) 3.3 1.5 0.8 
  assign (resid 114 and name HG* ) (resid 114 and name HE2*) 3.4 1.6 0.9 
  assign (resid 114 and name HA  ) (resid 115 and name HN  ) 2.3 0.5 0.6 
  assign (resid 114 and name HG* ) (resid 115 and name HN  ) 2.7 0.9 0.7 
  assign (resid 115 and name HN  ) (resid 115 and name HG2*) 2.9 1.1 1.3 
  assign (resid 115 and name HA  ) (resid 116 and name HN  ) 2.2 0.4 0.5 
  assign (resid 115 and name HG2*) (resid 116 and name HN  ) 2.6 0.8 0.6 
  assign (resid 116 and name HN  ) (resid 116 and name HB* ) 2.7 0.9 0.6 
  assign (resid 116 and name HN  ) (resid 116 and name HD* ) 3.1 1.3 0.7 
!
! carbohydrate on ASN 111 - residues numbered 132-135
!
  assign (resid 132 and name H8* ) (resid  93 and name HG2*) 2.8 1.0 0.7 
  assign (resid 132 and name H8* ) (resid  93 and name HG1*) 2.8 1.0 0.7 
  assign (resid 132 and name H8* ) (resid 109 and name HB  ) 2.8 1.0 0.7 
  assign (resid 132 and name H8* ) (resid 109 and name HG1*) 2.8 1.0 0.7 
  assign (resid 132 and name H8* ) (resid 109 and name HD1*) 2.8 1.0 1.2 
  assign (resid 132 and name H8* ) (resid 111 and name HA  ) 3.4 1.6 0.9 
  assign (resid 132 and name H1  ) (resid 111 and name HD22) 3.0 1.2 0.8 
  assign (resid 132 and name H2  ) (resid 111 and name HD22) 2.6 0.8 0.7 
  assign (resid 132 and name H1  ) (resid 111 and name HA  ) 3.0 0.0 9.9 
  assign (resid 132 and name H5  ) (resid 132 and name H6* ) 2.3 0.5 0.5
  assign (resid 132 and name HN2 ) (resid 132 and name H1  ) 2.6 0.8 0.7 
  assign (resid 132 and name HN2 ) (resid 132 and name H2  ) 2.5 0.7 0.6 
  assign (resid 132 and name HN2 ) (resid 132 and name H3  ) 2.5 0.7 0.6 
  assign (resid 132 and name H4  ) (resid 133 and name H1  ) 2.3 0.5 0.6 
  assign (resid 132 and name H6* ) (resid 133 and name H1  ) 2.3 0.5 0.6 
  assign (resid 132 and name H6* ) (resid 133 and name H8* ) 2.6 0.8 0.7 
  assign (resid 133 and name H5  ) (resid 133 and name H6* ) 2.2 0.4 0.6 
  assign (resid 133 and name H8* ) (resid 133 and name H3  ) 3.2 1.4 0.8 
  assign (resid 133 and name H8* ) (resid 134 and name H1  ) 3.4 1.6 0.9 
  assign (resid 133 and name H8* ) (resid 134 and name H2  ) 2.8 1.0 0.7 
  assign (resid 133 and name H4  ) (resid 135 and name H1  ) 2.1 0.3 0.5 
  assign (resid 133 and name H4  ) (resid 135 and name H2  ) 2.3 0.5 0.6 
  assign (resid 133 and name H6* ) (resid 135 and name H1  ) 2.7 0.9 0.7 
  assign (resid 134 and name H4  ) (resid 134 and name H6* ) 2.4 0.6 0.6 
!
! carbohydrate on ASN 78 - residues numbered 136-139
!
  assign (resid  78 and name HD22) (resid 136 and name H1  ) 2.8 1.0 0.7
  assign (resid  78 and name HD22) (resid 136 and name H2  ) 2.4 0.6 0.6 
  assign (resid  78 and name HD22) (resid 136 and name H4  ) 3.6 1.8 0.9 
  assign (resid 136 and name H1  ) (resid  18 and name HB* ) 3.0 1.2 1.0 
  assign (resid 136 and name H8* ) (resid  18 and name HB* ) 3.0 1.2 1.0 
  assign (resid 136 and name H8* ) (resid  20 and name HG2*) 3.0 1.2 1.0 
  assign (resid 136 and name HN2 ) (resid  18 and name HB* ) 3.0 1.2 1.0 
  assign (resid 137 and name HN2 ) (resid  18 and name HB* ) 3.0 1.2 1.0 
  assign (resid 137 and name H8* ) (resid  18 and name HB* ) 3.0 1.2 1.0 
  assign (resid 137 and name H8* ) (resid  16 and name HG2*) 3.0 1.2 1.0 
  assign (resid 137 and name H8* ) (resid  80 and name HG2*) 3.0 1.2 1.0 
  assign (resid  71 and name HG2*) (resid 138 and name H3  ) 3.4 1.6 0.8 
  assign (resid  71 and name HG2*) (resid 138 and name H4  ) 2.4 0.6 0.6 
  assign (resid  71 and name HG2*) (resid 138 and name H5  ) 2.6 0.8 0.7 
  assign (resid 136 and name H4  ) (resid 137 and name H1  ) 2.3 0.5 0.6 
  assign (resid 136 and name H6* ) (resid 138 and name H1  ) 2.0 0.2 0.5 
  assign (resid 137 and name H5  ) (resid 137 and name H6* ) 2.4 0.6 0.6 
  assign (resid 137 and name H4  ) (resid 139 and name H1  ) 1.9 0.1 0.5 
  assign (resid 139 and name H5  ) (resid 139 and name H61 ) 2.1 0.3 0.6 
  assign (resid 139 and name H5  ) (resid 139 and name H62 ) 2.0 0.2 0.5 
! Disulfide Bond Restraints for CTLA-4ex
assign (resid 48 and name sg) (resid 68 and name sg)  2.02 0.1 0.1
assign (resid 21 and name sg) (resid 94 and name sg)  2.02 0.1 0.1

  Entry H atom name         Submitted Coord H atom name

  Start of MODEL    1
    1   1H    ALA   1           HT2      ALA   1  -9.380   9.253   9.253
    2   2H    ALA   1           HT1      ALA   1  -8.221   8.973   8.973
    3   3H    ALA   1           HT3      ALA   1  -7.734   9.146   9.146
    4    HA   ALA   1           HA       ALA   1  -7.660   6.831   6.831
    5   1HB   ALA   1           HB1      ALA   1 -10.271   7.520   7.520
    6   2HB   ALA   1           HB3      ALA   1  -9.874   5.850   5.850
    7   3HB   ALA   1           HB2      ALA   1  -8.843   6.759   6.759
    8    H    MET   1           HN       MET   1  -9.398   5.078   5.078
    9    HA   MET   1           HA       MET   1 -10.444   4.329   4.329
   10   1HB   MET   1           HB2      MET   1 -11.657   7.089   7.089
   11   2HB   MET   1           HB1      MET   1 -12.294   5.850   5.850
   12   1HG   MET   1           HG2      MET   1 -12.601   4.326   4.326
   13   2HG   MET   1           HG1      MET   1 -11.957   5.558   5.558
   14   1HE   MET   1           HE2      MET   1 -14.614   3.898   3.898
   15   2HE   MET   1           HE1      MET   1 -16.083   4.866   4.866
   16   3HE   MET   1           HE3      MET   1 -14.971   5.083   5.083
   17    H    HIS   2           HN       HIS   2  -7.890   6.096   6.096
   18    HA   HIS   2           HA       HIS   2  -8.259   7.014   7.014
   19   1HB   HIS   2           HB2      HIS   2  -6.204   7.694   7.694
   20   2HB   HIS   2           HB1      HIS   2  -6.184   8.342   8.342
   21    HD1  HIS   2           HD1      HIS   2  -9.029   9.088   9.088
   22    HD2  HIS   2           HD2      HIS   2  -7.244   9.731   9.731
   23    HE1  HIS   2           HE1      HIS   2 -10.376  10.906  10.906
   24    H    VAL   3           HN       VAL   3  -7.774   4.239   4.239
   25    HA   VAL   3           HA       VAL   3  -5.539   3.581   3.581
   26    HB   VAL   3           HB       VAL   3  -5.695   2.785   2.785
   27   1HG1  VAL   3          HG12      VAL   3  -3.907   1.915   1.915
   28   2HG1  VAL   3          HG11      VAL   3  -3.352   1.845   1.845
   29   3HG1  VAL   3          HG13      VAL   3  -4.763   0.914   0.914
   30   1HG2  VAL   3          HG21      VAL   3  -3.865   4.624   4.624
   31   2HG2  VAL   3          HG23      VAL   3  -4.863   5.027   5.027
   32   3HG2  VAL   3          HG22      VAL   3  -3.445   3.997   3.997
   33    H    ALA   4           HN       ALA   4  -6.469   2.037   2.037
   34    HA   ALA   4           HA       ALA   4  -8.601   0.287   0.287
   35   1HB   ALA   4           HB2      ALA   4  -8.634   1.889   1.889
   36   2HB   ALA   4           HB1      ALA   4  -8.070   0.391   0.391
   37   3HB   ALA   4           HB3      ALA   4  -9.604   0.420   0.420
   38    H    GLN   5           HN       GLN   5  -8.169  -1.821  -1.821
   39    HA   GLN   5           HA       GLN   5  -6.218  -3.227  -3.227
   40   1HB   GLN   5           HB2      GLN   5  -4.609  -2.831  -2.831
   41   2HB   GLN   5           HB1      GLN   5  -5.779  -2.191  -2.191
   42   1HG   GLN   5           HG2      GLN   5  -6.317  -4.387  -4.387
   43   2HG   GLN   5           HG1      GLN   5  -5.355  -5.140  -5.140
   44   1HE2  GLN   5          HE22      GLN   5  -2.481  -5.101  -5.101
   45   2HE2  GLN   5          HE21      GLN   5  -3.404  -5.893  -5.893
   46    HA   PRO   6           HA       PRO   6  -9.402  -6.280  -6.280
   47   1HB   PRO   6           HB2      PRO   6  -8.028  -8.526  -8.526
   48   2HB   PRO   6           HB1      PRO   6  -8.633  -7.331  -7.331
   49   1HG   PRO   6           HG2      PRO   6  -5.885  -7.683  -7.683
   50   2HG   PRO   6           HG1      PRO   6  -6.402  -7.286  -7.286
   51   1HD   PRO   6           HD2      PRO   6  -5.455  -5.431  -5.431
   52   2HD   PRO   6           HD1      PRO   6  -6.644  -5.054  -5.054
   53    H    ALA   7           HN       ALA   7 -10.056  -7.424  -7.424
   54    HA   ALA   7           HA       ALA   7  -8.334  -7.644  -7.644
   55   1HB   ALA   7           HB2      ALA   7 -11.020  -8.888  -8.888
   56   2HB   ALA   7           HB1      ALA   7 -10.324  -8.838  -8.838
   57   3HB   ALA   7           HB3      ALA   7 -10.775  -7.339  -7.339
   58    H    VAL   8           HN       VAL   8  -9.227  -9.876  -9.876
   59    HA   VAL   8           HA       VAL   8  -7.162 -11.703 -11.703
   60    HB   VAL   8           HB       VAL   8  -9.547 -12.199 -12.199
   61   1HG1  VAL   8          HG11      VAL   8  -9.952 -12.663 -12.663
   62   2HG1  VAL   8          HG13      VAL   8 -10.543 -13.942 -13.942
   63   3HG1  VAL   8          HG12      VAL   8 -11.122 -12.275 -12.275
   64   1HG2  VAL   8          HG21      VAL   8  -7.368 -13.760 -13.760
   65   2HG2  VAL   8          HG23      VAL   8  -8.789 -14.256 -14.256
   66   3HG2  VAL   8          HG22      VAL   8  -8.637 -14.638 -14.638
   67    H    VAL   9           HN       VAL   9  -6.644 -13.348 -13.348
   68    HA   VAL   9           HA       VAL   9  -7.331 -12.550 -12.550
   69    HB   VAL   9           HB       VAL   9  -4.695 -12.597 -12.597
   70   1HG1  VAL   9          HG11      VAL   9  -5.084 -12.888 -12.888
   71   2HG1  VAL   9          HG13      VAL   9  -3.552 -12.486 -12.486
   72   3HG1  VAL   9          HG12      VAL   9  -4.297 -14.059 -14.059
   73   1HG2  VAL   9          HG23      VAL   9  -6.136 -10.552 -10.552
   74   2HG2  VAL   9          HG22      VAL   9  -4.467 -10.448 -10.448
   75   3HG2  VAL   9          HG21      VAL   9  -5.772 -10.775 -10.775
   76    H    LEU  10           HN       LEU  10  -7.773 -14.253 -14.253
   77    HA   LEU  10           HA       LEU  10  -7.382 -16.988 -16.988
   78   1HB   LEU  10           HB2      LEU  10  -8.741 -15.711 -15.711
   79   2HB   LEU  10           HB1      LEU  10  -8.689 -17.454 -17.454
   80    HG   LEU  10           HG       LEU  10 -10.779 -16.603 -16.603
   81   1HD1  LEU  10          HD11      LEU  10  -9.109 -18.226 -18.226
   82   2HD1  LEU  10          HD13      LEU  10  -9.441 -16.973 -16.973
   83   3HD1  LEU  10          HD12      LEU  10 -10.772 -17.878 -17.878
   84   1HD2  LEU  10          HD23      LEU  10  -9.763 -14.264 -14.264
   85   2HD2  LEU  10          HD22      LEU  10 -11.035 -14.845 -14.845
   86   3HD2  LEU  10          HD21      LEU  10  -9.348 -14.923 -14.923
   87    H    ALA  11           HN       ALA  11  -5.675 -18.266 -18.266
   88    HA   ALA  11           HA       ALA  11  -3.963 -17.219 -17.219
   89   1HB   ALA  11           HB1      ALA  11  -3.166 -17.633 -17.633
   90   2HB   ALA  11           HB3      ALA  11  -3.291 -19.350 -19.350
   91   3HB   ALA  11           HB2      ALA  11  -2.181 -18.323 -18.323
   92    H    SER  12           HN       SER  12  -3.158 -18.714 -18.714
   93    HA   SER  12           HA       SER  12  -5.073 -20.737 -20.737
   94   1HB   SER  12           HB2      SER  12  -2.284 -19.995 -19.995
   95   2HB   SER  12           HB1      SER  12  -3.422 -20.998 -20.998
   96    HG   SER  12           HG       SER  12  -3.386 -18.695 -18.695
   97    H    SER  13           HN       SER  13  -4.136 -22.996 -22.996
   98    HA   SER  13           HA       SER  13  -3.348 -24.407 -24.407
   99   1HB   SER  13           HB2      SER  13  -3.047 -25.111 -25.111
  100   2HB   SER  13           HB1      SER  13  -2.989 -26.266 -26.266
  101    HG   SER  13           HG       SER  13  -5.074 -26.325 -26.325
  102    H    ARG  14           HN       ARG  14  -1.419 -23.171 -23.171
  103    HA   ARG  14           HA       ARG  14   1.101 -24.295 -24.295
  104   1HB   ARG  14           HB2      ARG  14   0.427 -23.188 -23.188
  105   2HB   ARG  14           HB1      ARG  14   0.579 -21.642 -21.642
  106   1HG   ARG  14           HG2      ARG  14   2.837 -21.673 -21.673
  107   2HG   ARG  14           HG1      ARG  14   2.926 -23.278 -23.278
  108   1HD   ARG  14           HD2      ARG  14   3.494 -24.062 -24.062
  109   2HD   ARG  14           HD1      ARG  14   1.861 -23.659 -23.659
  110    HE   ARG  14           HE       ARG  14   2.712 -21.690 -21.690
  111   1HH1  ARG  14          HH21      ARG  14   5.071 -23.061 -23.061
  112   2HH1  ARG  14          HH22      ARG  14   6.323 -21.989 -21.989
  113   1HH2  ARG  14          HH11      ARG  14   4.361 -20.323 -20.323
  114   2HH2  ARG  14          HH12      ARG  14   5.928 -20.455 -20.455
  115    H    GLY  15           HN       GLY  15  -0.645 -21.487 -21.487
  116   1HA   GLY  15           HA2      GLY  15  -0.187 -20.711 -20.711
  117   2HA   GLY  15           HA1      GLY  15   1.518 -21.069 -21.069
  118    H    ILE  16           HN       ILE  16  -0.746 -19.377 -19.377
  119    HA   ILE  16           HA       ILE  16   1.139 -17.083 -17.083
  120    HB   ILE  16           HB       ILE  16  -1.030 -18.212 -18.212
  121   1HG1  ILE  16          HG12      ILE  16   0.722 -18.238 -18.238
  122   2HG1  ILE  16          HG11      ILE  16   1.804 -17.338 -17.338
  123   1HG2  ILE  16          HG23      ILE  16  -0.032 -15.389 -15.389
  124   2HG2  ILE  16          HG22      ILE  16  -0.252 -16.104 -16.104
  125   3HG2  ILE  16          HG21      ILE  16  -1.615 -16.001 -16.001
  126   1HD1  ILE  16          HD12      ILE  16   0.754 -19.942 -19.942
  127   2HD1  ILE  16          HD11      ILE  16   1.961 -19.991 -19.991
  128   3HD1  ILE  16          HD13      ILE  16   2.332 -19.185 -19.185
  129    H    ALA  17           HN       ALA  17   0.559 -15.778 -15.778
  130    HA   ALA  17           HA       ALA  17  -2.329 -15.029 -15.029
  131   1HB   ALA  17           HB1      ALA  17   0.044 -15.115 -15.115
  132   2HB   ALA  17           HB3      ALA  17  -1.353 -14.116 -14.116
  133   3HB   ALA  17           HB2      ALA  17  -1.539 -15.859 -15.859
  134    H    SER  18           HN       SER  18  -2.722 -13.173 -13.173
  135    HA   SER  18           HA       SER  18  -0.668 -10.992 -10.992
  136   1HB   SER  18           HB2      SER  18  -2.385 -11.898 -11.898
  137   2HB   SER  18           HB1      SER  18  -1.275 -10.531 -10.531
  138    HG   SER  18           HG       SER  18  -0.775 -13.260 -13.260
  139    H    PHE  19           HN       PHE  19  -1.473  -9.072  -9.072
  140    HA   PHE  19           HA       PHE  19  -4.317  -8.378  -8.378
  141   1HB   PHE  19           HB2      PHE  19  -4.579  -7.883  -7.883
  142   2HB   PHE  19           HB1      PHE  19  -4.328  -9.589  -9.589
  143    HD1  PHE  19           HD1      PHE  19  -2.093 -10.655 -10.655
  144    HD2  PHE  19           HD2      PHE  19  -2.962  -6.582  -6.582
  145    HE1  PHE  19           HE1      PHE  19  -0.111 -10.679 -10.679
  146    HE2  PHE  19           HE2      PHE  19  -0.976  -6.606  -6.606
  147    HZ   PHE  19           HZ       PHE  19   0.447  -8.659  -8.659
  148    H    VAL  20           HN       VAL  20  -4.684  -6.040  -6.040
  149    HA   VAL  20           HA       VAL  20  -2.131  -4.487  -4.487
  150    HB   VAL  20           HB       VAL  20  -4.830  -4.008  -4.008
  151   1HG1  VAL  20          HG13      VAL  20  -3.669  -1.892  -1.892
  152   2HG1  VAL  20          HG12      VAL  20  -2.233  -2.467  -2.467
  153   3HG1  VAL  20          HG11      VAL  20  -3.722  -2.155  -2.155
  154   1HG2  VAL  20          HG22      VAL  20  -3.250  -5.871  -5.871
  155   2HG2  VAL  20          HG21      VAL  20  -3.856  -4.699  -4.699
  156   3HG2  VAL  20          HG23      VAL  20  -2.218  -4.544  -4.544
  157    H    CYS  21           HN       CYS  21  -1.811  -3.176  -3.176
  158    HA   CYS  21           HA       CYS  21  -4.147  -2.306  -2.306
  159   1HB   CYS  21           HB2      CYS  21  -2.247  -3.587  -3.587
  160   2HB   CYS  21           HB1      CYS  21  -1.149  -2.301  -2.301
  161    H    GLU  22           HN       GLU  22  -4.866  -0.320  -0.320
  162    HA   GLU  22           HA       GLU  22  -2.996   1.538   1.538
  163   1HB   GLU  22           HB2      GLU  22  -4.965   2.705   2.705
  164   2HB   GLU  22           HB1      GLU  22  -5.418   1.005   1.005
  165   1HG   GLU  22           HG2      GLU  22  -6.329   1.268   1.268
  166   2HG   GLU  22           HG1      GLU  22  -5.963   2.988   2.988
  167    H    TYR  23           HN       TYR  23  -2.828   3.835   3.835
  168    HA   TYR  23           HA       TYR  23  -3.224   4.221   4.221
  169   1HB   TYR  23           HB2      TYR  23  -0.898   4.826   4.826
  170   2HB   TYR  23           HB1      TYR  23  -0.945   3.293   3.293
  171    HD1  TYR  23           HD1      TYR  23  -0.332   3.130   3.130
  172    HD2  TYR  23           HD2      TYR  23  -0.248   6.917   6.917
  173    HE1  TYR  23           HE1      TYR  23   0.998   4.137   4.137
  174    HE2  TYR  23           HE2      TYR  23   1.083   7.924   7.924
  175    HH   TYR  23           HH       TYR  23   1.248   7.049   7.049
  176    H    ALA  24           HN       ALA  24  -2.582   6.634   6.634
  177    HA   ALA  24           HA       ALA  24  -3.520   8.379   8.379
  178   1HB   ALA  24           HB1      ALA  24  -4.331   8.289   8.289
  179   2HB   ALA  24           HB3      ALA  24  -4.731   9.638   9.638
  180   3HB   ALA  24           HB2      ALA  24  -5.360   8.027   8.027
  181    H    SER  25           HN       SER  25  -2.185  10.105  10.105
  182    HA   SER  25           HA       SER  25  -0.373  11.004  11.004
  183   1HB   SER  25           HB2      SER  25   1.420  11.136  11.136
  184   2HB   SER  25           HB1      SER  25   0.759   9.504   9.504
  185    HG   SER  25           HG       SER  25   0.939  11.107  11.107
  186    HA   PRO  26           HA       PRO  26  -1.776  15.040  15.040
  187   1HB   PRO  26           HB2      PRO  26   0.446  16.566  16.566
  188   2HB   PRO  26           HB1      PRO  26  -0.573  15.886  15.886
  189   1HG   PRO  26           HG2      PRO  26   2.018  14.885  14.885
  190   2HG   PRO  26           HG1      PRO  26   1.459  14.972  14.972
  191   1HD   PRO  26           HD2      PRO  26   1.428  12.672  12.672
  192   2HD   PRO  26           HD1      PRO  26   0.213  13.043  13.043
  193    H    GLY  27           HN       GLY  27   0.943  13.623  13.623
  194   1HA   GLY  27           HA2      GLY  27   0.241  14.860  14.860
  195   2HA   GLY  27           HA1      GLY  27   1.695  15.603  15.603
  196    H    LYS  28           HN       LYS  28   2.481  14.560  14.560
  197    HA   LYS  28           HA       LYS  28   3.102  11.659  11.659
  198   1HB   LYS  28           HB2      LYS  28   3.351  13.640  13.640
  199   2HB   LYS  28           HB1      LYS  28   3.761  11.928  11.928
  200   1HG   LYS  28           HG2      LYS  28   1.447  11.327  11.327
  201   2HG   LYS  28           HG1      LYS  28   1.033  13.039  13.039
  202   1HD   LYS  28           HD2      LYS  28   0.330  12.327  12.327
  203   2HD   LYS  28           HD1      LYS  28   1.807  13.260  13.260
  204   1HE   LYS  28           HE2      LYS  28   3.129  11.203  11.203
  205   2HE   LYS  28           HE1      LYS  28   1.686  10.227  10.227
  206   1HZ   LYS  28           HZ2      LYS  28   1.960  12.139  12.139
  207   2HZ   LYS  28           HZ1      LYS  28   2.091  10.451  10.451
  208   3HZ   LYS  28           HZ3      LYS  28   0.616  11.150  11.150
  209    H    ALA  29           HN       ALA  29   5.204  10.976  10.976
  210    HA   ALA  29           HA       ALA  29   7.425  12.968  12.968
  211   1HB   ALA  29           HB2      ALA  29   6.557  11.307  11.307
  212   2HB   ALA  29           HB1      ALA  29   8.171  12.010  12.010
  213   3HB   ALA  29           HB3      ALA  29   6.753  13.058  13.058
  214    H    THR  30           HN       THR  30   9.594  11.777  11.777
  215    HA   THR  30           HA       THR  30   9.661   9.448   9.448
  216    HB   THR  30           HB       THR  30  12.145   9.656   9.656
  217    HG1  THR  30           HG1      THR  30  12.593  11.155  11.155
  218   1HG2  THR  30          HG23      THR  30  10.537  11.068  11.068
  219   2HG2  THR  30          HG22      THR  30  11.773  12.159  12.159
  220   3HG2  THR  30          HG21      THR  30  12.240  10.620  10.620
  221    H    GLU  31           HN       GLU  31   9.345   9.780   9.780
  222    HA   GLU  31           HA       GLU  31  10.507   7.028   7.028
  223   1HB   GLU  31           HB2      GLU  31  10.534   9.377   9.377
  224   2HB   GLU  31           HB1      GLU  31  11.325   7.829   7.829
  225   1HG   GLU  31           HG2      GLU  31  12.058   9.310   9.310
  226   2HG   GLU  31           HG1      GLU  31  12.627   9.978   9.978
  227    H    VAL  32           HN       VAL  32   8.736   5.719   5.719
  228    HA   VAL  32           HA       VAL  32   6.863   6.465   6.465
  229    HB   VAL  32           HB       VAL  32   6.325   5.105   5.105
  230   1HG1  VAL  32          HG12      VAL  32   4.824   5.122   5.122
  231   2HG1  VAL  32          HG11      VAL  32   3.877   5.370   5.370
  232   3HG1  VAL  32          HG13      VAL  32   4.844   3.906   3.906
  233   1HG2  VAL  32          HG23      VAL  32   5.764   7.769   7.769
  234   2HG2  VAL  32          HG22      VAL  32   6.144   7.357   7.357
  235   3HG2  VAL  32          HG21      VAL  32   4.522   7.074   7.074
  236    H    ARG  33           HN       ARG  33   8.490   5.280   5.280
  237    HA   ARG  33           HA       ARG  33   9.365   2.626   2.626
  238   1HB   ARG  33           HB2      ARG  33  10.184   4.341   4.341
  239   2HB   ARG  33           HB1      ARG  33   8.809   3.881   3.881
  240   1HG   ARG  33           HG2      ARG  33   9.576   1.566   1.566
  241   2HG   ARG  33           HG1      ARG  33  10.920   1.957   1.957
  242   1HD   ARG  33           HD2      ARG  33  11.848   3.498   3.498
  243   2HD   ARG  33           HD1      ARG  33  10.482   3.150   3.150
  244    HE   ARG  33           HE       ARG  33  11.488   0.641   0.641
  245   1HH1  ARG  33          HH21      ARG  33  12.817   3.545   3.545
  246   2HH1  ARG  33          HH22      ARG  33  13.979   2.672   2.672
  247   1HH2  ARG  33          HH11      ARG  33  13.007  -0.445  -0.445
  248   2HH2  ARG  33          HH12      ARG  33  14.089   0.436   0.436
  249    H    VAL  34           HN       VAL  34   8.268   0.745   0.745
  250    HA   VAL  34           HA       VAL  34   5.706   0.572   0.572
  251    HB   VAL  34           HB       VAL  34   5.060  -1.087  -1.087
  252   1HG1  VAL  34          HG12      VAL  34   4.669   1.369   1.369
  253   2HG1  VAL  34          HG11      VAL  34   6.145   1.411   1.411
  254   3HG1  VAL  34          HG13      VAL  34   4.773   0.438   0.438
  255   1HG2  VAL  34          HG22      VAL  34   7.828  -1.276  -1.276
  256   2HG2  VAL  34          HG21      VAL  34   6.552  -2.096  -2.096
  257   3HG2  VAL  34          HG23      VAL  34   7.177  -0.543  -0.543
  258    H    THR  35           HN       THR  35   5.358  -1.466  -1.466
  259    HA   THR  35           HA       THR  35   7.708  -3.281  -3.281
  260    HB   THR  35           HB       THR  35   6.305  -2.062  -2.062
  261    HG1  THR  35           HG1      THR  35   7.409  -0.415  -0.415
  262   1HG2  THR  35          HG21      THR  35   8.709  -3.828  -3.828
  263   2HG2  THR  35          HG23      THR  35   8.535  -2.868  -2.868
  264   3HG2  THR  35          HG22      THR  35   7.331  -4.092  -4.092
  265    H    VAL  36           HN       VAL  36   7.139  -5.386  -5.386
  266    HA   VAL  36           HA       VAL  36   4.230  -5.982  -5.982
  267    HB   VAL  36           HB       VAL  36   6.440  -7.483  -7.483
  268   1HG1  VAL  36          HG11      VAL  36   3.510  -8.131  -8.131
  269   2HG1  VAL  36          HG13      VAL  36   4.522  -8.932  -8.932
  270   3HG1  VAL  36          HG12      VAL  36   4.898  -9.089  -9.089
  271   1HG2  VAL  36          HG22      VAL  36   4.126  -5.763  -5.763
  272   2HG2  VAL  36          HG21      VAL  36   5.813  -5.686  -5.686
  273   3HG2  VAL  36          HG23      VAL  36   4.784  -7.003  -7.003
  274    H    LEU  37           HN       LEU  37   3.839  -6.940  -6.940
  275    HA   LEU  37           HA       LEU  37   6.228  -8.306  -8.306
  276   1HB   LEU  37           HB2      LEU  37   3.867  -6.864  -6.864
  277   2HB   LEU  37           HB1      LEU  37   5.197  -7.592  -7.592
  278    HG   LEU  37           HG       LEU  37   5.780  -5.550  -5.550
  279   1HD1  LEU  37          HD12      LEU  37   3.976  -4.904  -4.904
  280   2HD1  LEU  37          HD11      LEU  37   5.459  -4.647  -4.647
  281   3HD1  LEU  37          HD13      LEU  37   5.189  -3.760  -3.760
  282   1HD2  LEU  37          HD21      LEU  37   7.210  -7.062  -7.062
  283   2HD2  LEU  37          HD23      LEU  37   7.856  -5.930  -5.930
  284   3HD2  LEU  37          HD22      LEU  37   7.344  -5.344  -5.344
  285    H    ARG  38           HN       ARG  38   5.809 -10.177 -10.177
  286    HA   ARG  38           HA       ARG  38   3.183 -11.510 -11.510
  287   1HB   ARG  38           HB2      ARG  38   5.978 -12.573 -12.573
  288   2HB   ARG  38           HB1      ARG  38   4.554 -13.615 -13.615
  289   1HG   ARG  38           HG2      ARG  38   3.989 -12.644 -12.644
  290   2HG   ARG  38           HG1      ARG  38   5.600 -11.940 -11.940
  291   1HD   ARG  38           HD2      ARG  38   4.980 -14.904 -14.904
  292   2HD   ARG  38           HD1      ARG  38   5.625 -14.124 -14.124
  293    HE   ARG  38           HE       ARG  38   7.286 -13.412 -13.412
  294   1HH1  ARG  38          HH21      ARG  38   6.463 -16.199 -16.199
  295   2HH1  ARG  38          HH22      ARG  38   8.002 -16.947 -16.947
  296   1HH2  ARG  38          HH11      ARG  38   9.261 -14.416 -14.416
  297   2HH2  ARG  38          HH12      ARG  38   9.571 -15.951 -15.951
  298    H    GLN  39           HN       GLN  39   1.885 -11.712 -11.712
  299    HA   GLN  39           HA       GLN  39   3.062 -11.249 -11.249
  300   1HB   GLN  39           HB2      GLN  39   1.089  -9.987  -9.987
  301   2HB   GLN  39           HB1      GLN  39   0.205 -11.499 -11.499
  302   1HG   GLN  39           HG2      GLN  39   0.964 -11.747 -11.747
  303   2HG   GLN  39           HG1      GLN  39   1.025  -9.987  -9.987
  304   1HE2  GLN  39          HE22      GLN  39  -2.466  -9.629  -9.629
  305   2HE2  GLN  39          HE21      GLN  39  -0.939  -8.893  -8.893
  306    H    ALA  40           HN       ALA  40   3.074 -12.747 -12.747
  307    HA   ALA  40           HA       ALA  40   1.816 -15.418 -15.418
  308   1HB   ALA  40           HB2      ALA  40   4.463 -14.924 -14.924
  309   2HB   ALA  40           HB1      ALA  40   4.441 -15.274 -15.274
  310   3HB   ALA  40           HB3      ALA  40   3.850 -16.473 -16.473
  311    H    ASP  41           HN       ASP  41   1.347 -16.568 -16.568
  312    HA   ASP  41           HA       ASP  41   0.299 -14.945 -14.945
  313   1HB   ASP  41           HB2      ASP  41   1.109 -17.829 -17.829
  314   2HB   ASP  41           HB1      ASP  41   0.282 -17.186 -17.186
  315    H    SER  42           HN       SER  42   3.362 -16.755 -16.755
  316    HA   SER  42           HA       SER  42   4.288 -16.033 -16.033
  317   1HB   SER  42           HB2      SER  42   5.614 -17.030 -17.030
  318   2HB   SER  42           HB1      SER  42   6.487 -16.827 -16.827
  319    HG   SER  42           HG       SER  42   5.073 -18.889 -18.889
  320    H    GLN  43           HN       GLN  43   5.096 -14.733 -14.733
  321    HA   GLN  43           HA       GLN  43   5.589 -12.072 -12.072
  322   1HB   GLN  43           HB2      GLN  43   7.578 -13.423 -13.423
  323   2HB   GLN  43           HB1      GLN  43   7.849 -13.792 -13.792
  324   1HG   GLN  43           HG2      GLN  43   8.210 -11.474 -11.474
  325   2HG   GLN  43           HG1      GLN  43   7.733 -10.986 -10.986
  326   1HE2  GLN  43          HE22      GLN  43  11.513 -11.231 -11.231
  327   2HE2  GLN  43          HE21      GLN  43  10.353 -10.425 -10.425
  328    H    VAL  44           HN       VAL  44   6.426 -10.582 -10.582
  329    HA   VAL  44           HA       VAL  44   5.451 -11.471 -11.471
  330    HB   VAL  44           HB       VAL  44   5.509  -8.730  -8.730
  331   1HG1  VAL  44          HG13      VAL  44   5.700  -9.002  -9.002
  332   2HG1  VAL  44          HG12      VAL  44   3.990  -9.421  -9.421
  333   3HG1  VAL  44          HG11      VAL  44   4.548  -7.846  -7.846
  334   1HG2  VAL  44          HG23      VAL  44   3.782 -10.751 -10.751
  335   2HG2  VAL  44          HG22      VAL  44   3.330  -9.047  -9.047
  336   3HG2  VAL  44          HG21      VAL  44   2.956 -10.017 -10.017
  337    H    THR  45           HN       THR  45   6.903 -11.124 -11.124
  338    HA   THR  45           HA       THR  45   9.491  -9.745  -9.745
  339    HB   THR  45           HB       THR  45  10.588 -11.554 -11.554
  340    HG1  THR  45           HG1      THR  45   9.165 -12.369 -12.369
  341   1HG2  THR  45          HG22      THR  45  10.098 -11.708 -11.708
  342   2HG2  THR  45          HG21      THR  45   8.769 -12.783 -12.783
  343   3HG2  THR  45          HG23      THR  45  10.429 -13.231 -13.231
  344    H    GLU  46           HN       GLU  46  10.648  -8.927  -8.927
  345    HA   GLU  46           HA       GLU  46   8.855  -7.727  -7.727
  346   1HB   GLU  46           HB2      GLU  46  11.835  -7.676  -7.676
  347   2HB   GLU  46           HB1      GLU  46  11.071  -6.743  -6.743
  348   1HG   GLU  46           HG2      GLU  46   9.670  -5.573  -5.573
  349   2HG   GLU  46           HG1      GLU  46  10.323  -6.557  -6.557
  350    H    VAL  47           HN       VAL  47   9.054  -8.003  -8.003
  351    HA   VAL  47           HA       VAL  47  10.384 -10.559 -10.559
  352    HB   VAL  47           HB       VAL  47   7.594  -9.497  -9.497
  353   1HG1  VAL  47          HG12      VAL  47   9.031 -11.688 -11.688
  354   2HG1  VAL  47          HG11      VAL  47   7.267 -11.601 -11.601
  355   3HG1  VAL  47          HG13      VAL  47   8.168 -10.302 -10.302
  356   1HG2  VAL  47          HG23      VAL  47   8.886 -11.605 -11.605
  357   2HG2  VAL  47          HG22      VAL  47   7.333 -10.803 -10.803
  358   3HG2  VAL  47          HG21      VAL  47   7.466 -12.148 -12.148
  359    H    CYS  48           HN       CYS  48   8.437  -8.353  -8.353
  360    HA   CYS  48           HA       CYS  48  10.895  -7.871  -7.871
  361   1HB   CYS  48           HB2      CYS  48   7.934  -7.822  -7.822
  362   2HB   CYS  48           HB1      CYS  48   9.242  -7.582  -7.582
  363    H    ALA  49           HN       ALA  49  11.335  -5.759  -5.759
  364    HA   ALA  49           HA       ALA  49   9.598  -3.507  -3.507
  365   1HB   ALA  49           HB3      ALA  49  11.903  -4.474  -4.474
  366   2HB   ALA  49           HB2      ALA  49  12.049  -2.769  -2.769
  367   3HB   ALA  49           HB1      ALA  49  10.647  -3.332  -3.332
  368    H    ALA  50           HN       ALA  50   9.985  -1.717  -1.717
  369    HA   ALA  50           HA       ALA  50  12.509  -1.308  -1.308
  370   1HB   ALA  50           HB3      ALA  50  10.048  -2.479  -2.479
  371   2HB   ALA  50           HB2      ALA  50  11.241  -1.586  -1.586
  372   3HB   ALA  50           HB1      ALA  50  11.711  -3.057  -3.057
  373    H    THR  51           HN       THR  51  12.344   0.698   0.698
  374    HA   THR  51           HA       THR  51  10.305   2.558   2.558
  375    HB   THR  51           HB       THR  51  12.658   3.258   3.258
  376    HG1  THR  51           HG1      THR  51  13.829   2.476   2.476
  377   1HG2  THR  51          HG21      THR  51  10.604   4.731   4.731
  378   2HG2  THR  51          HG23      THR  51  12.106   5.055   5.055
  379   3HG2  THR  51          HG22      THR  51  12.007   5.356   5.356
  380    H    TYR  52           HN       TYR  52   8.461   2.778   2.778
  381    HA   TYR  52           HA       TYR  52   8.372   2.016   2.016
  382   1HB   TYR  52           HB2      TYR  52   6.383   1.688   1.688
  383   2HB   TYR  52           HB1      TYR  52   6.531   3.199   3.199
  384    HD1  TYR  52           HD1      TYR  52   6.941   3.241   3.241
  385    HD2  TYR  52           HD2      TYR  52   4.174   3.683   3.683
  386    HE1  TYR  52           HE1      TYR  52   5.262   4.254   4.254
  387    HE2  TYR  52           HE2      TYR  52   2.503   4.716   4.716
  388    HH   TYR  52           HH       TYR  52   3.176   5.984   5.984
  389    H    MET  53           HN       MET  53   9.926   3.298   3.298
  390    HA   MET  53           HA       MET  53   9.762   6.237   6.237
  391   1HB   MET  53           HB2      MET  53  11.341   4.423   4.423
  392   2HB   MET  53           HB1      MET  53  11.675   6.120   6.120
  393   1HG   MET  53           HG2      MET  53  11.895   3.811   3.811
  394   2HG   MET  53           HG1      MET  53  13.221   4.767   4.767
  395   1HE   MET  53           HE1      MET  53  13.868   6.628   6.628
  396   2HE   MET  53           HE3      MET  53  13.153   8.024   8.024
  397   3HE   MET  53           HE2      MET  53  14.163   6.874   6.874
  398    H    MET  54           HN       MET  54   8.414   7.351   7.351
  399    HA   MET  54           HA       MET  54   6.527   5.958   5.958
  400   1HB   MET  54           HB2      MET  54   7.589   8.803   8.803
  401   2HB   MET  54           HB1      MET  54   6.085   8.233   8.233
  402   1HG   MET  54           HG2      MET  54   6.747   8.297   8.297
  403   2HG   MET  54           HG1      MET  54   5.590   9.328   9.328
  404   1HE   MET  54           HE3      MET  54   5.179   8.107   8.107
  405   2HE   MET  54           HE2      MET  54   3.666   7.203   7.203
  406   3HE   MET  54           HE1      MET  54   5.199   6.340   6.340
  407    H    GLY  55           HN       GLY  55   9.779   7.065   7.065
  408   1HA   GLY  55           HA2      GLY  55   9.357   6.317   6.317
  409   2HA   GLY  55           HA1      GLY  55  10.677   7.318   7.318
  410    H    ASN  56           HN       ASN  56   9.973   4.469   4.469
  411    HA   ASN  56           HA       ASN  56  11.986   2.847   2.847
  412   1HB   ASN  56           HB2      ASN  56  12.824   4.561   4.561
  413   2HB   ASN  56           HB1      ASN  56  12.474   3.135   3.135
  414   1HD2  ASN  56          HD22      ASN  56  15.699   1.977   1.977
  415   2HD2  ASN  56          HD21      ASN  56  14.662   2.482   2.482
  416    H    GLU  57           HN       GLU  57  12.356   0.727   0.727
  417    HA   GLU  57           HA       GLU  57   9.633  -0.258  -0.258
  418   1HB   GLU  57           HB2      GLU  57  12.153  -1.635  -1.635
  419   2HB   GLU  57           HB1      GLU  57  10.656  -2.474  -2.474
  420   1HG   GLU  57           HG2      GLU  57  10.895  -0.290  -0.290
  421   2HG   GLU  57           HG1      GLU  57  10.856  -2.018  -2.018
  422    H    LEU  58           HN       LEU  58   9.487  -1.697  -1.697
  423    HA   LEU  58           HA       LEU  58  11.040  -0.877  -0.877
  424   1HB   LEU  58           HB2      LEU  58   9.058  -3.100  -3.100
  425   2HB   LEU  58           HB1      LEU  58   9.701  -2.774  -2.774
  426    HG   LEU  58           HG       LEU  58   8.350  -0.650  -0.650
  427   1HD1  LEU  58          HD13      LEU  58   7.160  -2.428  -2.428
  428   2HD1  LEU  58          HD12      LEU  58   6.348  -1.058  -1.058
  429   3HD1  LEU  58          HD11      LEU  58   6.755  -2.481  -2.481
  430   1HD2  LEU  58          HD22      LEU  58   8.995  -0.907  -0.907
  431   2HD2  LEU  58          HD21      LEU  58   9.813   0.148   0.148
  432   3HD2  LEU  58          HD23      LEU  58   8.127   0.442   0.442
  433    H    THR  59           HN       THR  59  12.778  -1.906  -1.906
  434    HA   THR  59           HA       THR  59  14.008  -4.205  -4.205
  435    HB   THR  59           HB       THR  59  15.986  -3.357  -3.357
  436    HG1  THR  59           HG1      THR  59  15.691  -2.010  -2.010
  437   1HG2  THR  59          HG23      THR  59  15.272  -2.503  -2.503
  438   2HG2  THR  59          HG22      THR  59  14.617  -1.101  -1.101
  439   3HG2  THR  59          HG21      THR  59  16.344  -1.447  -1.447
  440    H    PHE  60           HN       PHE  60  13.612  -6.164  -6.164
  441    HA   PHE  60           HA       PHE  60  13.134  -6.244  -6.244
  442   1HB   PHE  60           HB2      PHE  60  12.397  -8.107  -8.107
  443   2HB   PHE  60           HB1      PHE  60  12.012  -8.408  -8.408
  444    HD1  PHE  60           HD2      PHE  60  10.614  -6.652  -6.652
  445    HD2  PHE  60           HD1      PHE  60  11.013  -6.710  -6.710
  446    HE1  PHE  60           HE2      PHE  60   8.574  -5.220  -5.220
  447    HE2  PHE  60           HE1      PHE  60   8.974  -5.278  -5.278
  448    HZ   PHE  60           HZ       PHE  60   7.754  -4.533  -4.533
  449    H    LEU  61           HN       LEU  61  15.835  -6.127  -6.127
  450    HA   LEU  61           HA       LEU  61  17.086  -8.662  -8.662
  451   1HB   LEU  61           HB2      LEU  61  18.060  -6.422  -6.422
  452   2HB   LEU  61           HB1      LEU  61  18.168  -6.113  -6.113
  453    HG   LEU  61           HG       LEU  61  19.624  -8.125  -8.125
  454   1HD1  LEU  61          HD11      LEU  61  19.252  -8.170  -8.170
  455   2HD1  LEU  61          HD13      LEU  61  20.626  -8.950  -8.950
  456   3HD1  LEU  61          HD12      LEU  61  18.985  -9.481  -9.481
  457   1HD2  LEU  61          HD21      LEU  61  20.612  -5.877  -5.877
  458   2HD2  LEU  61          HD23      LEU  61  21.614  -7.111  -7.111
  459   3HD2  LEU  61          HD22      LEU  61  20.570  -6.087  -6.087
  460    H    ASP  62           HN       ASP  62  16.425  -6.786  -6.786
  461    HA   ASP  62           HA       ASP  62  17.686  -8.831  -8.831
  462   1HB   ASP  62           HB2      ASP  62  16.095  -6.299  -6.299
  463   2HB   ASP  62           HB1      ASP  62  16.905  -7.245  -7.245
  464    H    ASP  63           HN       ASP  63  16.571 -10.577 -10.577
  465    HA   ASP  63           HA       ASP  63  14.765 -12.036 -12.036
  466   1HB   ASP  63           HB2      ASP  63  13.668  -9.297  -9.297
  467   2HB   ASP  63           HB1      ASP  63  12.822 -10.795 -10.795
  468    H    SER  64           HN       SER  64  15.026 -11.490 -11.490
  469    HA   SER  64           HA       SER  64  12.800 -10.395 -10.395
  470   1HB   SER  64           HB2      SER  64  13.680 -11.711 -11.711
  471   2HB   SER  64           HB1      SER  64  15.001 -11.004 -11.004
  472    HG   SER  64           HG       SER  64  15.628 -12.937 -12.937
  473    H    ILE  67           HN       ILE  67  12.914 -13.731 -13.731
  474    HA   ILE  67           HA       ILE  67  11.229 -15.370 -15.370
  475    HB   ILE  67           HB       ILE  67  11.066 -14.283 -14.283
  476   1HG1  ILE  67          HG12      ILE  67  12.533 -16.661 -16.661
  477   2HG1  ILE  67          HG11      ILE  67  13.286 -15.111 -15.111
  478   1HG2  ILE  67          HG21      ILE  67   9.842 -16.691 -16.691
  479   2HG2  ILE  67          HG23      ILE  67  10.306 -16.775 -16.775
  480   3HG2  ILE  67          HG22      ILE  67   9.116 -15.589 -15.589
  481   1HD1  ILE  67          HD11      ILE  67  12.274 -15.473 -15.473
  482   2HD1  ILE  67          HD13      ILE  67  12.140 -17.158 -17.158
  483   3HD1  ILE  67          HD12      ILE  67  13.721 -16.377 -16.377
  484    H    CYS  68           HN       CYS  68  10.509 -12.412 -12.412
  485    HA   CYS  68           HA       CYS  68   7.617 -12.833 -12.833
  486   1HB   CYS  68           HB2      CYS  68   7.067 -10.817 -10.817
  487   2HB   CYS  68           HB1      CYS  68   7.885 -12.040 -12.040
  488    H    THR  69           HN       THR  69   6.633 -11.173 -11.173
  489    HA   THR  69           HA       THR  69   8.535  -9.319  -9.319
  490    HB   THR  69           HB       THR  69   8.184 -11.365 -11.365
  491    HG1  THR  69           HG1      THR  69   7.938 -10.220 -10.220
  492   1HG2  THR  69          HG22      THR  69   5.568 -11.229 -11.229
  493   2HG2  THR  69          HG21      THR  69   5.406 -10.956 -10.956
  494   3HG2  THR  69          HG23      THR  69   6.199 -12.415 -12.415
  495    H    GLY  70           HN       GLY  70   7.603  -7.267  -7.267
  496   1HA   GLY  70           HA2      GLY  70   4.678  -7.000  -7.000
  497   2HA   GLY  70           HA1      GLY  70   5.766  -6.055  -6.055
  498    H    THR  71           HN       THR  71   3.784  -5.075  -5.075
  499    HA   THR  71           HA       THR  71   5.499  -3.487  -3.487
  500    HB   THR  71           HB       THR  71   2.731  -4.576  -4.576
  501    HG1  THR  71           HG1      THR  71   4.252  -6.179  -6.179
  502   1HG2  THR  71          HG21      THR  71   4.499  -2.954  -2.954
  503   2HG2  THR  71          HG23      THR  71   2.990  -3.723  -3.723
  504   3HG2  THR  71          HG22      THR  71   2.971  -2.440  -2.440
  505    H    SER  72           HN       SER  72   4.488  -1.362  -1.362
  506    HA   SER  72           HA       SER  72   2.473  -0.438  -0.438
  507   1HB   SER  72           HB2      SER  72   4.770  -0.108  -0.108
  508   2HB   SER  72           HB1      SER  72   5.175   0.846   0.846
  509    HG   SER  72           HG       SER  72   3.693   1.496   1.496
  510    H    SER  73           HN       SER  73   0.986   0.873   0.873
  511    HA   SER  73           HA       SER  73   1.856   2.447   2.447
  512   1HB   SER  73           HB2      SER  73  -0.071   1.567   1.567
  513   2HB   SER  73           HB1      SER  73   0.953   0.237   0.237
  514    HG   SER  73           HG       SER  73  -1.441   0.135   0.135
  515    H    GLY  74           HN       GLY  74   0.948   4.488   4.488
  516   1HA   GLY  74           HA2      GLY  74  -0.293   6.313   6.313
  517   2HA   GLY  74           HA1      GLY  74  -1.650   5.187   5.187
  518    H    ASN  75           HN       ASN  75  -2.576   5.156   5.156
  519    HA   ASN  75           HA       ASN  75  -0.871   5.569   5.569
  520   1HB   ASN  75           HB2      ASN  75  -3.849   5.819   5.819
  521   2HB   ASN  75           HB1      ASN  75  -3.090   6.120   6.120
  522   1HD2  ASN  75          HD22      ASN  75  -3.208   9.121   9.121
  523   2HD2  ASN  75          HD21      ASN  75  -4.244   7.777   7.777
  524    H    GLN  76           HN       GLN  76  -1.607   2.955   2.955
  525    HA   GLN  76           HA       GLN  76  -2.558   1.358   1.358
  526   1HB   GLN  76           HB2      GLN  76  -2.963   1.101   1.101
  527   2HB   GLN  76           HB1      GLN  76  -3.362  -0.197  -0.197
  528   1HG   GLN  76           HG2      GLN  76  -4.912   1.257   1.257
  529   2HG   GLN  76           HG1      GLN  76  -4.467   2.620   2.620
  530   1HE2  GLN  76          HE22      GLN  76  -6.605  -0.435  -0.435
  531   2HE2  GLN  76          HE21      GLN  76  -5.491  -0.811  -0.811
  532    H    VAL  77           HN       VAL  77  -0.995  -0.015  -0.015
  533    HA   VAL  77           HA       VAL  77   1.309  -0.698  -0.698
  534    HB   VAL  77           HB       VAL  77   2.460  -1.067  -1.067
  535   1HG1  VAL  77          HG13      VAL  77   1.319   1.362   1.362
  536   2HG1  VAL  77          HG12      VAL  77   0.803   1.053   1.053
  537   3HG1  VAL  77          HG11      VAL  77   2.521   1.052   1.052
  538   1HG2  VAL  77          HG23      VAL  77  -0.239  -1.552  -1.552
  539   2HG2  VAL  77          HG22      VAL  77   1.273  -2.412  -2.412
  540   3HG2  VAL  77          HG21      VAL  77   0.966  -0.856  -0.856
  541    H    ASN  78           HN       ASN  78   1.471  -2.788  -2.788
  542    HA   ASN  78           HA       ASN  78  -0.550  -4.781  -4.781
  543   1HB   ASN  78           HB2      ASN  78  -0.470  -3.930  -3.930
  544   2HB   ASN  78           HB1      ASN  78   1.103  -4.714  -4.714
  545    HD2  ASN  78          HD22      ASN  78  -1.880  -5.561  -5.561
  546    H    LEU  79           HN       LEU  79   0.272  -6.346  -6.346
  547    HA   LEU  79           HA       LEU  79   3.149  -7.142  -7.142
  548   1HB   LEU  79           HB2      LEU  79   1.162  -7.234  -7.234
  549   2HB   LEU  79           HB1      LEU  79   2.724  -8.047  -8.047
  550    HG   LEU  79           HG       LEU  79   2.357  -5.072  -5.072
  551   1HD1  LEU  79          HD11      LEU  79   2.891  -6.685  -6.685
  552   2HD1  LEU  79          HD13      LEU  79   3.496  -5.034  -5.034
  553   3HD1  LEU  79          HD12      LEU  79   1.763  -5.350  -5.350
  554   1HD2  LEU  79          HD22      LEU  79   4.774  -6.865  -6.865
  555   2HD2  LEU  79          HD21      LEU  79   4.413  -5.854  -5.854
  556   3HD2  LEU  79          HD23      LEU  79   4.847  -5.103  -5.103
  557    H    THR  80           HN       THR  80   3.575  -9.217  -9.217
  558    HA   THR  80           HA       THR  80   1.307 -11.197 -11.197
  559    HB   THR  80           HB       THR  80   3.647 -10.792 -10.792
  560    HG1  THR  80           HG1      THR  80   2.367  -9.476  -9.476
  561   1HG2  THR  80          HG22      THR  80   1.994 -13.065 -13.065
  562   2HG2  THR  80          HG21      THR  80   1.478 -12.341 -12.341
  563   3HG2  THR  80          HG23      THR  80   3.160 -12.817 -12.817
  564    H    ILE  81           HN       ILE  81   1.716 -13.103 -13.103
  565    HA   ILE  81           HA       ILE  81   4.530 -13.687 -13.687
  566    HB   ILE  81           HB       ILE  81   1.813 -14.284 -14.284
  567   1HG1  ILE  81          HG12      ILE  81   4.080 -12.626 -12.626
  568   2HG1  ILE  81          HG11      ILE  81   2.773 -11.934 -11.934
  569   1HG2  ILE  81          HG21      ILE  81   3.443 -16.138 -16.138
  570   2HG2  ILE  81          HG23      ILE  81   4.552 -14.961 -14.961
  571   3HG2  ILE  81          HG22      ILE  81   2.997 -15.285 -15.285
  572   1HD1  ILE  81          HD11      ILE  81   1.267 -13.298 -13.298
  573   2HD1  ILE  81          HD13      ILE  81   2.688 -13.101 -13.101
  574   3HD1  ILE  81          HD12      ILE  81   1.861 -11.682 -11.682
  575    H    GLN  82           HN       GLN  82   5.386 -15.596 -15.596
  576    HA   GLN  82           HA       GLN  82   3.459 -17.649 -17.649
  577   1HB   GLN  82           HB2      GLN  82   6.165 -16.820 -16.820
  578   2HB   GLN  82           HB1      GLN  82   5.184 -18.153 -18.153
  579   1HG   GLN  82           HG2      GLN  82   3.379 -16.614 -16.614
  580   2HG   GLN  82           HG1      GLN  82   4.282 -15.263 -15.263
  581   1HE2  GLN  82          HE22      GLN  82   5.416 -14.735 -14.735
  582   2HE2  GLN  82          HE21      GLN  82   4.416 -14.157 -14.157
  583    H    GLY  83           HN       GLY  83   3.603 -19.451 -19.451
  584   1HA   GLY  83           HA2      GLY  83   4.988 -21.420 -21.420
  585   2HA   GLY  83           HA1      GLY  83   6.268 -20.298 -20.298
  586    H    LEU  84           HN       LEU  84   2.780 -20.362 -20.362
  587    HA   LEU  84           HA       LEU  84   3.489 -19.902 -19.902
  588   1HB   LEU  84           HB2      LEU  84   0.956 -19.809 -19.809
  589   2HB   LEU  84           HB1      LEU  84   0.981 -19.518 -19.518
  590    HG   LEU  84           HG       LEU  84   2.731 -17.998 -17.998
  591   1HD1  LEU  84          HD12      LEU  84  -0.111 -17.598 -17.598
  592   2HD1  LEU  84          HD11      LEU  84   0.911 -16.173 -16.173
  593   3HD1  LEU  84          HD13      LEU  84   0.661 -17.260 -17.260
  594   1HD2  LEU  84          HD23      LEU  84   2.359 -18.091 -18.091
  595   2HD2  LEU  84          HD22      LEU  84   3.658 -17.360 -17.360
  596   3HD2  LEU  84          HD21      LEU  84   2.169 -16.462 -16.462
  597    H    ARG  85           HN       ARG  85   3.897 -21.813 -21.813
  598    HA   ARG  85           HA       ARG  85   2.446 -24.300 -24.300
  599   1HB   ARG  85           HB2      ARG  85   4.444 -23.463 -23.463
  600   2HB   ARG  85           HB1      ARG  85   3.893 -25.119 -25.119
  601   1HG   ARG  85           HG2      ARG  85   4.674 -24.822 -24.822
  602   2HG   ARG  85           HG1      ARG  85   5.525 -23.388 -23.388
  603   1HD   ARG  85           HD2      ARG  85   5.862 -26.104 -26.104
  604   2HD   ARG  85           HD1      ARG  85   6.919 -25.525 -25.525
  605    HE   ARG  85           HE       ARG  85   6.844 -24.488 -24.488
  606   1HH1  ARG  85          HH21      ARG  85   7.640 -23.785 -23.785
  607   2HH1  ARG  85          HH22      ARG  85   8.787 -22.566 -22.566
  608   1HH2  ARG  85          HH11      ARG  85   8.335 -22.900 -22.900
  609   2HH2  ARG  85          HH12      ARG  85   9.177 -22.067 -22.067
  610    H    ALA  86           HN       ALA  86   1.724 -25.418 -25.418
  611    HA   ALA  86           HA       ALA  86  -0.653 -24.104 -24.104
  612   1HB   ALA  86           HB2      ALA  86   0.101 -26.561 -26.561
  613   2HB   ALA  86           HB1      ALA  86   1.025 -26.065 -26.065
  614   3HB   ALA  86           HB3      ALA  86  -0.734 -25.912 -25.912
  615    H    MET  87           HN       MET  87   2.570 -24.332 -24.332
  616    HA   MET  87           HA       MET  87   2.032 -22.806 -22.806
  617   1HB   MET  87           HB2      MET  87   4.499 -23.538 -23.538
  618   2HB   MET  87           HB1      MET  87   4.581 -22.717 -22.717
  619   1HG   MET  87           HG2      MET  87   3.381 -24.567 -24.567
  620   2HG   MET  87           HG1      MET  87   3.193 -25.368 -25.368
  621   1HE   MET  87           HE2      MET  87   4.792 -26.061 -26.061
  622   2HE   MET  87           HE1      MET  87   6.252 -25.075 -25.075
  623   3HE   MET  87           HE3      MET  87   6.337 -26.796 -26.796
  624    H    ASP  88           HN       ASP  88   3.290 -21.922 -21.922
  625    HA   ASP  88           HA       ASP  88   4.077 -19.244 -19.244
  626   1HB   ASP  88           HB2      ASP  88   3.026 -20.632 -20.632
  627   2HB   ASP  88           HB1      ASP  88   3.682 -18.997 -18.997
  628    H    THR  89           HN       THR  89   0.870 -20.564 -20.564
  629    HA   THR  89           HA       THR  89  -0.572 -18.273 -18.273
  630    HB   THR  89           HB       THR  89  -1.421 -20.536 -20.536
  631    HG1  THR  89           HG1      THR  89  -1.251 -20.277 -20.277
  632   1HG2  THR  89          HG21      THR  89  -2.866 -18.374 -18.374
  633   2HG2  THR  89          HG23      THR  89  -3.175 -19.234 -19.234
  634   3HG2  THR  89          HG22      THR  89  -3.602 -19.976 -19.976
  635    H    GLY  90           HN       GLY  90  -1.281 -16.533 -16.533
  636   1HA   GLY  90           HA2      GLY  90  -1.830 -16.434 -16.434
  637   2HA   GLY  90           HA1      GLY  90  -0.131 -16.016 -16.016
  638    H    LEU  91           HN       LEU  91  -0.304 -13.862 -13.862
  639    HA   LEU  91           HA       LEU  91  -2.150 -12.102 -12.102
  640   1HB   LEU  91           HB2      LEU  91  -2.113 -12.256 -12.256
  641   2HB   LEU  91           HB1      LEU  91  -0.506 -11.549 -11.549
  642    HG   LEU  91           HG       LEU  91  -2.248  -9.854  -9.854
  643   1HD1  LEU  91          HD12      LEU  91  -0.151  -9.528  -9.528
  644   2HD1  LEU  91          HD11      LEU  91  -1.457  -9.059  -9.059
  645   3HD1  LEU  91          HD13      LEU  91  -1.243  -8.225  -8.225
  646   1HD2  LEU  91          HD23      LEU  91  -4.080 -10.944 -10.944
  647   2HD2  LEU  91          HD22      LEU  91  -3.885  -9.243  -9.243
  648   3HD2  LEU  91          HD21      LEU  91  -3.267 -10.499 -10.499
  649    H    TYR  92           HN       TYR  92  -1.318 -10.501 -10.501
  650    HA   TYR  92           HA       TYR  92   1.630 -10.011 -10.011
  651   1HB   TYR  92           HB2      TYR  92  -0.289 -10.473 -10.473
  652   2HB   TYR  92           HB1      TYR  92   1.190  -9.544  -9.544
  653    HD1  TYR  92           HD2      TYR  92   3.440 -10.581 -10.581
  654    HD2  TYR  92           HD1      TYR  92  -0.222 -12.879 -12.879
  655    HE1  TYR  92           HE2      TYR  92   4.760 -12.697 -12.697
  656    HE2  TYR  92           HE1      TYR  92   1.101 -14.998 -14.998
  657    HH   TYR  92           HH       TYR  92   4.128 -15.222 -15.222
  658    H    ILE  93           HN       ILE  93   2.033  -7.872  -7.872
  659    HA   ILE  93           HA       ILE  93  -0.246  -5.979  -5.979
  660    HB   ILE  93           HB       ILE  93   2.495  -6.023  -6.023
  661   1HG1  ILE  93          HG12      ILE  93   0.750  -5.727  -5.727
  662   2HG1  ILE  93          HG11      ILE  93  -0.302  -6.530  -6.530
  663   1HG2  ILE  93          HG21      ILE  93   0.699  -3.732  -3.732
  664   2HG2  ILE  93          HG23      ILE  93   1.138  -3.940  -3.940
  665   3HG2  ILE  93          HG22      ILE  93   2.396  -3.746  -3.746
  666   1HD1  ILE  93          HD12      ILE  93   1.507  -8.290  -8.290
  667   2HD1  ILE  93          HD11      ILE  93   2.298  -7.547  -7.547
  668   3HD1  ILE  93          HD13      ILE  93   0.687  -8.256  -8.256
  669    H    CYS  94           HN       CYS  94  -0.469  -4.596  -4.596
  670    HA   CYS  94           HA       CYS  94   1.820  -4.001  -4.001
  671   1HB   CYS  94           HB2      CYS  94   0.092  -2.834  -2.834
  672   2HB   CYS  94           HB1      CYS  94  -0.548  -4.397  -4.397
  673    H    LYS  95           HN       LYS  95   3.169  -2.305  -2.305
  674    HA   LYS  95           HA       LYS  95   2.142  -0.208  -0.208
  675   1HB   LYS  95           HB2      LYS  95   4.957  -1.110  -1.110
  676   2HB   LYS  95           HB1      LYS  95   4.487   0.039   0.039
  677   1HG   LYS  95           HG2      LYS  95   2.911  -2.287  -2.287
  678   2HG   LYS  95           HG1      LYS  95   4.563  -2.841  -2.841
  679   1HD   LYS  95           HD2      LYS  95   3.921  -0.565  -0.565
  680   2HD   LYS  95           HD1      LYS  95   3.927  -2.230  -2.230
  681   1HE   LYS  95           HE2      LYS  95   6.294  -2.440  -2.440
  682   2HE   LYS  95           HE1      LYS  95   6.265  -0.715  -0.715
  683   1HZ   LYS  95           HZ1      LYS  95   5.586  -1.811  -1.811
  684   2HZ   LYS  95           HZ3      LYS  95   7.092  -1.142  -1.142
  685   3HZ   LYS  95           HZ2      LYS  95   5.698  -0.171  -0.171
  686    H    VAL  96           HN       VAL  96   2.640   1.986   1.986
  687    HA   VAL  96           HA       VAL  96   3.923   2.533   2.533
  688    HB   VAL  96           HB       VAL  96   1.276   3.665   3.665
  689   1HG1  VAL  96          HG12      VAL  96   3.001   4.745   4.745
  690   2HG1  VAL  96          HG11      VAL  96   2.049   3.703   3.703
  691   3HG1  VAL  96          HG13      VAL  96   1.252   4.942   4.942
  692   1HG2  VAL  96          HG21      VAL  96   1.952   1.277   1.277
  693   2HG2  VAL  96          HG23      VAL  96   0.693   1.459   1.459
  694   3HG2  VAL  96          HG22      VAL  96   0.498   2.198   2.198
  695    H    GLU  97           HN       GLU  97   5.687   3.654   3.654
  696    HA   GLU  97           HA       GLU  97   5.039   5.964   5.964
  697   1HB   GLU  97           HB2      GLU  97   7.399   4.073   4.073
  698   2HB   GLU  97           HB1      GLU  97   7.131   5.426   5.426
  699   1HG   GLU  97           HG2      GLU  97   6.098   3.855   3.855
  700   2HG   GLU  97           HG1      GLU  97   4.741   4.079   4.079
  701    H    LEU  98           HN       LEU  98   5.571   7.845   7.845
  702    HA   LEU  98           HA       LEU  98   7.638   7.986   7.986
  703   1HB   LEU  98           HB2      LEU  98   5.872   9.905   9.905
  704   2HB   LEU  98           HB1      LEU  98   7.096  10.499  10.499
  705    HG   LEU  98           HG       LEU  98   6.074   8.915   8.915
  706   1HD1  LEU  98          HD11      LEU  98   4.119   8.682   8.682
  707   2HD1  LEU  98          HD13      LEU  98   3.561   8.533   8.533
  708   3HD1  LEU  98          HD12      LEU  98   4.786   7.424   7.424
  709   1HD2  LEU  98          HD21      LEU  98   4.607  11.300  11.300
  710   2HD2  LEU  98          HD23      LEU  98   5.645  11.223  11.223
  711   3HD2  LEU  98          HD22      LEU  98   4.048  10.474  10.474
  712    H    MET  99           HN       MET  99   9.167   6.905   6.905
  713    HA   MET  99           HA       MET  99   9.943   8.183   8.183
  714   1HB   MET  99           HB2      MET  99  10.049   5.745   5.745
  715   2HB   MET  99           HB1      MET  99  11.365   6.091   6.091
  716   1HG   MET  99           HG2      MET  99  12.867   6.588   6.588
  717   2HG   MET  99           HG1      MET  99  11.596   7.064   7.064
  718   1HE   MET  99           HE3      MET  99  10.003   5.732   5.732
  719   2HE   MET  99           HE2      MET  99   9.493   4.461   4.461
  720   3HE   MET  99           HE1      MET  99  10.152   4.033   4.033
  721    H    TYR 100           HN       TYR 100  11.440   8.112   8.112
  722    HA   TYR 100           HA       TYR 100  13.901   9.375   9.375
  723   1HB   TYR 100           HB2      TYR 100  12.462   9.096   9.096
  724   2HB   TYR 100           HB1      TYR 100  14.086   9.757   9.757
  725    HD1  TYR 100           HD2      TYR 100  11.977   6.709   6.709
  726    HD2  TYR 100           HD1      TYR 100  15.995   8.324   8.324
  727    HE1  TYR 100           HE2      TYR 100  12.912   4.390   4.390
  728    HE2  TYR 100           HE1      TYR 100  16.923   6.002   6.002
  729    HH   TYR 100           HH       TYR 100  15.570   3.488   3.488
  730    HA   PRO 101           HA       PRO 101  12.092  13.519  13.519
  731   1HB   PRO 101           HB2      PRO 101   9.388  13.772  13.772
  732   2HB   PRO 101           HB1      PRO 101  10.486  13.267  13.267
  733   1HG   PRO 101           HG2      PRO 101   8.645  11.706  11.706
  734   2HG   PRO 101           HG1      PRO 101   9.143  11.396  11.396
  735   1HD   PRO 101           HD2      PRO 101  10.076  10.072  10.072
  736   2HD   PRO 101           HD1      PRO 101  10.870  10.062  10.062
  737    HA   PRO 102           HA       PRO 102  10.927  14.309  14.309
  738   1HB   PRO 102           HB2      PRO 102  11.825  16.925  16.925
  739   2HB   PRO 102           HB1      PRO 102  12.955  15.559  15.559
  740   1HG   PRO 102           HG2      PRO 102  12.297  17.471  17.471
  741   2HG   PRO 102           HG1      PRO 102  13.704  16.457  16.457
  742   1HD   PRO 102           HD2      PRO 102  11.628  16.107  16.107
  743   2HD   PRO 102           HD1      PRO 102  13.019  15.058  15.058
  744    HA   PRO 103           HA       PRO 103  10.019  15.057  15.057
  745   1HB   PRO 103           HB2      PRO 103   9.349  15.331  15.331
  746   2HB   PRO 103           HB1      PRO 103  10.366  16.421  16.421
  747   1HG   PRO 103           HG2      PRO 103   7.958  17.216  17.216
  748   2HG   PRO 103           HG1      PRO 103   8.804  17.905  17.905
  749   1HD   PRO 103           HD2      PRO 103   7.078  15.554  15.554
  750   2HD   PRO 103           HD1      PRO 103   6.650  17.256  17.256
  751    H    TYR 104           HN       TYR 104   8.559  13.350  13.350
  752    HA   TYR 104           HA       TYR 104   7.461  11.306  11.306
  753   1HB   TYR 104           HB2      TYR 104   9.612  10.781  10.781
  754   2HB   TYR 104           HB1      TYR 104   9.059  11.291  11.291
  755    HD1  TYR 104           HD1      TYR 104   6.863   9.513   9.513
  756    HD2  TYR 104           HD2      TYR 104   9.327   9.136   9.136
  757    HE1  TYR 104           HE1      TYR 104   5.772   7.312   7.312
  758    HE2  TYR 104           HE2      TYR 104   8.208   6.956   6.956
  759    HH   TYR 104           HH       TYR 104   7.031   5.159   5.159
  760    H    TYR 105           HN       TYR 105   5.322  11.226  11.226
  761    HA   TYR 105           HA       TYR 105   3.946  10.883  10.883
  762   1HB   TYR 105           HB2      TYR 105   4.192  13.313  13.313
  763   2HB   TYR 105           HB1      TYR 105   3.264  13.191  13.191
  764    HD1  TYR 105           HD2      TYR 105   0.915  12.267  12.267
  765    HD2  TYR 105           HD1      TYR 105   3.011  13.453  13.453
  766    HE1  TYR 105           HE2      TYR 105  -1.256  12.350  12.350
  767    HE2  TYR 105           HE1      TYR 105   0.826  13.535  13.535
  768    HH   TYR 105           HH       TYR 105  -1.746  13.857  13.857
  769    H    LEU 106           HN       LEU 106   2.919   9.076   9.076
  770    HA   LEU 106           HA       LEU 106   0.905   9.200   9.200
  771   1HB   LEU 106           HB2      LEU 106   3.487   8.369   8.369
  772   2HB   LEU 106           HB1      LEU 106   2.630   6.853   6.853
  773    HG   LEU 106           HG       LEU 106   2.467   7.489   7.489
  774   1HD1  LEU 106          HD12      LEU 106  -0.114   7.863   7.863
  775   2HD1  LEU 106          HD11      LEU 106  -0.038   7.741   7.741
  776   3HD1  LEU 106          HD13      LEU 106   0.488   6.389   6.389
  777   1HD2  LEU 106          HD22      LEU 106   2.779   9.971   9.971
  778   2HD2  LEU 106          HD21      LEU 106   1.614   9.587   9.587
  779   3HD2  LEU 106          HD23      LEU 106   1.050  10.014  10.014
  780    H    GLY 108           HN       GLY 108   0.937   6.117   6.117
  781   1HA   GLY 108           HA2      GLY 108   0.162   5.469   5.469
  782   2HA   GLY 108           HA1      GLY 108  -1.148   5.473   5.473
  783    H    ILE 109           HN       ILE 109  -0.550   3.118   3.118
  784    HA   ILE 109           HA       ILE 109   0.851   1.442   1.442
  785    HB   ILE 109           HB       ILE 109   0.461   1.123   1.123
  786   1HG1  ILE 109          HG12      ILE 109   2.068   2.882   2.882
  787   2HG1  ILE 109          HG11      ILE 109   2.890   1.477   1.477
  788   1HG2  ILE 109          HG22      ILE 109   1.746  -0.626  -0.626
  789   2HG2  ILE 109          HG21      ILE 109   2.209  -0.712  -0.712
  790   3HG2  ILE 109          HG23      ILE 109   0.549  -1.053  -1.053
  791   1HD1  ILE 109          HD12      ILE 109   2.835   0.942   0.942
  792   2HD1  ILE 109          HD11      ILE 109   3.142   2.673   2.673
  793   3HD1  ILE 109          HD13      ILE 109   4.220   1.555   1.555
  794    H    GLY 110           HN       GLY 110  -0.178  -0.674  -0.674
  795   1HA   GLY 110           HA2      GLY 110  -3.115  -0.554  -0.554
  796   2HA   GLY 110           HA1      GLY 110  -2.198  -1.766  -1.766
  797    H    ASN 111           HN       ASN 111  -4.310  -1.955  -1.955
  798    HA   ASN 111           HA       ASN 111  -3.102  -2.929  -2.929
  799   1HB   ASN 111           HB2      ASN 111  -5.727  -3.489  -3.489
  800   2HB   ASN 111           HB1      ASN 111  -5.360  -4.110  -4.110
  801    HD2  ASN 111          HD22      ASN 111  -3.980  -0.751  -0.751
  802    H    GLY 112           HN       GLY 112  -3.835  -4.567  -4.567
  803   1HA   GLY 112           HA2      GLY 112  -2.050  -6.319  -6.319
  804   2HA   GLY 112           HA1      GLY 112  -2.449  -6.991  -6.991
  805    H    THR 113           HN       THR 113  -2.580  -8.035  -8.035
  806    HA   THR 113           HA       THR 113  -5.489  -8.747  -8.747
  807    HB   THR 113           HB       THR 113  -3.194  -8.864  -8.864
  808    HG1  THR 113           HG1      THR 113  -4.149  -7.095  -7.095
  809   1HG2  THR 113          HG22      THR 113  -6.119  -9.587  -9.587
  810   2HG2  THR 113          HG21      THR 113  -5.123  -9.220  -9.220
  811   3HG2  THR 113          HG23      THR 113  -4.716 -10.600 -10.600
  812    H    GLN 114           HN       GLN 114  -5.972 -10.901 -10.901
  813    HA   GLN 114           HA       GLN 114  -3.778 -12.721 -12.721
  814   1HB   GLN 114           HB2      GLN 114  -6.084 -12.529 -12.529
  815   2HB   GLN 114           HB1      GLN 114  -6.741 -13.322 -13.322
  816   1HG   GLN 114           HG2      GLN 114  -6.370 -15.125 -15.125
  817   2HG   GLN 114           HG1      GLN 114  -4.900 -15.117 -15.117
  818   1HE2  GLN 114          HE22      GLN 114  -3.300 -15.220 -15.220
  819   2HE2  GLN 114          HE21      GLN 114  -3.791 -16.165 -16.165
  820    H    ILE 115           HN       ILE 115  -2.867 -14.224 -14.224
  821    HA   ILE 115           HA       ILE 115  -4.049 -14.336 -14.336
  822    HB   ILE 115           HB       ILE 115  -1.361 -15.053 -15.053
  823   1HG1  ILE 115          HG12      ILE 115  -1.908 -12.637 -12.637
  824   2HG1  ILE 115          HG11      ILE 115  -0.509 -13.224 -13.224
  825   1HG2  ILE 115          HG22      ILE 115  -2.458 -15.669 -15.669
  826   2HG2  ILE 115          HG21      ILE 115  -0.736 -15.348 -15.348
  827   3HG2  ILE 115          HG23      ILE 115  -1.491 -16.690 -16.690
  828   1HD1  ILE 115          HD12      ILE 115  -2.840 -13.682 -13.682
  829   2HD1  ILE 115          HD11      ILE 115  -2.837 -12.003 -12.003
  830   3HD1  ILE 115          HD13      ILE 115  -1.458 -12.643 -12.643
  831    H    TYR 116           HN       TYR 116  -5.317 -16.121 -16.121
  832    HA   TYR 116           HA       TYR 116  -5.098 -18.563 -18.563
  833   1HB   TYR 116           HB2      TYR 116  -7.175 -17.441 -17.441
  834   2HB   TYR 116           HB1      TYR 116  -7.297 -19.064 -19.064
  835    HD1  TYR 116           HD2      TYR 116  -5.911 -17.810 -17.810
  836    HD2  TYR 116           HD1      TYR 116  -9.453 -17.047 -17.047
  837    HE1  TYR 116           HE2      TYR 116  -7.096 -16.925 -16.925
  838    HE2  TYR 116           HE1      TYR 116 -10.629 -16.195 -16.195
  839    HH   TYR 116           HH       TYR 116  -9.043 -15.378 -15.378
  840    H    VAL 117           HN       VAL 117  -4.765 -20.616 -20.616
  841    HA   VAL 117           HA       VAL 117  -4.243 -20.675 -20.675
  842    HB   VAL 117           HB       VAL 117  -2.519 -21.867 -21.867
  843   1HG1  VAL 117          HG13      VAL 117  -2.498 -22.085 -22.085
  844   2HG1  VAL 117          HG12      VAL 117  -1.014 -22.297 -22.297
  845   3HG1  VAL 117          HG11      VAL 117  -2.386 -23.377 -23.377
  846   1HG2  VAL 117          HG21      VAL 117  -2.381 -19.357 -19.357
  847   2HG2  VAL 117          HG23      VAL 117  -0.873 -20.238 -20.238
  848   3HG2  VAL 117          HG22      VAL 117  -1.830 -19.739 -19.739
  849    H    ILE 118           HN       ILE 118  -4.279 -22.897 -22.897
  850    HA   ILE 118           HA       ILE 118  -6.260 -24.604 -24.604
  851    HB   ILE 118           HB       ILE 118  -5.515 -24.032 -24.032
  852   1HG1  ILE 118          HG12      ILE 118  -8.087 -23.493 -23.493
  853   2HG1  ILE 118          HG11      ILE 118  -7.859 -23.429 -23.429
  854   1HG2  ILE 118          HG22      ILE 118  -7.266 -26.215 -26.215
  855   2HG2  ILE 118          HG21      ILE 118  -7.621 -25.537 -25.537
  856   3HG2  ILE 118          HG23      ILE 118  -6.072 -26.326 -26.326
  857   1HD1  ILE 118          HD12      ILE 118  -5.799 -21.963 -21.963
  858   2HD1  ILE 118          HD11      ILE 118  -7.426 -21.326 -21.326
  859   3HD1  ILE 118          HD13      ILE 118  -6.762 -21.454 -21.454
  860    H    ASP 119           HN       ASP 119  -5.694 -26.761 -26.761
  861    HA   ASP 119           HA       ASP 119  -2.926 -27.609 -27.609
  862   1HB   ASP 119           HB2      ASP 119  -3.713 -27.612 -27.612
  863   2HB   ASP 119           HB1      ASP 119  -4.974 -28.760 -28.760
  864    HA   PRO 120           HA       PRO 120  -5.236 -30.037 -30.037
  865   1HB   PRO 120           HB2      PRO 120  -3.047 -30.841 -30.841
  866   2HB   PRO 120           HB1      PRO 120  -3.816 -29.255 -29.255
  867   1HG   PRO 120           HG2      PRO 120  -1.367 -29.982 -29.982
  868   2HG   PRO 120           HG1      PRO 120  -1.682 -28.568 -28.568
  869   1HD   PRO 120           HD2      PRO 120  -1.787 -28.486 -28.486
  870   2HD   PRO 120           HD1      PRO 120  -2.785 -27.444 -27.444
  871    H    GLU 121           HN       GLU 121  -5.515 -32.309 -32.309
  872    HA   GLU 121           HA       GLU 121  -3.724 -34.041 -34.041
  873   1HB   GLU 121           HB2      GLU 121  -6.751 -33.999 -33.999
  874   2HB   GLU 121           HB1      GLU 121  -5.838 -35.222 -35.222
  875   1HG   GLU 121           HG2      GLU 121  -4.904 -33.511 -33.511
  876   2HG   GLU 121           HG1      GLU 121  -5.711 -32.243 -32.243
  877    HA   PRO 122           HA       PRO 122  -3.601 -36.378 -36.378
  878   1HB   PRO 122           HB2      PRO 122  -2.648 -38.752 -38.752
  879   2HB   PRO 122           HB1      PRO 122  -1.626 -37.319 -37.319
  880   1HG   PRO 122           HG2      PRO 122  -2.866 -38.362 -38.362
  881   2HG   PRO 122           HG1      PRO 122  -1.255 -37.673 -37.673
  882   1HD   PRO 122           HD2      PRO 122  -3.296 -36.269 -36.269
  883   2HD   PRO 122           HD1      PRO 122  -2.011 -35.509 -35.509
  884    H    CYS 123           HN       CYS 123  -5.582 -37.160 -37.160
  885    HA   CYS 123           HA       CYS 123  -7.020 -39.278 -39.278
  886   1HB   CYS 123           HB2      CYS 123  -6.879 -38.617 -38.617
  887   2HB   CYS 123           HB1      CYS 123  -7.866 -39.909 -39.909
  888    HG   CYS 123           HG       CYS 123  -5.594 -41.007 -41.007
  889    HA   PRO 124           HA       PRO 124 -10.478 -36.572 -36.572
  890   1HB   PRO 124           HB2      PRO 124 -12.588 -38.311 -38.311
  891   2HB   PRO 124           HB1      PRO 124 -11.569 -38.204 -38.204
  892   1HG   PRO 124           HG2      PRO 124 -11.460 -40.162 -40.162
  893   2HG   PRO 124           HG1      PRO 124 -11.292 -40.436 -40.436
  894   1HD   PRO 124           HD2      PRO 124  -9.163 -40.337 -40.337
  895   2HD   PRO 124           HD1      PRO 124  -9.085 -39.774 -39.774
  896    H    ASP 125           HN       ASP 125 -10.117 -38.568 -38.568
  897    HA   ASP 125           HA       ASP 125 -11.660 -36.551 -36.551
  898   1HB   ASP 125           HB2      ASP 125 -12.754 -38.415 -38.415
  899   2HB   ASP 125           HB1      ASP 125 -13.105 -38.492 -38.492
  900    H    SER 126           HN       SER 126 -11.102 -36.690 -36.690
  901    HA   SER 126           HA       SER 126  -8.230 -37.412 -37.412
  902   1HB   SER 126           HB2      SER 126  -8.389 -35.842 -35.842
  903   2HB   SER 126           HB1      SER 126  -9.040 -35.103 -35.103
  904    HG   SER 126           HG       SER 126 -10.919 -35.017 -35.017
  905    H    ASP 127           HN       ASP 127 -10.955 -39.118 -39.118
  906    HA   ASP 127           HA       ASP 127 -11.121 -39.903 -39.903
  907   1HB   ASP 127           HB2      ASP 127 -12.690 -40.398 -40.398
  908   2HB   ASP 127           HB1      ASP 127 -11.543 -41.629 -41.629
  909    H    GLN 128           HN       GLN 128  -9.006 -41.029 -41.029
  910    HA   GLN 128           HA       GLN 128  -7.457 -42.611 -42.611
  911   1HB   GLN 128           HB2      GLN 128  -8.126 -43.229 -43.229
  912   2HB   GLN 128           HB1      GLN 128  -7.045 -44.200 -44.200
  913   1HG   GLN 128           HG2      GLN 128  -8.854 -44.662 -44.662
  914   2HG   GLN 128           HG1      GLN 128  -9.944 -43.614 -43.614
  915   1HE2  GLN 128          HE22      GLN 128 -10.198 -45.957 -45.957
  916   2HE2  GLN 128          HE21      GLN 128 -10.086 -44.290 -44.290
  917    H    GLU 129           HN       GLU 129  -5.174 -42.539 -42.539
  918    HA   GLU 129           HA       GLU 129  -3.118 -41.507 -41.507
  919   1HB   GLU 129           HB2      GLU 129  -4.543 -41.555 -41.555
  920   2HB   GLU 129           HB1      GLU 129  -2.814 -41.270 -41.270
  921   1HG   GLU 129           HG2      GLU 129  -2.535 -43.461 -43.461
  922   2HG   GLU 129           HG1      GLU 129  -4.274 -43.747 -43.747
  923    HA   PRO 130           HA       PRO 130  -5.326 -37.303 -37.303
  924   1HB   PRO 130           HB2      PRO 130  -5.207 -36.537 -36.537
  925   2HB   PRO 130           HB1      PRO 130  -6.592 -37.403 -37.403
  926   1HG   PRO 130           HG2      PRO 130  -4.327 -38.452 -38.452
  927   2HG   PRO 130           HG1      PRO 130  -6.048 -38.866 -38.866
  928   1HD   PRO 130           HD2      PRO 130  -4.200 -40.429 -40.429
  929   2HD   PRO 130           HD1      PRO 130  -5.895 -40.340 -40.340
  930    H    LYS 131           HN       LYS 131  -4.106 -35.345 -35.345
  931    HA   LYS 131           HA       LYS 131  -1.509 -35.160 -35.160
  932   1HB   LYS 131           HB2      LYS 131  -1.115 -36.670 -36.670
  933   2HB   LYS 131           HB1      LYS 131  -1.694 -35.397 -35.397
  934   1HG   LYS 131           HG2      LYS 131   0.110 -33.916 -33.916
  935   2HG   LYS 131           HG1      LYS 131   0.662 -35.116 -35.116
  936   1HD   LYS 131           HD2      LYS 131   1.068 -36.706 -36.706
  937   2HD   LYS 131           HD1      LYS 131   0.616 -35.436 -35.436
  938   1HE   LYS 131           HE2      LYS 131   2.468 -34.029 -34.029
  939   2HE   LYS 131           HE1      LYS 131   2.897 -35.235 -35.235
  940   1HZ   LYS 131           HZ1      LYS 131   3.186 -36.872 -36.872
  941   2HZ   LYS 131           HZ3      LYS 131   2.801 -35.712 -35.712
  942   3HZ   LYS 131           HZ2      LYS 131   4.216 -35.545 -35.545
  943    H1   NAG 132           H1       NAG 132  -5.094  -1.874  -1.874
  944    H2   NAG 132           H2       NAG 132  -2.517  -0.276  -0.276
  945    H3   NAG 132           H3       NAG 132  -3.383  -1.764  -1.764
  946    H4   NAG 132           H4       NAG 132  -3.162   1.254   1.254
  947    H5   NAG 132           H5       NAG 132  -5.707  -0.412  -0.412
  948   1H6   NAG 132           H61      NAG 132  -5.274   2.459   2.459
  949   2H6   NAG 132           H62      NAG 132  -6.849   1.681   1.681
  950   1H8   NAG 132           H81      NAG 132  -0.397  -0.491  -0.491
  951   2H8   NAG 132           H82      NAG 132   0.282  -1.945  -1.945
  952   3H8   NAG 132           H83      NAG 132  -1.384  -1.427  -1.427
  953    HN2  NAG 132           HN2      NAG 132  -2.992  -3.124  -3.124
  954    HO3  NAG 132           HO3      NAG 132  -1.160  -0.096  -0.096
  955    H1   NAG 133           H1       NAG 133  -3.462   2.385   2.385
  956    H2   NAG 133           H2       NAG 133  -3.252   0.495   0.495
  957    H3   NAG 133           H3       NAG 133  -3.119   3.537   3.537
  958    H4   NAG 133           H4       NAG 133  -0.841   1.545   1.545
  959    H5   NAG 133           H5       NAG 133  -1.248   3.328   3.328
  960   1H6   NAG 133           H61      NAG 133   1.009   3.110   3.110
  961   2H6   NAG 133           H62      NAG 133   0.925   1.548   1.548
  962   1H8   NAG 133           H81      NAG 133  -7.291   2.237   2.237
  963   2H8   NAG 133           H82      NAG 133  -7.639   0.778   0.778
  964   3H8   NAG 133           H83      NAG 133  -7.813   0.727   0.727
  965    HN2  NAG 133           HN2      NAG 133  -5.242   2.626   2.626
  966    HO3  NAG 133           HO3      NAG 133  -3.104   3.327   3.327
  967    HO6  NAG 133           HO6      NAG 133   1.140   0.660   0.660
  968    H1   FUC 134           H1       FUC 134  -6.105   2.626   2.626
  969    H2   FUC 134           H2       FUC 134  -7.225   3.842   3.842
  970    H3   FUC 134           H3       FUC 134  -6.949   5.823   5.823
  971    H4   FUC 134           H4       FUC 134  -5.697   7.231   7.231
  972    H5   FUC 134           H5       FUC 134  -4.182   5.594   5.594
  973   1H6   FUC 134           H61      FUC 134  -3.204   5.176   5.176
  974   2H6   FUC 134           H62      FUC 134  -2.409   5.899   5.899
  975   3H6   FUC 134           H63      FUC 134  -3.510   6.889   6.889
  976    HO2  FUC 134           HO2      FUC 134  -8.039   3.944   3.944
  977    HO3  FUC 134           HO3      FUC 134  -8.179   6.064   6.064
  978    HO4  FUC 134           HO4      FUC 134  -5.315   6.384   6.384
  979    H1   MAN 135           H1       MAN 135  -0.302   2.446   2.446
  980    H2   MAN 135           H2       MAN 135   1.859   2.452   2.452
  981    H3   MAN 135           H3       MAN 135   2.074   2.252   2.252
  982    H4   MAN 135           H4       MAN 135   2.185   5.298   5.298
  983    H5   MAN 135           H5       MAN 135  -0.059   3.401   3.401
  984   1H6   MAN 135           H61      MAN 135   0.534   5.727   5.727
  985   2H6   MAN 135           H62      MAN 135  -0.340   6.357   6.357
  986    HO2  MAN 135           HO2      MAN 135   2.359   4.289   4.289
  987    HO3  MAN 135           HO3      MAN 135   4.164   2.805   2.805
  988    HO4  MAN 135           HO4      MAN 135   1.931   3.368   3.368
  989    HO6  MAN 135           HO6      MAN 135  -1.957   5.949   5.949
  990    H1   NAG 136           H1       NAG 136  -0.003  -7.821  -7.821
  991    H2   NAG 136           H2       NAG 136  -2.855  -7.469  -7.469
  992    H3   NAG 136           H3       NAG 136  -1.037  -9.952  -9.952
  993    H4   NAG 136           H4       NAG 136  -1.726  -8.071  -8.071
  994    H5   NAG 136           H5       NAG 136   0.885  -8.227  -8.227
  995   1H6   NAG 136           H61      NAG 136   0.339  -7.612  -7.612
  996   2H6   NAG 136           H62      NAG 136   0.059  -6.070  -6.070
  997   1H8   NAG 136           H81      NAG 136  -3.620 -10.955 -10.955
  998   2H8   NAG 136           H82      NAG 136  -4.569 -10.383 -10.383
  999   3H8   NAG 136           H83      NAG 136  -5.273 -10.310 -10.310
 1000    HN2  NAG 136           HN2      NAG 136  -1.844  -9.017  -9.017
 1001    HO3  NAG 136           HO3      NAG 136  -2.730 -10.878 -10.878
 1002    H1   NAG 137           H1       NAG 137   1.216  -9.377  -9.377
 1003    H2   NAG 137           H2       NAG 137   0.095 -12.161 -12.161
 1004    H3   NAG 137           H3       NAG 137   2.933 -11.351 -11.351
 1005    H4   NAG 137           H4       NAG 137   2.144 -12.445 -12.445
 1006    H5   NAG 137           H5       NAG 137   2.953  -9.575  -9.575
 1007   1H6   NAG 137           H61      NAG 137   3.563 -10.062 -10.062
 1008   2H6   NAG 137           H62      NAG 137   2.071  -9.127  -9.127
 1009   1H8   NAG 137           H81      NAG 137  -1.991 -12.942 -12.942
 1010   2H8   NAG 137           H82      NAG 137  -1.699 -12.468 -12.468
 1011   3H8   NAG 137           H83      NAG 137  -1.371 -14.144 -14.144
 1012    HN2  NAG 137           HN2      NAG 137   0.711 -10.812 -10.812
 1013    HO3  NAG 137           HO3      NAG 137   3.229 -13.463 -13.463
 1014    HO6  NAG 137           HO6      NAG 137   2.339 -11.262 -11.262
 1015    H1   FUC 138           H1       FUC 138   2.164  -7.797  -7.797
 1016    H2   FUC 138           H2       FUC 138   4.433  -6.012  -6.012
 1017    H3   FUC 138           H3       FUC 138   3.118  -4.620  -4.620
 1018    H4   FUC 138           H4       FUC 138   5.431  -5.141  -5.141
 1019    H5   FUC 138           H5       FUC 138   3.742  -7.144  -7.144
 1020   1H6   FUC 138           H61      FUC 138   6.364  -8.272  -8.272
 1021   2H6   FUC 138           H62      FUC 138   5.285  -8.858  -8.858
 1022   3H6   FUC 138           H63      FUC 138   6.266  -7.380  -7.380
 1023    HO2  FUC 138           HO2      FUC 138   2.490  -5.542  -5.542
 1024    HO3  FUC 138           HO3      FUC 138   3.957  -3.499  -3.499
 1025    HO4  FUC 138           HO4      FUC 138   6.808  -5.155  -5.155
 1026    H1   MAN 139           H1       MAN 139   3.878 -12.030 -12.030
 1027    H2   MAN 139           H2       MAN 139   5.406 -10.049 -10.049
 1028    H3   MAN 139           H3       MAN 139   5.793 -11.092 -11.092
 1029    H4   MAN 139           H4       MAN 139   7.739 -12.978 -12.978
 1030    H5   MAN 139           H5       MAN 139   4.976 -13.624 -13.624
 1031   1H6   MAN 139           H61      MAN 139   5.728 -15.631 -15.631
 1032   2H6   MAN 139           H62      MAN 139   5.689 -15.677 -15.677
 1033    HO2  MAN 139           HO2      MAN 139   7.301 -11.931 -11.931
 1034    HO3  MAN 139           HO3      MAN 139   8.099 -10.455 -10.455
 1035    HO4  MAN 139           HO4      MAN 139   6.890 -12.555 -12.555
 1036    HO6  MAN 139           HO6      MAN 139   7.876 -15.194 -15.194

  Start of MODEL    2
    1   1H    ALA   1           HT1      ALA   1 -15.220   4.573   4.573
    2   2H    ALA   1           HT3      ALA   1 -15.807   6.004   6.004
    3   3H    ALA   1           HT2      ALA   1 -14.387   6.034   6.034
    4    HA   ALA   1           HA       ALA   1 -13.853   6.138   6.138
    5   1HB   ALA   1           HB2      ALA   1 -16.059   4.844   4.844
    6   2HB   ALA   1           HB1      ALA   1 -15.102   3.390   3.390
    7   3HB   ALA   1           HB3      ALA   1 -14.693   4.468   4.468
    8    H    MET   1           HN       MET   1 -11.959   4.974   4.974
    9    HA   MET   1           HA       MET   1  -9.917   3.838   3.838
   10   1HB   MET   1           HB2      MET   1 -11.812   1.994   1.994
   11   2HB   MET   1           HB1      MET   1 -10.173   1.560   1.560
   12   1HG   MET   1           HG2      MET   1 -10.749   1.959   1.959
   13   2HG   MET   1           HG1      MET   1 -12.390   2.403   2.403
   14   1HE   MET   1           HE3      MET   1 -13.987   1.026   1.026
   15   2HE   MET   1           HE2      MET   1 -12.973   0.293   0.293
   16   3HE   MET   1           HE1      MET   1 -13.967  -0.731  -0.731
   17    H    HIS   2           HN       HIS   2  -8.419   4.838   4.838
   18    HA   HIS   2           HA       HIS   2  -8.934   5.178   5.178
   19   1HB   HIS   2           HB2      HIS   2  -6.770   6.198   6.198
   20   2HB   HIS   2           HB1      HIS   2  -6.945   6.678   6.678
   21    HD1  HIS   2           HD1      HIS   2  -8.371   7.233   7.233
   22    HD2  HIS   2           HD2      HIS   2  -9.290   8.285   8.285
   23    HE1  HIS   2           HE1      HIS   2 -10.116   9.063   9.063
   24    H    VAL   3           HN       VAL   3  -8.134   2.574   2.574
   25    HA   VAL   3           HA       VAL   3  -6.048   1.821   1.821
   26    HB   VAL   3           HB       VAL   3  -5.803   1.450   1.450
   27   1HG1  VAL   3          HG13      VAL   3  -4.901  -0.439  -0.439
   28   2HG1  VAL   3          HG12      VAL   3  -3.850   0.715   0.715
   29   3HG1  VAL   3          HG11      VAL   3  -3.654   0.416   0.416
   30   1HG2  VAL   3          HG21      VAL   3  -4.362   3.227   3.227
   31   2HG2  VAL   3          HG23      VAL   3  -5.253   3.721   3.721
   32   3HG2  VAL   3          HG22      VAL   3  -3.717   2.870   2.870
   33    H    ALA   4           HN       ALA   4  -6.557  -0.207  -0.207
   34    HA   ALA   4           HA       ALA   4  -8.629  -1.797  -1.797
   35   1HB   ALA   4           HB1      ALA   4  -8.844  -0.841  -0.841
   36   2HB   ALA   4           HB3      ALA   4  -7.837  -2.224  -2.224
   37   3HB   ALA   4           HB2      ALA   4  -9.402  -2.478  -2.478
   38    H    GLN   5           HN       GLN   5  -8.050  -3.756  -3.756
   39    HA   GLN   5           HA       GLN   5  -5.507  -5.020  -5.020
   40   1HB   GLN   5           HB2      GLN   5  -6.601  -4.692  -4.692
   41   2HB   GLN   5           HB1      GLN   5  -5.162  -5.626  -5.626
   42   1HG   GLN   5           HG2      GLN   5  -3.918  -3.736  -3.736
   43   2HG   GLN   5           HG1      GLN   5  -5.349  -2.776  -2.776
   44   1HE2  GLN   5          HE22      GLN   5  -5.070  -1.303  -1.303
   45   2HE2  GLN   5          HE21      GLN   5  -5.144  -1.067  -1.067
   46    HA   PRO   6           HA       PRO   6  -8.425  -8.480  -8.480
   47   1HB   PRO   6           HB2      PRO   6  -6.662 -10.309 -10.309
   48   2HB   PRO   6           HB1      PRO   6  -7.436  -9.067  -9.067
   49   1HG   PRO   6           HG2      PRO   6  -4.690  -9.145  -9.145
   50   2HG   PRO   6           HG1      PRO   6  -5.253  -8.535  -8.535
   51   1HD   PRO   6           HD2      PRO   6  -4.640  -6.934  -6.934
   52   2HD   PRO   6           HD1      PRO   6  -5.782  -6.482  -6.482
   53    H    ALA   7           HN       ALA   7  -8.852 -10.082 -10.082
   54    HA   ALA   7           HA       ALA   7  -7.117 -10.250 -10.250
   55   1HB   ALA   7           HB3      ALA   7  -9.651 -10.425 -10.425
   56   2HB   ALA   7           HB2      ALA   7  -9.450 -12.022 -12.022
   57   3HB   ALA   7           HB1      ALA   7  -8.869 -11.712 -11.712
   58    H    VAL   8           HN       VAL   8  -7.581 -12.238 -12.238
   59    HA   VAL   8           HA       VAL   8  -5.158 -13.698 -13.698
   60    HB   VAL   8           HB       VAL   8  -7.286 -14.692 -14.692
   61   1HG1  VAL   8          HG11      VAL   8  -7.959 -15.063 -15.063
   62   2HG1  VAL   8          HG13      VAL   8  -8.049 -16.551 -16.551
   63   3HG1  VAL   8          HG12      VAL   8  -8.990 -15.126 -15.126
   64   1HG2  VAL   8          HG23      VAL   8  -4.901 -15.764 -15.764
   65   2HG2  VAL   8          HG22      VAL   8  -6.104 -16.577 -16.577
   66   3HG2  VAL   8          HG21      VAL   8  -6.035 -16.864 -16.864
   67    H    VAL   9           HN       VAL   9  -4.441 -15.068 -15.068
   68    HA   VAL   9           HA       VAL   9  -5.628 -14.489 -14.489
   69    HB   VAL   9           HB       VAL   9  -2.898 -13.855 -13.855
   70   1HG1  VAL   9          HG13      VAL   9  -3.637 -14.414 -14.414
   71   2HG1  VAL   9          HG12      VAL   9  -2.272 -13.383 -13.383
   72   3HG1  VAL   9          HG11      VAL   9  -2.286 -15.079 -15.079
   73   1HG2  VAL   9          HG23      VAL   9  -4.921 -12.245 -12.245
   74   2HG2  VAL   9          HG22      VAL   9  -3.351 -11.694 -11.694
   75   3HG2  VAL   9          HG21      VAL   9  -4.557 -12.274 -12.274
   76    H    LEU  10           HN       LEU  10  -5.008 -16.082 -16.082
   77    HA   LEU  10           HA       LEU  10  -4.035 -18.650 -18.650
   78   1HB   LEU  10           HB2      LEU  10  -5.888 -18.096 -18.096
   79   2HB   LEU  10           HB1      LEU  10  -5.458 -19.698 -19.698
   80    HG   LEU  10           HG       LEU  10  -6.870 -17.551 -17.551
   81   1HD1  LEU  10          HD11      LEU  10  -7.870 -20.071 -20.071
   82   2HD1  LEU  10          HD13      LEU  10  -8.796 -19.172 -19.172
   83   3HD1  LEU  10          HD12      LEU  10  -8.370 -18.412 -18.412
   84   1HD2  LEU  10          HD23      LEU  10  -5.577 -20.102 -20.102
   85   2HD2  LEU  10          HD22      LEU  10  -6.077 -18.774 -18.774
   86   3HD2  LEU  10          HD21      LEU  10  -7.248 -19.995 -19.995
   87    H    ALA  11           HN       ALA  11  -2.185 -19.504 -19.504
   88    HA   ALA  11           HA       ALA  11  -0.896 -18.081 -18.081
   89   1HB   ALA  11           HB1      ALA  11  -0.010 -20.273 -20.273
   90   2HB   ALA  11           HB3      ALA  11   1.043 -19.489 -19.489
   91   3HB   ALA  11           HB2      ALA  11   0.352 -18.552 -18.552
   92    H    SER  12           HN       SER  12   0.614 -20.158 -20.158
   93    HA   SER  12           HA       SER  12  -1.451 -22.012 -22.012
   94   1HB   SER  12           HB2      SER  12  -0.809 -20.019 -20.019
   95   2HB   SER  12           HB1      SER  12   0.836 -20.648 -20.648
   96    HG   SER  12           HG       SER  12   0.199 -21.936 -21.936
   97    H    SER  13           HN       SER  13  -0.103 -23.746 -23.746
   98    HA   SER  13           HA       SER  13   1.384 -25.386 -25.386
   99   1HB   SER  13           HB2      SER  13   0.188 -26.110 -26.110
  100   2HB   SER  13           HB1      SER  13   1.418 -25.303 -25.303
  101    HG   SER  13           HG       SER  13   2.916 -26.745 -26.745
  102    H    ARG  14           HN       ARG  14   2.431 -23.083 -23.083
  103    HA   ARG  14           HA       ARG  14   5.254 -23.524 -23.524
  104   1HB   ARG  14           HB2      ARG  14   3.991 -22.219 -22.219
  105   2HB   ARG  14           HB1      ARG  14   3.682 -20.980 -20.980
  106   1HG   ARG  14           HG2      ARG  14   5.588 -20.227 -20.227
  107   2HG   ARG  14           HG1      ARG  14   6.218 -20.833 -20.833
  108   1HD   ARG  14           HD2      ARG  14   7.603 -21.708 -21.708
  109   2HD   ARG  14           HD1      ARG  14   6.656 -23.047 -23.047
  110    HE   ARG  14           HE       ARG  14   5.057 -21.918 -21.918
  111   1HH1  ARG  14          HH21      ARG  14   8.182 -23.474 -23.474
  112   2HH1  ARG  14          HH22      ARG  14   8.096 -24.106 -24.106
  113   1HH2  ARG  14          HH11      ARG  14   4.990 -22.756 -22.756
  114   2HH2  ARG  14          HH12      ARG  14   6.311 -23.705 -23.705
  115    H    GLY  15           HN       GLY  15   3.077 -22.015 -22.015
  116   1HA   GLY  15           HA2      GLY  15   3.568 -21.426 -21.426
  117   2HA   GLY  15           HA1      GLY  15   5.284 -21.664 -21.664
  118    H    ILE  16           HN       ILE  16   3.105 -19.647 -19.647
  119    HA   ILE  16           HA       ILE  16   4.730 -17.295 -17.295
  120    HB   ILE  16           HB       ILE  16   3.130 -17.535 -17.535
  121   1HG1  ILE  16          HG12      ILE  16   4.487 -19.476 -19.476
  122   2HG1  ILE  16          HG11      ILE  16   5.269 -18.245 -18.245
  123   1HG2  ILE  16          HG22      ILE  16   5.508 -15.948 -15.948
  124   2HG2  ILE  16          HG21      ILE  16   5.024 -16.030 -16.030
  125   3HG2  ILE  16          HG23      ILE  16   3.926 -15.348 -15.348
  126   1HD1  ILE  16          HD13      ILE  16   6.212 -18.181 -18.181
  127   2HD1  ILE  16          HD12      ILE  16   6.411 -19.785 -19.785
  128   3HD1  ILE  16          HD11      ILE  16   7.128 -18.377 -18.377
  129    H    ALA  17           HN       ALA  17   3.517 -16.189 -16.189
  130    HA   ALA  17           HA       ALA  17   0.553 -16.045 -16.045
  131   1HB   ALA  17           HB1      ALA  17   1.561 -16.874 -16.874
  132   2HB   ALA  17           HB3      ALA  17   2.304 -15.290 -15.290
  133   3HB   ALA  17           HB2      ALA  17   0.548 -15.447 -15.447
  134    H    SER  18           HN       SER  18  -0.306 -14.152 -14.152
  135    HA   SER  18           HA       SER  18   1.317 -11.650 -11.650
  136   1HB   SER  18           HB2      SER  18   1.342 -12.584 -12.584
  137   2HB   SER  18           HB1      SER  18  -0.417 -12.527 -12.527
  138    HG   SER  18           HG       SER  18   1.444 -10.405 -10.405
  139    H    PHE  19           HN       PHE  19   0.247 -10.029 -10.029
  140    HA   PHE  19           HA       PHE  19  -2.728  -9.942  -9.942
  141   1HB   PHE  19           HB2      PHE  19  -2.753  -9.461  -9.461
  142   2HB   PHE  19           HB1      PHE  19  -2.101 -11.052 -11.052
  143    HD1  PHE  19           HD2      PHE  19   0.367 -11.471 -11.471
  144    HD2  PHE  19           HD1      PHE  19  -1.387  -7.715  -7.715
  145    HE1  PHE  19           HE2      PHE  19   2.473 -10.897 -10.897
  146    HE2  PHE  19           HE1      PHE  19   0.720  -7.140  -7.140
  147    HZ   PHE  19           HZ       PHE  19   2.649  -8.738  -8.738
  148    H    VAL  20           HN       VAL  20  -3.550  -7.770  -7.770
  149    HA   VAL  20           HA       VAL  20  -1.491  -5.648  -5.648
  150    HB   VAL  20           HB       VAL  20  -4.305  -5.931  -5.931
  151   1HG1  VAL  20          HG11      VAL  20  -3.500  -3.565  -3.565
  152   2HG1  VAL  20          HG13      VAL  20  -2.194  -3.897  -3.897
  153   3HG1  VAL  20          HG12      VAL  20  -3.872  -3.950  -3.950
  154   1HG2  VAL  20          HG23      VAL  20  -2.366  -7.426  -7.426
  155   2HG2  VAL  20          HG22      VAL  20  -3.358  -6.551  -6.551
  156   3HG2  VAL  20          HG21      VAL  20  -1.769  -5.932  -5.932
  157    H    CYS  21           HN       CYS  21  -1.416  -4.174  -4.174
  158    HA   CYS  21           HA       CYS  21  -3.795  -3.792  -3.792
  159   1HB   CYS  21           HB2      CYS  21  -1.590  -4.524  -4.524
  160   2HB   CYS  21           HB1      CYS  21  -0.860  -3.052  -3.052
  161    H    GLU  22           HN       GLU  22  -4.998  -2.076  -2.076
  162    HA   GLU  22           HA       GLU  22  -3.683   0.024   0.024
  163   1HB   GLU  22           HB2      GLU  22  -5.900   0.666   0.666
  164   2HB   GLU  22           HB1      GLU  22  -5.945  -1.088  -1.088
  165   1HG   GLU  22           HG2      GLU  22  -6.680  -0.763  -0.763
  166   2HG   GLU  22           HG1      GLU  22  -6.882   0.944   0.944
  167    H    TYR  23           HN       TYR  23  -3.573   2.235   2.235
  168    HA   TYR  23           HA       TYR  23  -4.157   2.928   2.928
  169   1HB   TYR  23           HB2      TYR  23  -1.958   3.831   3.831
  170   2HB   TYR  23           HB1      TYR  23  -1.701   2.312   2.312
  171    HD1  TYR  23           HD1      TYR  23  -2.031   6.014   6.014
  172    HD2  TYR  23           HD2      TYR  23  -0.657   2.263   2.263
  173    HE1  TYR  23           HE1      TYR  23  -0.856   7.259   7.259
  174    HE2  TYR  23           HE2      TYR  23   0.511   3.510   3.510
  175    HH   TYR  23           HH       TYR  23   1.497   6.157   6.157
  176    H    ALA  24           HN       ALA  24  -4.336   5.365   5.365
  177    HA   ALA  24           HA       ALA  24  -5.189   6.642   6.642
  178   1HB   ALA  24           HB2      ALA  24  -6.932   5.656   5.656
  179   2HB   ALA  24           HB1      ALA  24  -6.612   7.167   7.167
  180   3HB   ALA  24           HB3      ALA  24  -7.243   7.199   7.199
  181    H    SER  25           HN       SER  25  -4.401   8.685   8.685
  182    HA   SER  25           HA       SER  25  -3.481  10.241  10.241
  183   1HB   SER  25           HB2      SER  25  -1.515   9.148   9.148
  184   2HB   SER  25           HB1      SER  25  -1.918   9.493   9.493
  185    HG   SER  25           HG       SER  25  -0.315  10.891  10.891
  186    HA   PRO  26           HA       PRO  26  -5.486  13.557  13.557
  187   1HB   PRO  26           HB2      PRO  26  -4.106  15.691  15.691
  188   2HB   PRO  26           HB1      PRO  26  -5.306  14.774  14.774
  189   1HG   PRO  26           HG2      PRO  26  -2.331  14.580  14.580
  190   2HG   PRO  26           HG1      PRO  26  -3.481  14.527  14.527
  191   1HD   PRO  26           HD2      PRO  26  -2.339  12.293  12.293
  192   2HD   PRO  26           HD1      PRO  26  -3.967  12.305  12.305
  193    H    GLY  27           HN       GLY  27  -2.156  12.826  12.826
  194   1HA   GLY  27           HA2      GLY  27  -2.233  14.384  14.384
  195   2HA   GLY  27           HA1      GLY  27  -0.895  14.700  14.700
  196    H    LYS  28           HN       LYS  28   0.057  13.891  13.891
  197    HA   LYS  28           HA       LYS  28   0.496  10.927  10.927
  198   1HB   LYS  28           HB2      LYS  28   0.426  12.801  12.801
  199   2HB   LYS  28           HB1      LYS  28   0.834  11.088  11.088
  200   1HG   LYS  28           HG2      LYS  28  -1.753  12.040  12.040
  201   2HG   LYS  28           HG1      LYS  28  -1.608  11.722  11.722
  202   1HD   LYS  28           HD2      LYS  28  -0.805   9.421   9.421
  203   2HD   LYS  28           HD1      LYS  28  -1.075   9.747   9.747
  204   1HE   LYS  28           HE2      LYS  28  -3.466  10.096  10.096
  205   2HE   LYS  28           HE1      LYS  28  -3.225   9.877   9.877
  206   1HZ   LYS  28           HZ1      LYS  28  -2.250   7.685   7.685
  207   2HZ   LYS  28           HZ3      LYS  28  -2.645   7.886   7.886
  208   3HZ   LYS  28           HZ2      LYS  28  -3.878   7.787   7.787
  209    H    ALA  29           HN       ALA  29   2.652  10.201  10.201
  210    HA   ALA  29           HA       ALA  29   4.800  12.215  12.215
  211   1HB   ALA  29           HB2      ALA  29   4.376  10.488  10.488
  212   2HB   ALA  29           HB1      ALA  29   5.915  11.268  11.268
  213   3HB   ALA  29           HB3      ALA  29   4.479  12.247  12.247
  214    H    THR  30           HN       THR  30   6.922  11.103  11.103
  215    HA   THR  30           HA       THR  30   6.597   8.672   8.672
  216    HB   THR  30           HB       THR  30   9.034   8.957   8.957
  217    HG1  THR  30           HG1      THR  30  10.154  10.337  10.337
  218   1HG2  THR  30          HG22      THR  30   7.142  10.647  10.647
  219   2HG2  THR  30          HG21      THR  30   8.199  11.768  11.768
  220   3HG2  THR  30          HG23      THR  30   8.853  10.751  10.751
  221    H    GLU  31           HN       GLU  31   8.338   9.560   9.560
  222    HA   GLU  31           HA       GLU  31   9.325   6.869   6.869
  223   1HB   GLU  31           HB2      GLU  31   9.218   9.240   9.240
  224   2HB   GLU  31           HB1      GLU  31  10.312   7.880   7.880
  225   1HG   GLU  31           HG2      GLU  31  10.438   9.210   9.210
  226   2HG   GLU  31           HG1      GLU  31  10.852  10.278  10.278
  227    H    VAL  32           HN       VAL  32   7.995   5.291   5.291
  228    HA   VAL  32           HA       VAL  32   6.113   5.827   5.827
  229    HB   VAL  32           HB       VAL  32   5.864   3.960   3.960
  230   1HG1  VAL  32          HG13      VAL  32   4.390   4.156   4.156
  231   2HG1  VAL  32          HG12      VAL  32   3.434   3.867   3.867
  232   3HG1  VAL  32          HG11      VAL  32   4.714   2.741   2.741
  233   1HG2  VAL  32          HG22      VAL  32   4.564   6.559   6.559
  234   2HG2  VAL  32          HG21      VAL  32   5.294   6.130   6.130
  235   3HG2  VAL  32          HG23      VAL  32   3.739   5.438   5.438
  236    H    ARG  33           HN       ARG  33   7.607   5.151   5.151
  237    HA   ARG  33           HA       ARG  33   9.249   2.766   2.766
  238   1HB   ARG  33           HB2      ARG  33   9.798   4.782   4.782
  239   2HB   ARG  33           HB1      ARG  33   8.449   4.385   4.385
  240   1HG   ARG  33           HG2      ARG  33   9.485   2.251   2.251
  241   2HG   ARG  33           HG1      ARG  33  10.799   2.552   2.552
  242   1HD   ARG  33           HD2      ARG  33  11.510   4.518   4.518
  243   2HD   ARG  33           HD1      ARG  33  10.173   4.252   4.252
  244    HE   ARG  33           HE       ARG  33  11.425   1.796   1.796
  245   1HH1  ARG  33          HH21      ARG  33  12.555   5.057   5.057
  246   2HH1  ARG  33          HH22      ARG  33  13.833   4.537   4.537
  247   1HH2  ARG  33          HH11      ARG  33  13.088   1.170   1.170
  248   2HH2  ARG  33          HH12      ARG  33  14.134   2.361   2.361
  249    H    VAL  34           HN       VAL  34   8.326   0.751   0.751
  250    HA   VAL  34           HA       VAL  34   6.059   0.359   0.359
  251    HB   VAL  34           HB       VAL  34   5.340  -1.420  -1.420
  252   1HG1  VAL  34          HG11      VAL  34   4.412   0.857   0.857
  253   2HG1  VAL  34          HG13      VAL  34   5.739   1.339   1.339
  254   3HG1  VAL  34          HG12      VAL  34   4.561   0.148   0.148
  255   1HG2  VAL  34          HG23      VAL  34   7.646  -1.798  -1.798
  256   2HG2  VAL  34          HG22      VAL  34   6.401  -1.586  -1.586
  257   3HG2  VAL  34          HG21      VAL  34   7.495  -0.258  -0.258
  258    H    THR  35           HN       THR  35   6.179  -1.316  -1.316
  259    HA   THR  35           HA       THR  35   8.544  -3.147  -3.147
  260    HB   THR  35           HB       THR  35   7.352  -1.769  -1.769
  261    HG1  THR  35           HG1      THR  35   8.532  -0.344  -0.344
  262   1HG2  THR  35          HG23      THR  35   9.706  -3.650  -3.650
  263   2HG2  THR  35          HG22      THR  35   9.444  -2.678  -2.678
  264   3HG2  THR  35          HG21      THR  35   8.269  -3.910  -3.910
  265    H    VAL  36           HN       VAL  36   8.123  -5.281  -5.281
  266    HA   VAL  36           HA       VAL  36   5.290  -5.940  -5.940
  267    HB   VAL  36           HB       VAL  36   7.429  -7.475  -7.475
  268   1HG1  VAL  36          HG12      VAL  36   5.942  -8.951  -8.951
  269   2HG1  VAL  36          HG11      VAL  36   4.544  -8.241  -8.241
  270   3HG1  VAL  36          HG13      VAL  36   5.716  -9.179  -9.179
  271   1HG2  VAL  36          HG22      VAL  36   5.150  -5.728  -5.728
  272   2HG2  VAL  36          HG21      VAL  36   6.633  -6.088  -6.088
  273   3HG2  VAL  36          HG23      VAL  36   5.289  -7.227  -7.227
  274    H    LEU  37           HN       LEU  37   5.023  -7.244  -7.244
  275    HA   LEU  37           HA       LEU  37   7.636  -8.060  -8.060
  276   1HB   LEU  37           HB2      LEU  37   5.178  -6.868  -6.868
  277   2HB   LEU  37           HB1      LEU  37   6.665  -7.314  -7.314
  278    HG   LEU  37           HG       LEU  37   6.815  -5.392  -5.392
  279   1HD1  LEU  37          HD13      LEU  37   4.965  -4.874  -4.874
  280   2HD1  LEU  37          HD12      LEU  37   6.402  -4.275  -4.275
  281   3HD1  LEU  37          HD11      LEU  37   5.948  -3.607  -3.607
  282   1HD2  LEU  37          HD21      LEU  37   8.456  -6.337  -6.337
  283   2HD2  LEU  37          HD23      LEU  37   8.950  -5.528  -5.528
  284   3HD2  LEU  37          HD22      LEU  37   8.409  -4.575  -4.575
  285    H    ARG  38           HN       ARG  38   7.234  -9.554  -9.554
  286    HA   ARG  38           HA       ARG  38   4.990 -11.479 -11.479
  287   1HB   ARG  38           HB2      ARG  38   7.923 -11.949 -11.949
  288   2HB   ARG  38           HB1      ARG  38   6.708 -13.224 -13.224
  289   1HG   ARG  38           HG2      ARG  38   6.173 -12.902 -12.902
  290   2HG   ARG  38           HG1      ARG  38   7.304 -11.554 -11.554
  291   1HD   ARG  38           HD2      ARG  38   9.162 -13.110 -13.110
  292   2HD   ARG  38           HD1      ARG  38   8.003 -14.453 -14.453
  293    HE   ARG  38           HE       ARG  38   7.968 -12.808 -12.808
  294   1HH1  ARG  38          HH21      ARG  38   9.477 -15.525 -15.525
  295   2HH1  ARG  38          HH22      ARG  38   9.992 -16.244 -16.244
  296   1HH2  ARG  38          HH11      ARG  38   8.655 -13.774 -13.774
  297   2HH2  ARG  38          HH12      ARG  38   9.533 -15.266 -15.266
  298    H    GLN  39           HN       GLN  39   3.718 -11.637 -11.637
  299    HA   GLN  39           HA       GLN  39   4.948 -10.831 -10.831
  300   1HB   GLN  39           HB2      GLN  39   2.126 -10.922 -10.922
  301   2HB   GLN  39           HB1      GLN  39   2.479 -10.626 -10.626
  302   1HG   GLN  39           HG2      GLN  39   3.754  -8.650  -8.650
  303   2HG   GLN  39           HG1      GLN  39   3.668  -8.997  -8.997
  304   1HE2  GLN  39          HE22      GLN  39  -0.133  -8.229  -8.229
  305   2HE2  GLN  39          HE21      GLN  39   0.647  -9.661  -9.661
  306    H    ALA  40           HN       ALA  40   5.197 -12.301 -12.301
  307    HA   ALA  40           HA       ALA  40   4.137 -15.062 -15.062
  308   1HB   ALA  40           HB3      ALA  40   6.658 -14.089 -14.089
  309   2HB   ALA  40           HB2      ALA  40   6.131 -14.474 -14.474
  310   3HB   ALA  40           HB1      ALA  40   6.148 -15.730 -15.730
  311    H    ASP  41           HN       ASP  41   4.082 -16.071 -16.071
  312    HA   ASP  41           HA       ASP  41   1.702 -15.071 -15.071
  313   1HB   ASP  41           HB2      ASP  41   3.946 -16.808 -16.808
  314   2HB   ASP  41           HB1      ASP  41   2.491 -16.546 -16.546
  315    H    SER  42           HN       SER  42   5.114 -14.564 -14.564
  316    HA   SER  42           HA       SER  42   4.182 -12.234 -12.234
  317   1HB   SER  42           HB2      SER  42   5.874 -12.945 -12.945
  318   2HB   SER  42           HB1      SER  42   4.661 -14.192 -14.192
  319    HG   SER  42           HG       SER  42   7.258 -14.417 -14.417
  320    H    GLN  43           HN       GLN  43   6.102 -13.135 -13.135
  321    HA   GLN  43           HA       GLN  43   7.841 -10.730 -10.730
  322   1HB   GLN  43           HB2      GLN  43   8.602 -13.548 -13.548
  323   2HB   GLN  43           HB1      GLN  43   9.674 -12.165 -12.165
  324   1HG   GLN  43           HG2      GLN  43   9.633 -11.692 -11.692
  325   2HG   GLN  43           HG1      GLN  43   8.475 -12.997 -12.997
  326   1HE2  GLN  43          HE22      GLN  43  11.143 -15.228 -15.228
  327   2HE2  GLN  43          HE21      GLN  43   9.645 -14.627 -14.627
  328    H    VAL  44           HN       VAL  44   8.544  -9.760  -9.760
  329    HA   VAL  44           HA       VAL  44   7.134 -10.724 -10.724
  330    HB   VAL  44           HB       VAL  44   7.370  -7.875  -7.875
  331   1HG1  VAL  44          HG12      VAL  44   7.326  -8.335  -8.335
  332   2HG1  VAL  44          HG11      VAL  44   5.657  -8.843  -8.843
  333   3HG1  VAL  44          HG13      VAL  44   6.147  -7.192  -7.192
  334   1HG2  VAL  44          HG23      VAL  44   5.757  -9.419  -9.419
  335   2HG2  VAL  44          HG22      VAL  44   5.019  -7.997  -7.997
  336   3HG2  VAL  44          HG21      VAL  44   4.872  -9.569  -9.569
  337    H    THR  45           HN       THR  45   8.349 -10.420 -10.420
  338    HA   THR  45           HA       THR  45  11.066  -9.174  -9.174
  339    HB   THR  45           HB       THR  45  11.944 -11.035 -11.035
  340    HG1  THR  45           HG1      THR  45  10.334 -11.663 -11.663
  341   1HG2  THR  45          HG21      THR  45  11.708 -11.258 -11.258
  342   2HG2  THR  45          HG23      THR  45  10.202 -12.132 -12.132
  343   3HG2  THR  45          HG22      THR  45  11.728 -12.795 -12.795
  344    H    GLU  46           HN       GLU  46  11.972  -8.301  -8.301
  345    HA   GLU  46           HA       GLU  46   9.952  -7.218  -7.218
  346   1HB   GLU  46           HB2      GLU  46  12.938  -6.844  -6.844
  347   2HB   GLU  46           HB1      GLU  46  11.958  -5.946  -5.946
  348   1HG   GLU  46           HG2      GLU  46  11.820  -4.462  -4.462
  349   2HG   GLU  46           HG1      GLU  46  10.489  -5.513  -5.513
  350    H    VAL  47           HN       VAL  47  10.232  -7.317  -7.317
  351    HA   VAL  47           HA       VAL  47  11.578  -9.840  -9.840
  352    HB   VAL  47           HB       VAL  47   8.984  -8.549  -8.549
  353   1HG1  VAL  47          HG11      VAL  47  10.570 -10.861 -10.861
  354   2HG1  VAL  47          HG13      VAL  47   8.809 -10.925 -10.925
  355   3HG1  VAL  47          HG12      VAL  47   9.674  -9.637  -9.637
  356   1HG2  VAL  47          HG22      VAL  47   9.659 -10.879 -10.879
  357   2HG2  VAL  47          HG21      VAL  47   8.528  -9.560  -9.560
  358   3HG2  VAL  47          HG23      VAL  47   8.123 -10.822 -10.822
  359    H    CYS  48           HN       CYS  48  10.005  -7.246  -7.246
  360    HA   CYS  48           HA       CYS  48  12.692  -6.555  -6.555
  361   1HB   CYS  48           HB2      CYS  48  10.074  -7.177  -7.177
  362   2HB   CYS  48           HB1      CYS  48  11.475  -6.488  -6.488
  363    H    ALA  49           HN       ALA  49  12.810  -4.369  -4.369
  364    HA   ALA  49           HA       ALA  49  10.532  -2.535  -2.535
  365   1HB   ALA  49           HB2      ALA  49  12.658  -2.977  -2.977
  366   2HB   ALA  49           HB1      ALA  49  12.510  -1.280  -1.280
  367   3HB   ALA  49           HB3      ALA  49  11.116  -2.141  -2.141
  368    H    ALA  50           HN       ALA  50  10.661  -1.175  -1.175
  369    HA   ALA  50           HA       ALA  50  13.207   0.152   0.152
  370   1HB   ALA  50           HB2      ALA  50  13.010  -2.210  -2.210
  371   2HB   ALA  50           HB1      ALA  50  11.795  -1.458  -1.458
  372   3HB   ALA  50           HB3      ALA  50  13.453  -0.854  -0.854
  373    H    THR  51           HN       THR  51  12.797   2.139   2.139
  374    HA   THR  51           HA       THR  51   9.938   2.930   2.930
  375    HB   THR  51           HB       THR  51  12.350   4.665   4.665
  376    HG1  THR  51           HG1      THR  51  12.867   3.787   3.787
  377   1HG2  THR  51          HG21      THR  51   9.526   5.038   5.038
  378   2HG2  THR  51          HG23      THR  51  10.746   6.264   6.264
  379   3HG2  THR  51          HG22      THR  51  10.362   5.826   5.826
  380    H    TYR  52           HN       TYR  52   9.000   2.675   2.675
  381    HA   TYR  52           HA       TYR  52  10.828   2.683   2.683
  382   1HB   TYR  52           HB2      TYR  52   9.016   1.373   1.373
  383   2HB   TYR  52           HB1      TYR  52   9.606   0.602   0.602
  384    HD1  TYR  52           HD1      TYR  52   6.843   2.588   2.588
  385    HD2  TYR  52           HD2      TYR  52   8.193   0.369   0.369
  386    HE1  TYR  52           HE1      TYR  52   4.520   2.617   2.617
  387    HE2  TYR  52           HE2      TYR  52   5.873   0.398   0.398
  388    HH   TYR  52           HH       TYR  52   3.358   0.671   0.671
  389    H    MET  53           HN       MET  53  10.354   3.899   3.899
  390    HA   MET  53           HA       MET  53   8.771   6.313   6.313
  391   1HB   MET  53           HB2      MET  53  10.089   5.104   5.104
  392   2HB   MET  53           HB1      MET  53   9.511   6.763   6.763
  393   1HG   MET  53           HG2      MET  53  12.075   5.963   5.963
  394   2HG   MET  53           HG1      MET  53  11.324   7.427   7.427
  395   1HE   MET  53           HE1      MET  53  11.683   7.978   7.978
  396   2HE   MET  53           HE3      MET  53   9.968   7.533   7.533
  397   3HE   MET  53           HE2      MET  53  10.989   7.021   7.021
  398    H    MET  54           HN       MET  54   6.852   6.776   6.776
  399    HA   MET  54           HA       MET  54   5.058   4.500   4.500
  400   1HB   MET  54           HB2      MET  54   4.960   7.308   7.308
  401   2HB   MET  54           HB1      MET  54   3.587   6.199   6.199
  402   1HG   MET  54           HG2      MET  54   5.100   7.294   7.294
  403   2HG   MET  54           HG1      MET  54   3.434   7.657   7.657
  404   1HE   MET  54           HE2      MET  54   5.937   5.775   5.775
  405   2HE   MET  54           HE1      MET  54   5.142   4.674   4.674
  406   3HE   MET  54           HE3      MET  54   5.621   4.117   4.117
  407    H    GLY  55           HN       GLY  55   4.893   3.032   3.032
  408   1HA   GLY  55           HA2      GLY  55   4.789   2.266   2.266
  409   2HA   GLY  55           HA1      GLY  55   5.538   3.773   3.773
  410    H    ASN  56           HN       ASN  56   6.933   1.879   1.879
  411    HA   ASN  56           HA       ASN  56   8.941   0.671   0.671
  412   1HB   ASN  56           HB2      ASN  56   9.430   3.139   3.139
  413   2HB   ASN  56           HB1      ASN  56   9.962   2.257   2.257
  414   1HD2  ASN  56          HD22      ASN  56  13.086   1.837   1.837
  415   2HD2  ASN  56          HD21      ASN  56  12.238   2.454   2.454
  416    H    GLU  57           HN       GLU  57  10.628  -0.539  -0.539
  417    HA   GLU  57           HA       GLU  57   9.400  -1.671  -1.671
  418   1HB   GLU  57           HB2      GLU  57  10.478  -3.167  -3.167
  419   2HB   GLU  57           HB1      GLU  57  10.003  -3.935  -3.935
  420   1HG   GLU  57           HG2      GLU  57   8.166  -2.252  -2.252
  421   2HG   GLU  57           HG1      GLU  57   8.192  -4.014  -4.014
  422    H    LEU  58           HN       LEU  58  11.013  -2.537  -2.537
  423    HA   LEU  58           HA       LEU  58  13.868  -2.019  -2.019
  424   1HB   LEU  58           HB2      LEU  58  12.388  -1.194  -1.194
  425   2HB   LEU  58           HB1      LEU  58  14.127  -1.033  -1.033
  426    HG   LEU  58           HG       LEU  58  12.029   0.242   0.242
  427   1HD1  LEU  58          HD11      LEU  58  12.087   1.153   1.153
  428   2HD1  LEU  58          HD13      LEU  58  13.829   1.392   1.392
  429   3HD1  LEU  58          HD12      LEU  58  12.729   2.318   2.318
  430   1HD2  LEU  58          HD22      LEU  58  15.057   0.407   0.407
  431   2HD2  LEU  58          HD21      LEU  58  14.080  -0.157  -0.157
  432   3HD2  LEU  58          HD23      LEU  58  14.060   1.548   1.548
  433    H    THR  59           HN       THR  59  15.172  -2.700  -2.700
  434    HA   THR  59           HA       THR  59  14.464  -5.531  -5.531
  435    HB   THR  59           HB       THR  59  16.920  -5.641  -5.641
  436    HG1  THR  59           HG1      THR  59  18.154  -3.881  -3.881
  437   1HG2  THR  59          HG23      THR  59  15.755  -5.820  -5.820
  438   2HG2  THR  59          HG22      THR  59  16.519  -4.260  -4.260
  439   3HG2  THR  59          HG21      THR  59  17.511  -5.672  -5.672
  440    H    PHE  60           HN       PHE  60  14.936  -6.212  -6.212
  441    HA   PHE  60           HA       PHE  60  14.603  -3.939  -3.939
  442   1HB   PHE  60           HB2      PHE  60  13.761  -6.861  -6.861
  443   2HB   PHE  60           HB1      PHE  60  13.438  -5.681  -5.681
  444    HD1  PHE  60           HD1      PHE  60  11.857  -3.801  -3.801
  445    HD2  PHE  60           HD2      PHE  60  12.612  -6.726  -6.726
  446    HE1  PHE  60           HE1      PHE  60   9.897  -2.932  -2.932
  447    HE2  PHE  60           HE2      PHE  60  10.642  -5.869  -5.869
  448    HZ   PHE  60           HZ       PHE  60   9.279  -3.981  -3.981
  449    H    LEU  61           HN       LEU  61  16.262  -3.592  -3.592
  450    HA   LEU  61           HA       LEU  61  18.762  -4.912  -4.912
  451   1HB   LEU  61           HB2      LEU  61  17.451  -3.189  -3.189
  452   2HB   LEU  61           HB1      LEU  61  19.154  -3.647  -3.647
  453    HG   LEU  61           HG       LEU  61  17.844  -2.218  -2.218
  454   1HD1  LEU  61          HD12      LEU  61  19.593  -1.186  -1.186
  455   2HD1  LEU  61          HD11      LEU  61  19.178  -0.261  -0.261
  456   3HD1  LEU  61          HD13      LEU  61  17.914  -0.746  -0.746
  457   1HD2  LEU  61          HD22      LEU  61  20.676  -3.055  -3.055
  458   2HD2  LEU  61          HD21      LEU  61  19.737  -3.438  -3.438
  459   3HD2  LEU  61          HD23      LEU  61  20.324  -1.795  -1.795
  460    H    ASP  62           HN       ASP  62  16.187  -5.353  -5.353
  461    HA   ASP  62           HA       ASP  62  17.770  -7.566  -7.566
  462   1HB   ASP  62           HB2      ASP  62  16.069  -7.406  -7.406
  463   2HB   ASP  62           HB1      ASP  62  16.738  -5.817  -5.817
  464    H    ASP  63           HN       ASP  63  17.307  -9.678  -9.678
  465    HA   ASP  63           HA       ASP  63  16.284 -11.564 -11.564
  466   1HB   ASP  63           HB2      ASP  63  13.874  -9.899  -9.899
  467   2HB   ASP  63           HB1      ASP  63  13.801 -11.598 -11.598
  468    H    SER  64           HN       SER  64  17.281 -10.045 -10.045
  469    HA   SER  64           HA       SER  64  15.608  -8.715  -8.715
  470   1HB   SER  64           HB2      SER  64  18.175 -10.278 -10.278
  471   2HB   SER  64           HB1      SER  64  17.533  -9.083  -9.083
  472    HG   SER  64           HG       SER  64  18.302  -7.577  -7.577
  473    H    ILE  67           HN       ILE  67  13.839 -10.579 -10.579
  474    HA   ILE  67           HA       ILE  67  13.947 -12.259 -12.259
  475    HB   ILE  67           HB       ILE  67  13.244 -13.159 -13.159
  476   1HG1  ILE  67          HG12      ILE  67  15.459 -13.965 -13.965
  477   2HG1  ILE  67          HG11      ILE  67  15.668 -12.976 -12.976
  478   1HG2  ILE  67          HG23      ILE  67  12.882 -14.423 -14.423
  479   2HG2  ILE  67          HG22      ILE  67  13.151 -15.440 -15.440
  480   3HG2  ILE  67          HG21      ILE  67  11.753 -14.371 -14.371
  481   1HD1  ILE  67          HD12      ILE  67  14.377 -15.136 -15.136
  482   2HD1  ILE  67          HD11      ILE  67  15.324 -15.885 -15.885
  483   3HD1  ILE  67          HD13      ILE  67  16.130 -14.947 -14.947
  484    H    CYS  68           HN       CYS  68  12.479  -9.736  -9.736
  485    HA   CYS  68           HA       CYS  68   9.662 -10.674 -10.674
  486   1HB   CYS  68           HB2      CYS  68  10.903  -8.114  -8.114
  487   2HB   CYS  68           HB1      CYS  68   9.186  -8.510  -8.510
  488    H    THR  69           HN       THR  69   8.536 -10.124 -10.124
  489    HA   THR  69           HA       THR  69   9.374  -7.750  -7.750
  490    HB   THR  69           HB       THR  69  10.444  -9.769  -9.769
  491    HG1  THR  69           HG1      THR  69   9.771  -8.268  -8.268
  492   1HG2  THR  69          HG23      THR  69   7.608 -10.815 -10.815
  493   2HG2  THR  69          HG22      THR  69   8.871 -11.515 -11.515
  494   3HG2  THR  69          HG21      THR  69   9.034 -11.537 -11.537
  495    H    GLY  70           HN       GLY  70   7.564  -6.808  -6.808
  496   1HA   GLY  70           HA2      GLY  70   4.997  -8.050  -8.050
  497   2HA   GLY  70           HA1      GLY  70   5.029  -7.048  -7.048
  498    H    THR  71           HN       THR  71   3.267  -6.015  -6.015
  499    HA   THR  71           HA       THR  71   4.454  -3.987  -3.987
  500    HB   THR  71           HB       THR  71   1.690  -5.148  -5.148
  501    HG1  THR  71           HG1      THR  71   2.957  -6.664  -6.664
  502   1HG2  THR  71          HG21      THR  71   2.892  -3.035  -3.035
  503   2HG2  THR  71          HG23      THR  71   1.566  -4.030  -4.030
  504   3HG2  THR  71          HG22      THR  71   1.338  -3.034  -3.034
  505    H    SER  72           HN       SER  72   3.221  -1.879  -1.879
  506    HA   SER  72           HA       SER  72   1.877  -1.282  -1.282
  507   1HB   SER  72           HB2      SER  72   3.420   0.586   0.586
  508   2HB   SER  72           HB1      SER  72   4.328  -0.917  -0.917
  509    HG   SER  72           HG       SER  72   4.125   1.237   1.237
  510    H    SER  73           HN       SER  73   0.529   0.589   0.589
  511    HA   SER  73           HA       SER  73   0.238   1.811   1.811
  512   1HB   SER  73           HB2      SER  73  -1.926   0.818   0.818
  513   2HB   SER  73           HB1      SER  73  -2.214   1.626   1.626
  514    HG   SER  73           HG       SER  73  -2.245  -0.717  -0.717
  515    H    GLY  74           HN       GLY  74  -1.552   3.722   3.722
  516   1HA   GLY  74           HA2      GLY  74  -0.273   5.776   5.776
  517   2HA   GLY  74           HA1      GLY  74  -1.983   5.800   5.800
  518    H    ASN  75           HN       ASN  75  -3.351   4.272   4.272
  519    HA   ASN  75           HA       ASN  75  -2.485   4.849   4.849
  520   1HB   ASN  75           HB2      ASN  75  -5.198   4.534   4.534
  521   2HB   ASN  75           HB1      ASN  75  -4.963   4.803   4.803
  522   1HD2  ASN  75          HD22      ASN  75  -5.369   8.077   8.077
  523   2HD2  ASN  75          HD21      ASN  75  -6.240   6.623   6.623
  524    H    GLN  76           HN       GLN  76  -2.385   2.248   2.248
  525    HA   GLN  76           HA       GLN  76  -3.185   0.354   0.354
  526   1HB   GLN  76           HB2      GLN  76  -4.797   0.496   0.496
  527   2HB   GLN  76           HB1      GLN  76  -3.499   0.142   0.142
  528   1HG   GLN  76           HG2      GLN  76  -3.133  -2.006  -2.006
  529   2HG   GLN  76           HG1      GLN  76  -4.344  -1.665  -1.665
  530   1HE2  GLN  76          HE22      GLN  76  -5.702  -2.246  -2.246
  531   2HE2  GLN  76          HE21      GLN  76  -4.194  -1.504  -1.504
  532    H    VAL  77           HN       VAL  77  -1.460  -1.023  -1.023
  533    HA   VAL  77           HA       VAL  77   0.815  -1.205  -1.205
  534    HB   VAL  77           HB       VAL  77   2.204  -1.371  -1.371
  535   1HG1  VAL  77          HG12      VAL  77   0.832   0.885   0.885
  536   2HG1  VAL  77          HG11      VAL  77   0.445   0.729   0.729
  537   3HG1  VAL  77          HG13      VAL  77   2.129   0.824   0.824
  538   1HG2  VAL  77          HG23      VAL  77  -0.282  -2.124  -2.124
  539   2HG2  VAL  77          HG22      VAL  77   1.379  -2.525  -2.525
  540   3HG2  VAL  77          HG21      VAL  77   0.680  -0.982  -0.982
  541    H    ASN  78           HN       ASN  78   1.419  -3.240  -3.240
  542    HA   ASN  78           HA       ASN  78   0.000  -5.587  -5.587
  543   1HB   ASN  78           HB2      ASN  78  -0.408  -4.942  -4.942
  544   2HB   ASN  78           HB1      ASN  78   1.299  -5.250  -5.250
  545    HD2  ASN  78          HD22      ASN  78  -1.554  -7.003  -7.003
  546    H    LEU  79           HN       LEU  79   1.367  -6.653  -6.653
  547    HA   LEU  79           HA       LEU  79   4.279  -6.864  -6.864
  548   1HB   LEU  79           HB2      LEU  79   2.729  -7.220  -7.220
  549   2HB   LEU  79           HB1      LEU  79   4.469  -7.454  -7.454
  550    HG   LEU  79           HG       LEU  79   3.013  -4.865  -4.865
  551   1HD1  LEU  79          HD12      LEU  79   3.659  -5.960  -5.960
  552   2HD1  LEU  79          HD11      LEU  79   4.908  -4.757  -4.757
  553   3HD1  LEU  79          HD13      LEU  79   3.208  -4.293  -4.293
  554   1HD2  LEU  79          HD22      LEU  79   5.902  -5.738  -5.738
  555   2HD2  LEU  79          HD21      LEU  79   4.977  -4.891  -4.891
  556   3HD2  LEU  79          HD23      LEU  79   5.477  -4.042  -4.042
  557    H    THR  80           HN       THR  80   5.013  -8.893  -8.893
  558    HA   THR  80           HA       THR  80   3.246 -11.254 -11.254
  559    HB   THR  80           HB       THR  80   4.963 -10.683 -10.683
  560    HG1  THR  80           HG1      THR  80   3.198  -9.929  -9.929
  561   1HG2  THR  80          HG22      THR  80   3.226 -12.960 -12.960
  562   2HG2  THR  80          HG21      THR  80   3.342 -12.576 -12.576
  563   3HG2  THR  80          HG23      THR  80   4.793 -12.996 -12.996
  564    H    ILE  81           HN       ILE  81   4.260 -13.026 -13.026
  565    HA   ILE  81           HA       ILE  81   7.205 -12.839 -12.839
  566    HB   ILE  81           HB       ILE  81   4.969 -14.475 -14.475
  567   1HG1  ILE  81          HG12      ILE  81   6.626 -12.252 -12.252
  568   2HG1  ILE  81          HG11      ILE  81   5.065 -11.969 -11.969
  569   1HG2  ILE  81          HG22      ILE  81   7.920 -14.290 -14.290
  570   2HG2  ILE  81          HG21      ILE  81   6.704 -15.063 -15.063
  571   3HG2  ILE  81          HG23      ILE  81   7.068 -15.725 -15.725
  572   1HD1  ILE  81          HD12      ILE  81   4.132 -13.777 -13.777
  573   2HD1  ILE  81          HD11      ILE  81   5.650 -13.643 -13.643
  574   3HD1  ILE  81          HD13      ILE  81   4.579 -12.248 -12.248
  575    H    GLN  82           HN       GLN  82   8.567 -14.393 -14.393
  576    HA   GLN  82           HA       GLN  82   7.289 -16.673 -16.673
  577   1HB   GLN  82           HB2      GLN  82   9.756 -15.031 -15.031
  578   2HB   GLN  82           HB1      GLN  82   9.313 -16.505 -16.505
  579   1HG   GLN  82           HG2      GLN  82   7.203 -15.512 -15.512
  580   2HG   GLN  82           HG1      GLN  82   7.538 -14.059 -14.059
  581   1HE2  GLN  82          HE22      GLN  82  10.337 -13.186 -13.186
  582   2HE2  GLN  82          HE21      GLN  82  10.140 -13.426 -13.426
  583    H    GLY  83           HN       GLY  83   7.755 -18.545 -18.545
  584   1HA   GLY  83           HA2      GLY  83   9.455 -20.236 -20.236
  585   2HA   GLY  83           HA1      GLY  83  10.434 -18.935 -18.935
  586    H    LEU  84           HN       LEU  84   6.956 -19.485 -19.485
  587    HA   LEU  84           HA       LEU  84   7.262 -19.214 -19.214
  588   1HB   LEU  84           HB2      LEU  84   4.974 -19.750 -19.750
  589   2HB   LEU  84           HB1      LEU  84   4.748 -19.638 -19.638
  590    HG   LEU  84           HG       LEU  84   6.118 -17.478 -17.478
  591   1HD1  LEU  84          HD13      LEU  84   3.724 -17.888 -17.888
  592   2HD1  LEU  84          HD12      LEU  84   3.241 -17.516 -17.516
  593   3HD1  LEU  84          HD11      LEU  84   4.026 -16.284 -16.284
  594   1HD2  LEU  84          HD21      LEU  84   5.202 -17.868 -17.868
  595   2HD2  LEU  84          HD23      LEU  84   6.677 -17.112 -17.112
  596   3HD2  LEU  84          HD22      LEU  84   5.145 -16.242 -16.242
  597    H    ARG  85           HN       ARG  85   7.221 -20.814 -20.814
  598    HA   ARG  85           HA       ARG  85   6.918 -23.650 -23.650
  599   1HB   ARG  85           HB2      ARG  85   8.567 -22.387 -22.387
  600   2HB   ARG  85           HB1      ARG  85   8.478 -24.120 -24.120
  601   1HG   ARG  85           HG2      ARG  85   9.228 -23.563 -23.563
  602   2HG   ARG  85           HG1      ARG  85   9.635 -21.962 -21.962
  603   1HD   ARG  85           HD2      ARG  85  11.097 -23.029 -23.029
  604   2HD   ARG  85           HD1      ARG  85  10.753 -24.608 -24.608
  605    HE   ARG  85           HE       ARG  85  12.438 -22.509 -22.509
  606   1HH1  ARG  85          HH21      ARG  85  10.447 -25.311 -25.311
  607   2HH1  ARG  85          HH22      ARG  85  11.263 -25.665 -25.665
  608   1HH2  ARG  85          HH11      ARG  85  13.460 -23.004 -23.004
  609   2HH2  ARG  85          HH12      ARG  85  12.948 -24.375 -24.375
  610    H    ALA  86           HN       ALA  86   6.280 -25.046 -25.046
  611    HA   ALA  86           HA       ALA  86   3.693 -24.243 -24.243
  612   1HB   ALA  86           HB1      ALA  86   5.734 -26.216 -26.216
  613   2HB   ALA  86           HB3      ALA  86   4.057 -26.150 -26.150
  614   3HB   ALA  86           HB2      ALA  86   4.427 -26.561 -26.561
  615    H    MET  87           HN       MET  87   6.880 -24.052 -24.052
  616    HA   MET  87           HA       MET  87   6.038 -23.029 -23.029
  617   1HB   MET  87           HB2      MET  87   8.256 -24.007 -24.007
  618   2HB   MET  87           HB1      MET  87   8.609 -22.579 -22.579
  619   1HG   MET  87           HG2      MET  87   8.311 -21.163 -21.163
  620   2HG   MET  87           HG1      MET  87   8.073 -22.628 -22.628
  621   1HE   MET  87           HE1      MET  87   9.368 -24.568 -24.568
  622   2HE   MET  87           HE3      MET  87  11.073 -24.680 -24.680
  623   3HE   MET  87           HE2      MET  87  10.626 -24.262 -24.262
  624    H    ASP  88           HN       ASP  88   6.928 -21.397 -21.397
  625    HA   ASP  88           HA       ASP  88   6.988 -18.713 -18.713
  626   1HB   ASP  88           HB2      ASP  88   6.192 -19.904 -19.904
  627   2HB   ASP  88           HB1      ASP  88   6.563 -18.200 -18.200
  628    H    THR  89           HN       THR  89   4.240 -20.801 -20.801
  629    HA   THR  89           HA       THR  89   2.175 -19.017 -19.017
  630    HB   THR  89           HB       THR  89   2.090 -21.363 -21.363
  631    HG1  THR  89           HG1      THR  89   2.122 -22.620 -22.620
  632   1HG2  THR  89          HG22      THR  89   0.071 -19.754 -19.754
  633   2HG2  THR  89          HG21      THR  89  -0.022 -20.601 -20.601
  634   3HG2  THR  89          HG23      THR  89  -0.185 -21.498 -21.498
  635    H    GLY  90           HN       GLY  90   1.052 -17.544 -17.544
  636   1HA   GLY  90           HA2      GLY  90   0.516 -17.389 -17.389
  637   2HA   GLY  90           HA1      GLY  90   2.188 -16.834 -16.834
  638    H    LEU  91           HN       LEU  91   1.179 -14.790 -14.790
  639    HA   LEU  91           HA       LEU  91  -0.467 -13.229 -13.229
  640   1HB   LEU  91           HB2      LEU  91  -0.816 -13.288 -13.288
  641   2HB   LEU  91           HB1      LEU  91   0.774 -12.560 -12.560
  642    HG   LEU  91           HG       LEU  91  -0.100 -10.694 -10.694
  643   1HD1  LEU  91          HD13      LEU  91  -2.136 -12.009 -12.009
  644   2HD1  LEU  91          HD12      LEU  91  -2.730 -11.809 -11.809
  645   3HD1  LEU  91          HD11      LEU  91  -2.500 -10.396 -10.396
  646   1HD2  LEU  91          HD23      LEU  91   0.236 -10.704 -10.704
  647   2HD2  LEU  91          HD22      LEU  91  -0.723  -9.417  -9.417
  648   3HD2  LEU  91          HD21      LEU  91  -1.526 -10.776 -10.776
  649    H    TYR  92           HN       TYR  92   0.321 -11.870 -11.870
  650    HA   TYR  92           HA       TYR  92   3.126 -10.856 -10.856
  651   1HB   TYR  92           HB2      TYR  92   1.263 -11.474 -11.474
  652   2HB   TYR  92           HB1      TYR  92   2.573 -10.314 -10.314
  653    HD1  TYR  92           HD1      TYR  92   1.766 -13.858 -13.858
  654    HD2  TYR  92           HD2      TYR  92   4.891 -10.991 -10.991
  655    HE1  TYR  92           HE1      TYR  92   3.409 -15.727 -15.727
  656    HE2  TYR  92           HE2      TYR  92   6.535 -12.853 -12.853
  657    HH   TYR  92           HH       TYR  92   5.862 -16.062 -16.062
  658    H    ILE  93           HN       ILE  93   3.371  -8.505  -8.505
  659    HA   ILE  93           HA       ILE  93   0.851  -6.991  -6.991
  660    HB   ILE  93           HB       ILE  93   3.691  -6.638  -6.638
  661   1HG1  ILE  93          HG12      ILE  93   2.187  -6.595  -6.595
  662   2HG1  ILE  93          HG11      ILE  93   1.114  -7.540  -7.540
  663   1HG2  ILE  93          HG21      ILE  93   1.440  -4.691  -4.691
  664   2HG2  ILE  93          HG23      ILE  93   2.337  -4.760  -4.760
  665   3HG2  ILE  93          HG22      ILE  93   3.178  -4.397  -4.397
  666   1HD1  ILE  93          HD12      ILE  93   3.106  -9.034  -9.034
  667   2HD1  ILE  93          HD11      ILE  93   3.966  -8.178  -8.178
  668   3HD1  ILE  93          HD13      ILE  93   2.515  -9.101  -9.101
  669    H    CYS  94           HN       CYS  94   0.436  -5.193  -5.193
  670    HA   CYS  94           HA       CYS  94   2.370  -4.597  -4.597
  671   1HB   CYS  94           HB2      CYS  94   0.476  -3.689  -3.689
  672   2HB   CYS  94           HB1      CYS  94  -0.134  -5.138  -5.138
  673    H    LYS  95           HN       LYS  95   3.461  -2.658  -2.658
  674    HA   LYS  95           HA       LYS  95   2.643  -0.588  -0.588
  675   1HB   LYS  95           HB2      LYS  95   4.440  -2.124  -2.124
  676   2HB   LYS  95           HB1      LYS  95   5.430  -1.661  -1.661
  677   1HG   LYS  95           HG2      LYS  95   6.115   0.203   0.203
  678   2HG   LYS  95           HG1      LYS  95   4.445   0.726   0.726
  679   1HD   LYS  95           HD2      LYS  95   4.266  -0.666  -0.666
  680   2HD   LYS  95           HD1      LYS  95   5.919  -1.239  -1.239
  681   1HE   LYS  95           HE2      LYS  95   6.758   1.091   1.091
  682   2HE   LYS  95           HE1      LYS  95   5.099   1.643   1.643
  683   1HZ   LYS  95           HZ1      LYS  95   4.952   0.069   0.069
  684   2HZ   LYS  95           HZ3      LYS  95   6.553  -0.420  -0.420
  685   3HZ   LYS  95           HZ2      LYS  95   6.226   1.166   1.166
  686    H    VAL  96           HN       VAL  96   2.443   1.249   1.249
  687    HA   VAL  96           HA       VAL  96   4.208   1.672   1.672
  688    HB   VAL  96           HB       VAL  96   2.091   0.869   0.869
  689   1HG1  VAL  96          HG12      VAL  96   0.881   2.844   2.844
  690   2HG1  VAL  96          HG11      VAL  96  -0.047   2.000   2.000
  691   3HG1  VAL  96          HG13      VAL  96   0.773   1.075   1.075
  692   1HG2  VAL  96          HG23      VAL  96   2.984   3.472   3.472
  693   2HG2  VAL  96          HG22      VAL  96   1.973   2.412   2.412
  694   3HG2  VAL  96          HG21      VAL  96   1.226   3.569   3.569
  695    H    GLU  97           HN       GLU  97   5.405   3.440   3.440
  696    HA   GLU  97           HA       GLU  97   4.160   5.758   5.758
  697   1HB   GLU  97           HB2      GLU  97   6.832   4.419   4.419
  698   2HB   GLU  97           HB1      GLU  97   6.316   5.918   5.918
  699   1HG   GLU  97           HG2      GLU  97   5.030   3.169   3.169
  700   2HG   GLU  97           HG1      GLU  97   5.847   4.084   4.084
  701    H    LEU  98           HN       LEU  98   4.827   7.737   7.737
  702    HA   LEU  98           HA       LEU  98   6.576   7.896   7.896
  703   1HB   LEU  98           HB2      LEU  98   5.195  10.156  10.156
  704   2HB   LEU  98           HB1      LEU  98   5.568  10.074  10.074
  705    HG   LEU  98           HG       LEU  98   3.377   8.645   8.645
  706   1HD1  LEU  98          HD12      LEU  98   3.530  10.614  10.614
  707   2HD1  LEU  98          HD11      LEU  98   2.093   9.619   9.619
  708   3HD1  LEU  98          HD13      LEU  98   2.613  10.730  10.730
  709   1HD2  LEU  98          HD21      LEU  98   4.583   7.972   7.972
  710   2HD2  LEU  98          HD23      LEU  98   4.201   6.888   6.888
  711   3HD2  LEU  98          HD22      LEU  98   2.901   7.583   7.583
  712    H    MET  99           HN       MET  99   8.488   7.259   7.259
  713    HA   MET  99           HA       MET  99   9.128   8.798   8.798
  714   1HB   MET  99           HB2      MET  99   9.665   6.409   6.409
  715   2HB   MET  99           HB1      MET  99  10.862   6.929   6.929
  716   1HG   MET  99           HG2      MET  99  12.362   7.468   7.468
  717   2HG   MET  99           HG1      MET  99  11.148   8.292   8.292
  718   1HE   MET  99           HE1      MET  99   9.461   7.268   7.268
  719   2HE   MET  99           HE3      MET  99   8.922   5.862   5.862
  720   3HE   MET  99           HE2      MET  99   9.487   5.662   5.662
  721    H    TYR 100           HN       TYR 100  10.697   8.610   8.610
  722    HA   TYR 100           HA       TYR 100  12.712  10.586  10.586
  723   1HB   TYR 100           HB2      TYR 100  11.557   9.336   9.336
  724   2HB   TYR 100           HB1      TYR 100  12.893  10.485  10.485
  725    HD1  TYR 100           HD1      TYR 100  11.801   7.145   7.145
  726    HD2  TYR 100           HD2      TYR 100  15.103   9.927   9.927
  727    HE1  TYR 100           HE1      TYR 100  13.399   5.314   5.314
  728    HE2  TYR 100           HE2      TYR 100  16.703   8.095   8.095
  729    HH   TYR 100           HH       TYR 100  16.420   5.243   5.243
  730    HA   PRO 101           HA       PRO 101  10.090  13.730  13.730
  731   1HB   PRO 101           HB2      PRO 101   7.519  13.209  13.209
  732   2HB   PRO 101           HB1      PRO 101   8.866  12.585  12.585
  733   1HG   PRO 101           HG2      PRO 101   7.129  11.178  11.178
  734   2HG   PRO 101           HG1      PRO 101   7.923  10.585  10.585
  735   1HD   PRO 101           HD2      PRO 101   8.790  10.196  10.196
  736   2HD   PRO 101           HD1      PRO 101   9.716   9.867   9.867
  737    HA   PRO 102           HA       PRO 102   8.237  14.946  14.946
  738   1HB   PRO 102           HB2      PRO 102   8.923  17.559  17.559
  739   2HB   PRO 102           HB1      PRO 102  10.035  16.203  16.203
  740   1HG   PRO 102           HG2      PRO 102   9.881  17.861  17.861
  741   2HG   PRO 102           HG1      PRO 102  11.248  16.980  16.980
  742   1HD   PRO 102           HD2      PRO 102   9.561  16.288  16.288
  743   2HD   PRO 102           HD1      PRO 102  10.885  15.326  15.326
  744    HA   PRO 103           HA       PRO 103   7.522  16.080  16.080
  745   1HB   PRO 103           HB2      PRO 103   5.608  16.385  16.385
  746   2HB   PRO 103           HB1      PRO 103   6.795  17.637  17.637
  747   1HG   PRO 103           HG2      PRO 103   4.065  17.871  17.871
  748   2HG   PRO 103           HG1      PRO 103   5.318  18.675  18.675
  749   1HD   PRO 103           HD2      PRO 103   3.991  16.039  16.039
  750   2HD   PRO 103           HD1      PRO 103   3.996  17.435  17.435
  751    H    TYR 104           HN       TYR 104   6.904  14.144  14.144
  752    HA   TYR 104           HA       TYR 104   5.838  11.968  11.968
  753   1HB   TYR 104           HB2      TYR 104   7.819  12.013  12.013
  754   2HB   TYR 104           HB1      TYR 104   6.838  12.400  12.400
  755    HD1  TYR 104           HD1      TYR 104   5.585  10.003  10.003
  756    HD2  TYR 104           HD2      TYR 104   7.690  10.511  10.511
  757    HE1  TYR 104           HE1      TYR 104   5.229   7.603   7.603
  758    HE2  TYR 104           HE2      TYR 104   7.339   8.092   8.092
  759    HH   TYR 104           HH       TYR 104   6.870   5.997   5.997
  760    H    TYR 105           HN       TYR 105   3.776  11.020  11.020
  761    HA   TYR 105           HA       TYR 105   2.347  10.987  10.987
  762   1HB   TYR 105           HB2      TYR 105   0.255  12.083  12.083
  763   2HB   TYR 105           HB1      TYR 105   1.564  13.175  13.175
  764    HD1  TYR 105           HD1      TYR 105   3.111  14.011  14.011
  765    HD2  TYR 105           HD2      TYR 105  -0.524  11.865  11.865
  766    HE1  TYR 105           HE1      TYR 105   3.197  14.861  14.861
  767    HE2  TYR 105           HE2      TYR 105  -0.437  12.684  12.684
  768    HH   TYR 105           HH       TYR 105   1.540  13.553  13.553
  769    H    LEU 106           HN       LEU 106   1.840   8.802   8.802
  770    HA   LEU 106           HA       LEU 106  -0.102   8.011   8.011
  771   1HB   LEU 106           HB2      LEU 106   2.598   7.737   7.737
  772   2HB   LEU 106           HB1      LEU 106   2.136   6.125   6.125
  773    HG   LEU 106           HG       LEU 106   0.256   6.147   6.147
  774   1HD1  LEU 106          HD13      LEU 106   1.476   8.818   8.818
  775   2HD1  LEU 106          HD12      LEU 106   0.364   7.937   7.937
  776   3HD1  LEU 106          HD11      LEU 106  -0.172   8.511   8.511
  777   1HD2  LEU 106          HD23      LEU 106   3.133   6.370   6.370
  778   2HD2  LEU 106          HD22      LEU 106   2.017   5.022   5.022
  779   3HD2  LEU 106          HD21      LEU 106   1.951   6.394   6.394
  780    H    GLY 108           HN       GLY 108   0.556   5.062   5.062
  781   1HA   GLY 108           HA2      GLY 108   0.118   4.763   4.763
  782   2HA   GLY 108           HA1      GLY 108  -1.325   4.467   4.467
  783    H    ILE 109           HN       ILE 109  -0.419   2.407   2.407
  784    HA   ILE 109           HA       ILE 109   0.996   0.561   0.561
  785    HB   ILE 109           HB       ILE 109   0.836   0.765   0.765
  786   1HG1  ILE 109          HG12      ILE 109   3.395   0.732   0.732
  787   2HG1  ILE 109          HG11      ILE 109   3.007   1.128   1.128
  788   1HG2  ILE 109          HG21      ILE 109   2.151  -1.428  -1.428
  789   2HG2  ILE 109          HG23      ILE 109   2.272  -1.222  -1.222
  790   3HG2  ILE 109          HG22      ILE 109   0.717  -1.604  -1.604
  791   1HD1  ILE 109          HD12      ILE 109   1.618   2.695   2.695
  792   2HD1  ILE 109          HD11      ILE 109   3.338   3.015   3.015
  793   3HD1  ILE 109          HD13      ILE 109   2.223   3.204   3.204
  794    H    GLY 110           HN       GLY 110   0.172  -1.722  -1.722
  795   1HA   GLY 110           HA2      GLY 110  -2.741  -1.816  -1.816
  796   2HA   GLY 110           HA1      GLY 110  -1.948  -2.889  -2.889
  797    H    ASN 111           HN       ASN 111  -3.479  -3.459  -3.459
  798    HA   ASN 111           HA       ASN 111  -1.662  -4.331  -4.331
  799   1HB   ASN 111           HB2      ASN 111  -4.464  -5.032  -5.032
  800   2HB   ASN 111           HB1      ASN 111  -3.672  -5.985  -5.985
  801    HD2  ASN 111          HD22      ASN 111  -2.588  -2.712  -2.712
  802    H    GLY 112           HN       GLY 112  -2.897  -6.019  -6.019
  803   1HA   GLY 112           HA2      GLY 112  -0.937  -7.433  -7.433
  804   2HA   GLY 112           HA1      GLY 112  -1.007  -8.245  -8.245
  805    H    THR 113           HN       THR 113  -1.229  -9.498  -9.498
  806    HA   THR 113           HA       THR 113  -4.056 -10.541 -10.541
  807    HB   THR 113           HB       THR 113  -2.016 -10.226 -10.226
  808    HG1  THR 113           HG1      THR 113  -2.908  -8.294  -8.294
  809   1HG2  THR 113          HG22      THR 113  -4.782 -11.461 -11.461
  810   2HG2  THR 113          HG21      THR 113  -3.972 -10.965 -10.965
  811   3HG2  THR 113          HG23      THR 113  -3.263 -12.236 -12.236
  812    H    GLN 114           HN       GLN 114  -4.108 -12.851 -12.851
  813    HA   GLN 114           HA       GLN 114  -1.502 -14.167 -14.167
  814   1HB   GLN 114           HB2      GLN 114  -3.506 -14.637 -14.637
  815   2HB   GLN 114           HB1      GLN 114  -4.304 -15.340 -15.340
  816   1HG   GLN 114           HG2      GLN 114  -2.889 -17.165 -17.165
  817   2HG   GLN 114           HG1      GLN 114  -1.562 -16.301 -16.301
  818   1HE2  GLN 114          HE22      GLN 114  -2.454 -18.247 -18.247
  819   2HE2  GLN 114          HE21      GLN 114  -1.351 -18.093 -18.093
  820    H    ILE 115           HN       ILE 115  -0.587 -15.689 -15.689
  821    HA   ILE 115           HA       ILE 115  -1.953 -15.826 -15.826
  822    HB   ILE 115           HB       ILE 115   0.964 -16.068 -16.068
  823   1HG1  ILE 115          HG12      ILE 115  -0.455 -14.093 -14.093
  824   2HG1  ILE 115          HG11      ILE 115  -0.027 -13.777 -13.777
  825   1HG2  ILE 115          HG21      ILE 115  -0.269 -16.384 -16.384
  826   2HG2  ILE 115          HG23      ILE 115   1.461 -16.281 -16.281
  827   3HG2  ILE 115          HG22      ILE 115   0.529 -17.651 -17.651
  828   1HD1  ILE 115          HD11      ILE 115   2.382 -14.543 -14.543
  829   2HD1  ILE 115          HD13      ILE 115   1.744 -14.019 -14.019
  830   3HD1  ILE 115          HD12      ILE 115   1.833 -12.879 -12.879
  831    H    TYR 116           HN       TYR 116  -2.676 -17.851 -17.851
  832    HA   TYR 116           HA       TYR 116  -1.897 -20.221 -20.221
  833   1HB   TYR 116           HB2      TYR 116  -4.327 -19.505 -19.505
  834   2HB   TYR 116           HB1      TYR 116  -4.076 -21.112 -21.112
  835    HD1  TYR 116           HD1      TYR 116  -2.704 -19.717 -19.717
  836    HD2  TYR 116           HD2      TYR 116  -6.502 -19.401 -19.401
  837    HE1  TYR 116           HE1      TYR 116  -3.835 -19.043 -19.043
  838    HE2  TYR 116           HE2      TYR 116  -7.611 -18.754 -18.754
  839    HH   TYR 116           HH       TYR 116  -6.193 -19.151 -19.151
  840    H    VAL 117           HN       VAL 117  -1.367 -22.189 -22.189
  841    HA   VAL 117           HA       VAL 117  -0.541 -21.837 -21.837
  842    HB   VAL 117           HB       VAL 117   0.097 -23.943 -23.943
  843   1HG1  VAL 117          HG12      VAL 117   0.921 -23.624 -23.624
  844   2HG1  VAL 117          HG11      VAL 117   1.893 -24.555 -24.555
  845   3HG1  VAL 117          HG13      VAL 117   0.235 -25.044 -25.044
  846   1HG2  VAL 117          HG22      VAL 117   1.696 -21.660 -21.660
  847   2HG2  VAL 117          HG21      VAL 117   1.164 -21.805 -21.805
  848   3HG2  VAL 117          HG23      VAL 117   2.381 -22.910 -22.910
  849    H    ILE 118           HN       ILE 118  -0.960 -23.776 -23.776
  850    HA   ILE 118           HA       ILE 118  -3.710 -24.827 -24.827
  851    HB   ILE 118           HB       ILE 118  -1.991 -24.361 -24.361
  852   1HG1  ILE 118          HG12      ILE 118  -2.745 -22.281 -22.281
  853   2HG1  ILE 118          HG11      ILE 118  -3.640 -22.561 -22.561
  854   1HG2  ILE 118          HG22      ILE 118  -4.688 -25.616 -25.616
  855   2HG2  ILE 118          HG21      ILE 118  -4.391 -24.635 -24.635
  856   3HG2  ILE 118          HG23      ILE 118  -3.389 -26.050 -26.050
  857   1HD1  ILE 118          HD13      ILE 118  -5.183 -23.854 -23.854
  858   2HD1  ILE 118          HD12      ILE 118  -4.605 -22.443 -22.443
  859   3HD1  ILE 118          HD11      ILE 118  -5.493 -22.236 -22.236
  860    H    ASP 119           HN       ASP 119  -3.985 -27.028 -27.028
  861    HA   ASP 119           HA       ASP 119  -1.741 -28.830 -28.830
  862   1HB   ASP 119           HB2      ASP 119  -1.810 -28.407 -28.407
  863   2HB   ASP 119           HB1      ASP 119  -3.466 -29.009 -29.009
  864    HA   PRO 120           HA       PRO 120  -5.513 -30.336 -30.336
  865   1HB   PRO 120           HB2      PRO 120  -4.233 -31.974 -31.974
  866   2HB   PRO 120           HB1      PRO 120  -4.421 -30.226 -30.226
  867   1HG   PRO 120           HG2      PRO 120  -2.063 -31.752 -31.752
  868   2HG   PRO 120           HG1      PRO 120  -2.129 -30.373 -30.373
  869   1HD   PRO 120           HD2      PRO 120  -1.447 -30.131 -30.131
  870   2HD   PRO 120           HD1      PRO 120  -2.260 -28.839 -28.839
  871    H    GLU 121           HN       GLU 121  -6.687 -32.189 -32.189
  872    HA   GLU 121           HA       GLU 121  -5.205 -34.529 -34.529
  873   1HB   GLU 121           HB2      GLU 121  -7.727 -33.150 -33.150
  874   2HB   GLU 121           HB1      GLU 121  -7.097 -34.655 -34.655
  875   1HG   GLU 121           HG2      GLU 121  -5.017 -33.542 -33.542
  876   2HG   GLU 121           HG1      GLU 121  -5.558 -32.044 -32.044
  877    HA   PRO 122           HA       PRO 122  -7.673 -36.699 -36.699
  878   1HB   PRO 122           HB2      PRO 122  -7.476 -39.237 -39.237
  879   2HB   PRO 122           HB1      PRO 122  -6.160 -38.438 -38.438
  880   1HG   PRO 122           HG2      PRO 122  -6.538 -38.765 -38.765
  881   2HG   PRO 122           HG1      PRO 122  -5.063 -38.907 -38.907
  882   1HD   PRO 122           HD2      PRO 122  -5.645 -36.704 -36.704
  883   2HD   PRO 122           HD1      PRO 122  -4.715 -36.636 -36.636
  884    H    CYS 123           HN       CYS 123  -8.450 -36.462 -36.462
  885    HA   CYS 123           HA       CYS 123 -10.995 -37.944 -37.944
  886   1HB   CYS 123           HB2      CYS 123  -9.518 -38.038 -38.038
  887   2HB   CYS 123           HB1      CYS 123  -9.766 -36.308 -36.308
  888    HG   CYS 123           HG       CYS 123 -12.017 -38.455 -38.455
  889    HA   PRO 124           HA       PRO 124 -13.181 -34.232 -34.232
  890   1HB   PRO 124           HB2      PRO 124 -15.729 -35.031 -35.031
  891   2HB   PRO 124           HB1      PRO 124 -14.862 -35.582 -35.582
  892   1HG   PRO 124           HG2      PRO 124 -15.267 -36.972 -36.972
  893   2HG   PRO 124           HG1      PRO 124 -15.324 -37.622 -37.622
  894   1HD   PRO 124           HD2      PRO 124 -13.182 -37.939 -37.939
  895   2HD   PRO 124           HD1      PRO 124 -13.042 -37.837 -37.837
  896    H    ASP 125           HN       ASP 125 -14.568 -32.558 -32.558
  897    HA   ASP 125           HA       ASP 125 -14.096 -32.537 -32.537
  898   1HB   ASP 125           HB2      ASP 125 -14.281 -30.086 -30.086
  899   2HB   ASP 125           HB1      ASP 125 -13.079 -30.767 -30.767
  900    H    SER 126           HN       SER 126 -15.821 -31.699 -31.699
  901    HA   SER 126           HA       SER 126 -18.432 -32.766 -32.766
  902   1HB   SER 126           HB2      SER 126 -18.993 -31.711 -31.711
  903   2HB   SER 126           HB1      SER 126 -17.411 -32.478 -32.478
  904    HG   SER 126           HG       SER 126 -18.075 -29.904 -29.904
  905    H    ASP 127           HN       ASP 127 -16.992 -29.571 -29.571
  906    HA   ASP 127           HA       ASP 127 -19.400 -28.043 -28.043
  907   1HB   ASP 127           HB2      ASP 127 -17.099 -27.163 -27.163
  908   2HB   ASP 127           HB1      ASP 127 -16.652 -27.668 -27.668
  909    H    GLN 128           HN       GLN 128 -20.768 -27.854 -27.854
  910    HA   GLN 128           HA       GLN 128 -19.924 -29.074 -29.074
  911   1HB   GLN 128           HB2      GLN 128 -22.564 -29.269 -29.269
  912   2HB   GLN 128           HB1      GLN 128 -22.293 -29.889 -29.889
  913   1HG   GLN 128           HG2      GLN 128 -20.720 -30.737 -30.737
  914   2HG   GLN 128           HG1      GLN 128 -22.048 -31.656 -31.656
  915   1HE2  GLN 128          HE22      GLN 128 -20.129 -32.496 -32.496
  916   2HE2  GLN 128          HE21      GLN 128 -21.702 -32.052 -32.052
  917    H    GLU 129           HN       GLU 129 -21.001 -28.116 -28.116
  918    HA   GLU 129           HA       GLU 129 -21.716 -26.256 -26.256
  919   1HB   GLU 129           HB2      GLU 129 -23.445 -26.048 -26.048
  920   2HB   GLU 129           HB1      GLU 129 -23.761 -25.184 -25.184
  921   1HG   GLU 129           HG2      GLU 129 -23.973 -27.296 -27.296
  922   2HG   GLU 129           HG1      GLU 129 -23.556 -28.199 -28.199
  923    HA   PRO 130           HA       PRO 130 -19.360 -23.363 -23.363
  924   1HB   PRO 130           HB2      PRO 130 -16.897 -23.441 -23.441
  925   2HB   PRO 130           HB1      PRO 130 -17.366 -24.529 -24.529
  926   1HG   PRO 130           HG2      PRO 130 -17.288 -25.041 -25.041
  927   2HG   PRO 130           HG1      PRO 130 -16.814 -26.095 -26.095
  928   1HD   PRO 130           HD2      PRO 130 -19.168 -26.361 -26.361
  929   2HD   PRO 130           HD1      PRO 130 -18.967 -26.789 -26.789
  930    H    LYS 131           HN       LYS 131 -18.944 -21.173 -21.173
  931    HA   LYS 131           HA       LYS 131 -19.846 -20.429 -20.429
  932   1HB   LYS 131           HB2      LYS 131 -20.686 -19.358 -19.358
  933   2HB   LYS 131           HB1      LYS 131 -19.055 -18.776 -18.776
  934   1HG   LYS 131           HG2      LYS 131 -20.203 -16.964 -16.964
  935   2HG   LYS 131           HG1      LYS 131 -19.126 -17.648 -17.648
  936   1HD   LYS 131           HD2      LYS 131 -20.985 -18.956 -18.956
  937   2HD   LYS 131           HD1      LYS 131 -22.070 -18.316 -18.316
  938   1HE   LYS 131           HE2      LYS 131 -21.773 -16.041 -16.041
  939   2HE   LYS 131           HE1      LYS 131 -20.597 -16.625 -16.625
  940   1HZ   LYS 131           HZ3      LYS 131 -22.292 -18.119 -18.119
  941   2HZ   LYS 131           HZ2      LYS 131 -23.423 -17.520 -17.520
  942   3HZ   LYS 131           HZ1      LYS 131 -22.807 -16.506 -16.506
  943    H1   NAG 132           H1       NAG 132  -2.734  -5.510  -5.510
  944    H2   NAG 132           H2       NAG 132  -0.960  -3.163  -3.163
  945    H3   NAG 132           H3       NAG 132  -0.567  -6.183  -6.183
  946    H4   NAG 132           H4       NAG 132  -1.352  -4.071  -4.071
  947    H5   NAG 132           H5       NAG 132  -3.106  -6.277  -6.277
  948   1H6   NAG 132           H61      NAG 132  -3.286  -4.644  -4.644
  949   2H6   NAG 132           H62      NAG 132  -4.583  -4.243  -4.243
  950   1H8   NAG 132           H81      NAG 132   1.225  -1.799  -1.799
  951   2H8   NAG 132           H82      NAG 132   0.647  -3.125  -3.125
  952   3H8   NAG 132           H83      NAG 132  -0.512  -2.216  -2.216
  953    HN2  NAG 132           HN2      NAG 132  -0.488  -5.203  -5.203
  954    HO3  NAG 132           HO3      NAG 132   0.778  -3.877  -3.877
  955    H1   NAG 133           H1       NAG 133  -1.060  -5.199  -5.199
  956    H2   NAG 133           H2       NAG 133   0.916  -7.385  -7.385
  957    H3   NAG 133           H3       NAG 133   0.634  -6.090  -6.090
  958    H4   NAG 133           H4       NAG 133   2.903  -5.746  -5.746
  959    H5   NAG 133           H5       NAG 133   0.753  -3.711  -3.711
  960   1H6   NAG 133           H61      NAG 133   3.206  -3.104  -3.104
  961   2H6   NAG 133           H62      NAG 133   1.799  -2.162  -2.162
  962   1H8   NAG 133           H81      NAG 133  -3.082  -7.176  -7.176
  963   2H8   NAG 133           H82      NAG 133  -3.338  -8.237  -8.237
  964   3H8   NAG 133           H83      NAG 133  -3.417  -8.917  -8.917
  965    HN2  NAG 133           HN2      NAG 133  -0.764  -7.970  -7.970
  966    HO3  NAG 133           HO3      NAG 133   2.638  -7.286  -7.286
  967    HO6  NAG 133           HO6      NAG 133   3.311  -2.767  -2.767
  968    H1   FUC 134           H1       FUC 134  -4.851  -6.555  -6.555
  969    H2   FUC 134           H2       FUC 134  -6.512  -7.960  -7.960
  970    H3   FUC 134           H3       FUC 134  -7.883  -7.109  -7.109
  971    H4   FUC 134           H4       FUC 134  -9.673  -6.146  -6.146
  972    H5   FUC 134           H5       FUC 134  -7.727  -4.495  -4.495
  973   1H6   FUC 134           H61      FUC 134  -9.476  -3.707  -3.707
  974   2H6   FUC 134           H62      FUC 134  -8.624  -4.487  -4.487
  975   3H6   FUC 134           H63      FUC 134  -7.841  -3.148  -3.148
  976    HO2  FUC 134           HO2      FUC 134  -5.384  -9.116  -9.116
  977    HO3  FUC 134           HO3      FUC 134  -8.507  -8.945  -8.945
  978    HO4  FUC 134           HO4      FUC 134  -9.725  -7.127  -7.127
  979    H1   MAN 135           H1       MAN 135   4.379  -6.167  -6.167
  980    H2   MAN 135           H2       MAN 135   4.979  -3.965  -3.965
  981    H3   MAN 135           H3       MAN 135   6.868  -5.342  -5.342
  982    H4   MAN 135           H4       MAN 135   6.795  -4.034  -4.034
  983    H5   MAN 135           H5       MAN 135   6.056  -6.913  -6.913
  984   1H6   MAN 135           H61      MAN 135   7.087  -6.649  -6.649
  985   2H6   MAN 135           H62      MAN 135   5.849  -5.443  -5.443
  986    HO2  MAN 135           HO2      MAN 135   5.211  -3.005  -3.005
  987    HO3  MAN 135           HO3      MAN 135   7.175  -2.622  -2.622
  988    HO4  MAN 135           HO4      MAN 135   8.802  -4.857  -4.857
  989    HO6  MAN 135           HO6      MAN 135   5.598  -7.968  -7.968
  990    H1   NAG 136           H1       NAG 136   0.753  -8.737  -8.737
  991    H2   NAG 136           H2       NAG 136  -2.231  -8.947  -8.947
  992    H3   NAG 136           H3       NAG 136   0.043 -10.939 -10.939
  993    H4   NAG 136           H4       NAG 136  -1.371  -9.218  -9.218
  994    H5   NAG 136           H5       NAG 136   1.448  -8.921  -8.921
  995   1H6   NAG 136           H61      NAG 136   1.766  -7.246  -7.246
  996   2H6   NAG 136           H62      NAG 136   0.770  -8.342  -8.342
  997   1H8   NAG 136           H81      NAG 136  -2.733  -9.730  -9.730
  998   2H8   NAG 136           H82      NAG 136  -3.901  -9.104  -9.104
  999   3H8   NAG 136           H83      NAG 136  -4.157 -10.711 -10.711
 1000    HN2  NAG 136           HN2      NAG 136  -0.691 -10.195 -10.195
 1001    HO3  NAG 136           HO3      NAG 136  -1.609 -11.975 -11.975
 1002    H1   NAG 137           H1       NAG 137   1.496 -10.775 -10.775
 1003    H2   NAG 137           H2       NAG 137   0.922 -12.767 -12.767
 1004    H3   NAG 137           H3       NAG 137   3.065 -12.930 -12.930
 1005    H4   NAG 137           H4       NAG 137   3.412 -12.441 -12.441
 1006    H5   NAG 137           H5       NAG 137   3.817 -10.437 -10.437
 1007   1H6   NAG 137           H61      NAG 137   3.650  -9.024  -9.024
 1008   2H6   NAG 137           H62      NAG 137   4.478 -10.484 -10.484
 1009   1H8   NAG 137           H81      NAG 137   1.751 -15.350 -15.350
 1010   2H8   NAG 137           H82      NAG 137   0.198 -15.440 -15.440
 1011   3H8   NAG 137           H83      NAG 137   0.485 -16.495 -16.495
 1012    HN2  NAG 137           HN2      NAG 137   0.209 -12.730 -12.730
 1013    HO3  NAG 137           HO3      NAG 137   2.809 -14.470 -14.470
 1014    HO6  NAG 137           HO6      NAG 137   5.896  -8.795  -8.795
 1015    H1   FUC 138           H1       FUC 138  -1.465  -7.587  -7.587
 1016    H2   FUC 138           H2       FUC 138  -2.176  -5.140  -5.140
 1017    H3   FUC 138           H3       FUC 138  -0.589  -4.217  -4.217
 1018    H4   FUC 138           H4       FUC 138   0.907  -3.452  -3.452
 1019    H5   FUC 138           H5       FUC 138   1.495  -5.908  -5.908
 1020   1H6   FUC 138           H61      FUC 138   2.234  -6.773  -6.773
 1021   2H6   FUC 138           H62      FUC 138   2.569  -5.014  -5.014
 1022   3H6   FUC 138           H63      FUC 138   1.173  -5.640  -5.640
 1023    HO2  FUC 138           HO2      FUC 138  -2.372  -5.384  -5.384
 1024    HO3  FUC 138           HO3      FUC 138  -1.857  -2.656  -2.656
 1025    HO4  FUC 138           HO4      FUC 138  -0.518  -3.050  -3.050
 1026    H1   MAN 139           H1       MAN 139   4.886 -14.336 -14.336
 1027    H2   MAN 139           H2       MAN 139   4.851 -12.513 -12.513
 1028    H3   MAN 139           H3       MAN 139   5.843 -14.584 -14.584
 1029    H4   MAN 139           H4       MAN 139   8.526 -13.526 -13.526
 1030    H5   MAN 139           H5       MAN 139   6.803 -15.796 -15.796
 1031   1H6   MAN 139           H61      MAN 139   8.433 -15.655 -15.655
 1032   2H6   MAN 139           H62      MAN 139   9.103 -16.270 -16.270
 1033    HO2  MAN 139           HO2      MAN 139   6.507 -11.051 -11.051
 1034    HO3  MAN 139           HO3      MAN 139   6.699 -13.629 -13.629
 1035    HO4  MAN 139           HO4      MAN 139   9.034 -14.947 -14.947
 1036    HO6  MAN 139           HO6      MAN 139  10.053 -14.241 -14.241

  Start of MODEL    3
    1   1H    ALA   1           HT2      ALA   1 -12.000   1.708   1.708
    2   2H    ALA   1           HT1      ALA   1 -13.323   1.460   1.460
    3   3H    ALA   1           HT3      ALA   1 -11.743   1.375   1.375
    4    HA   ALA   1           HA       ALA   1 -12.787   3.484   3.484
    5   1HB   ALA   1           HB1      ALA   1 -13.025   3.631   3.631
    6   2HB   ALA   1           HB3      ALA   1 -13.361   4.983   4.983
    7   3HB   ALA   1           HB2      ALA   1 -14.351   3.526   3.526
    8    H    MET   1           HN       MET   1 -10.317   2.858   2.858
    9    HA   MET   1           HA       MET   1  -8.642   4.869   4.869
   10   1HB   MET   1           HB2      MET   1  -7.971   2.054   2.054
   11   2HB   MET   1           HB1      MET   1  -6.801   3.181   3.181
   12   1HG   MET   1           HG2      MET   1  -8.065   3.278   3.278
   13   2HG   MET   1           HG1      MET   1  -9.318   2.241   2.241
   14   1HE   MET   1           HE2      MET   1  -9.155   0.012   0.012
   15   2HE   MET   1           HE1      MET   1  -7.672  -0.020  -0.020
   16   3HE   MET   1           HE3      MET   1  -7.905  -1.172  -1.172
   17    H    HIS   2           HN       HIS   2  -6.427   4.985   4.985
   18    HA   HIS   2           HA       HIS   2  -7.337   5.731   5.731
   19   1HB   HIS   2           HB2      HIS   2  -4.849   6.348   6.348
   20   2HB   HIS   2           HB1      HIS   2  -5.166   6.991   6.991
   21    HD1  HIS   2           HD1      HIS   2  -6.174   7.341   7.341
   22    HD2  HIS   2           HD2      HIS   2  -7.313   8.904   8.904
   23    HE1  HIS   2           HE1      HIS   2  -7.671   9.324   9.324
   24    H    VAL   3           HN       VAL   3  -6.708   2.944   2.944
   25    HA   VAL   3           HA       VAL   3  -4.856   2.233   2.233
   26    HB   VAL   3           HB       VAL   3  -4.685   1.276   1.276
   27   1HG1  VAL   3          HG11      VAL   3  -3.309   0.457   0.457
   28   2HG1  VAL   3          HG13      VAL   3  -2.470   0.306   0.306
   29   3HG1  VAL   3          HG12      VAL   3  -3.983  -0.560  -0.560
   30   1HG2  VAL   3          HG22      VAL   3  -2.833   3.024   3.024
   31   2HG2  VAL   3          HG21      VAL   3  -3.799   3.551   3.551
   32   3HG2  VAL   3          HG23      VAL   3  -2.468   2.420   2.420
   33    H    ALA   4           HN       ALA   4  -5.718   0.491   0.491
   34    HA   ALA   4           HA       ALA   4  -7.897  -1.088  -1.088
   35   1HB   ALA   4           HB2      ALA   4  -7.744   0.478   0.478
   36   2HB   ALA   4           HB1      ALA   4  -8.371  -1.152  -1.152
   37   3HB   ALA   4           HB3      ALA   4  -9.162  -0.074  -0.074
   38    H    GLN   5           HN       GLN   5  -7.681  -3.285  -3.285
   39    HA   GLN   5           HA       GLN   5  -5.913  -4.532  -4.532
   40   1HB   GLN   5           HB2      GLN   5  -5.628  -4.706  -4.706
   41   2HB   GLN   5           HB1      GLN   5  -4.841  -5.832  -5.832
   42   1HG   GLN   5           HG2      GLN   5  -3.824  -3.802  -3.802
   43   2HG   GLN   5           HG1      GLN   5  -4.410  -2.849  -2.849
   44   1HE2  GLN   5          HE22      GLN   5  -1.259  -3.617  -3.617
   45   2HE2  GLN   5          HE21      GLN   5  -2.169  -2.417  -2.417
   46    HA   PRO   6           HA       PRO   6  -9.136  -7.609  -7.609
   47   1HB   PRO   6           HB2      PRO   6  -7.795  -9.746  -9.746
   48   2HB   PRO   6           HB1      PRO   6  -8.401  -8.407  -8.407
   49   1HG   PRO   6           HG2      PRO   6  -5.646  -8.917  -8.917
   50   2HG   PRO   6           HG1      PRO   6  -6.174  -8.314  -8.314
   51   1HD   PRO   6           HD2      PRO   6  -5.190  -6.700  -6.700
   52   2HD   PRO   6           HD1      PRO   6  -6.394  -6.157  -6.157
   53    H    ALA   7           HN       ALA   7  -9.743  -9.098  -9.098
   54    HA   ALA   7           HA       ALA   7  -8.062  -9.455  -9.455
   55   1HB   ALA   7           HB3      ALA   7 -10.598 -10.765 -10.765
   56   2HB   ALA   7           HB2      ALA   7  -9.897 -11.186 -11.186
   57   3HB   ALA   7           HB1      ALA   7 -10.447  -9.538  -9.538
   58    H    VAL   8           HN       VAL   8  -8.533 -11.419 -11.419
   59    HA   VAL   8           HA       VAL   8  -6.187 -12.965 -12.965
   60    HB   VAL   8           HB       VAL   8  -8.338 -13.876 -13.876
   61   1HG1  VAL   8          HG13      VAL   8  -8.933 -14.414 -14.414
   62   2HG1  VAL   8          HG12      VAL   8  -9.262 -15.710 -15.710
   63   3HG1  VAL   8          HG11      VAL   8 -10.032 -14.124 -14.124
   64   1HG2  VAL   8          HG22      VAL   8  -6.011 -15.092 -15.092
   65   2HG2  VAL   8          HG21      VAL   8  -7.078 -15.684 -15.684
   66   3HG2  VAL   8          HG23      VAL   8  -7.317 -16.183 -16.183
   67    H    VAL   9           HN       VAL   9  -5.461 -14.360 -14.360
   68    HA   VAL   9           HA       VAL   9  -6.554 -13.826 -13.826
   69    HB   VAL   9           HB       VAL   9  -3.845 -13.266 -13.266
   70   1HG1  VAL   9          HG11      VAL   9  -4.486 -13.968 -13.968
   71   2HG1  VAL   9          HG13      VAL   9  -3.153 -12.880 -12.880
   72   3HG1  VAL   9          HG12      VAL   9  -3.144 -14.539 -14.539
   73   1HG2  VAL   9          HG21      VAL   9  -5.889 -11.646 -11.646
   74   2HG2  VAL   9          HG23      VAL   9  -4.237 -11.118 -11.118
   75   3HG2  VAL   9          HG22      VAL   9  -5.238 -11.661 -11.661
   76    H    LEU  10           HN       LEU  10  -5.948 -15.479 -15.479
   77    HA   LEU  10           HA       LEU  10  -4.998 -18.030 -18.030
   78   1HB   LEU  10           HB2      LEU  10  -7.052 -17.588 -17.588
   79   2HB   LEU  10           HB1      LEU  10  -6.611 -19.147 -19.147
   80    HG   LEU  10           HG       LEU  10  -7.838 -16.830 -16.830
   81   1HD1  LEU  10          HD13      LEU  10  -8.991 -19.436 -19.436
   82   2HD1  LEU  10          HD12      LEU  10  -9.797 -18.410 -18.410
   83   3HD1  LEU  10          HD11      LEU  10  -9.489 -17.802 -17.802
   84   1HD2  LEU  10          HD21      LEU  10  -6.651 -19.442 -19.442
   85   2HD2  LEU  10          HD23      LEU  10  -6.787 -17.945 -17.945
   86   3HD2  LEU  10          HD22      LEU  10  -8.177 -19.021 -19.021
   87    H    ALA  11           HN       ALA  11  -3.126 -18.764 -18.764
   88    HA   ALA  11           HA       ALA  11  -2.064 -17.558 -17.558
   89   1HB   ALA  11           HB2      ALA  11  -1.173 -19.815 -19.815
   90   2HB   ALA  11           HB1      ALA  11  -0.195 -19.178 -19.178
   91   3HB   ALA  11           HB3      ALA  11  -0.615 -18.139 -18.139
   92    H    SER  12           HN       SER  12  -2.002 -18.540 -18.540
   93    HA   SER  12           HA       SER  12  -3.950 -20.663 -20.663
   94   1HB   SER  12           HB2      SER  12  -1.974 -19.150 -19.150
   95   2HB   SER  12           HB1      SER  12  -3.210 -20.236 -20.236
   96    HG   SER  12           HG       SER  12  -4.562 -18.653 -18.653
   97    H    SER  13           HN       SER  13  -0.470 -20.415 -20.415
   98    HA   SER  13           HA       SER  13  -0.068 -23.270 -23.270
   99   1HB   SER  13           HB2      SER  13  -0.959 -23.078 -23.078
  100   2HB   SER  13           HB1      SER  13   0.490 -22.162 -22.162
  101    HG   SER  13           HG       SER  13   1.065 -24.201 -24.201
  102    H    ARG  14           HN       ARG  14   2.336 -23.813 -23.813
  103    HA   ARG  14           HA       ARG  14   4.592 -23.275 -23.275
  104   1HB   ARG  14           HB2      ARG  14   4.372 -22.339 -22.339
  105   2HB   ARG  14           HB1      ARG  14   3.855 -20.809 -20.809
  106   1HG   ARG  14           HG2      ARG  14   5.990 -20.200 -20.200
  107   2HG   ARG  14           HG1      ARG  14   6.310 -21.704 -21.704
  108   1HD   ARG  14           HD2      ARG  14   6.580 -22.818 -22.818
  109   2HD   ARG  14           HD1      ARG  14   6.514 -21.197 -21.197
  110    HE   ARG  14           HE       ARG  14   8.395 -21.296 -21.296
  111   1HH1  ARG  14          HH21      ARG  14   7.995 -22.069 -22.069
  112   2HH1  ARG  14          HH22      ARG  14   9.689 -21.957 -21.957
  113   1HH2  ARG  14          HH11      ARG  14  10.577 -21.163 -21.163
  114   2HH2  ARG  14          HH12      ARG  14  11.136 -21.450 -21.450
  115    H    GLY  15           HN       GLY  15   2.221 -22.175 -22.175
  116   1HA   GLY  15           HA2      GLY  15   2.025 -20.868 -20.868
  117   2HA   GLY  15           HA1      GLY  15   3.777 -21.038 -21.038
  118    H    ILE  16           HN       ILE  16   1.838 -19.435 -19.435
  119    HA   ILE  16           HA       ILE  16   3.445 -16.970 -16.970
  120    HB   ILE  16           HB       ILE  16   1.725 -17.748 -17.748
  121   1HG1  ILE  16          HG12      ILE  16   3.462 -19.453 -19.453
  122   2HG1  ILE  16          HG11      ILE  16   3.753 -18.541 -18.541
  123   1HG2  ILE  16          HG23      ILE  16   3.978 -15.773 -15.773
  124   2HG2  ILE  16          HG22      ILE  16   3.157 -16.120 -16.120
  125   3HG2  ILE  16          HG21      ILE  16   2.269 -15.383 -15.383
  126   1HD1  ILE  16          HD12      ILE  16   4.999 -17.326 -17.326
  127   2HD1  ILE  16          HD11      ILE  16   5.515 -19.005 -19.005
  128   3HD1  ILE  16          HD13      ILE  16   5.724 -17.855 -17.855
  129    H    ALA  17           HN       ALA  17   2.254 -15.772 -15.772
  130    HA   ALA  17           HA       ALA  17  -0.693 -15.513 -15.513
  131   1HB   ALA  17           HB2      ALA  17   1.124 -15.027 -15.027
  132   2HB   ALA  17           HB1      ALA  17  -0.595 -14.630 -14.630
  133   3HB   ALA  17           HB3      ALA  17  -0.077 -16.306 -16.306
  134    H    SER  18           HN       SER  18  -1.307 -13.682 -13.682
  135    HA   SER  18           HA       SER  18   0.394 -11.227 -11.227
  136   1HB   SER  18           HB2      SER  18  -1.514 -11.970 -11.970
  137   2HB   SER  18           HB1      SER  18  -0.328 -10.666 -10.666
  138    HG   SER  18           HG       SER  18   0.187 -12.816 -12.816
  139    H    PHE  19           HN       PHE  19  -0.597  -9.687  -9.687
  140    HA   PHE  19           HA       PHE  19  -3.584  -9.512  -9.512
  141   1HB   PHE  19           HB2      PHE  19  -3.470  -9.078  -9.078
  142   2HB   PHE  19           HB1      PHE  19  -2.854 -10.667 -10.667
  143    HD1  PHE  19           HD1      PHE  19  -0.421 -11.151 -11.151
  144    HD2  PHE  19           HD2      PHE  19  -1.994  -7.336  -7.336
  145    HE1  PHE  19           HE1      PHE  19   1.764 -10.630 -10.630
  146    HE2  PHE  19           HE2      PHE  19   0.194  -6.813  -6.813
  147    HZ   PHE  19           HZ       PHE  19   2.072  -8.465  -8.465
  148    H    VAL  20           HN       VAL  20  -4.371  -7.352  -7.352
  149    HA   VAL  20           HA       VAL  20  -2.394  -5.207  -5.207
  150    HB   VAL  20           HB       VAL  20  -5.367  -5.299  -5.299
  151   1HG1  VAL  20          HG11      VAL  20  -3.169  -3.415  -3.415
  152   2HG1  VAL  20          HG13      VAL  20  -4.810  -3.399  -3.399
  153   3HG1  VAL  20          HG12      VAL  20  -4.535  -3.027  -3.027
  154   1HG2  VAL  20          HG21      VAL  20  -3.007  -6.162  -6.162
  155   2HG2  VAL  20          HG23      VAL  20  -4.615  -6.880  -6.880
  156   3HG2  VAL  20          HG22      VAL  20  -4.366  -5.406  -5.406
  157    H    CYS  21           HN       CYS  21  -2.145  -3.634  -3.634
  158    HA   CYS  21           HA       CYS  21  -4.233  -3.358  -3.358
  159   1HB   CYS  21           HB2      CYS  21  -2.009  -4.285  -4.285
  160   2HB   CYS  21           HB1      CYS  21  -1.253  -2.795  -2.795
  161    H    GLU  22           HN       GLU  22  -5.135  -1.329  -1.329
  162    HA   GLU  22           HA       GLU  22  -4.021   0.746   0.746
  163   1HB   GLU  22           HB2      GLU  22  -6.275  -0.044  -0.044
  164   2HB   GLU  22           HB1      GLU  22  -6.709   0.339   0.339
  165   1HG   GLU  22           HG2      GLU  22  -6.330   2.719   2.719
  166   2HG   GLU  22           HG1      GLU  22  -5.801   2.368   2.368
  167    H    TYR  23           HN       TYR  23  -3.281   2.669   2.669
  168    HA   TYR  23           HA       TYR  23  -3.578   3.308   3.308
  169   1HB   TYR  23           HB2      TYR  23  -1.232   3.948   3.948
  170   2HB   TYR  23           HB1      TYR  23  -1.352   2.338   2.338
  171    HD1  TYR  23           HD1      TYR  23  -1.186   2.023   2.023
  172    HD2  TYR  23           HD2      TYR  23  -0.485   5.856   5.856
  173    HE1  TYR  23           HE1      TYR  23  -0.055   2.842   2.842
  174    HE2  TYR  23           HE2      TYR  23   0.646   6.674   6.674
  175    HH   TYR  23           HH       TYR  23   1.915   5.446   5.446
  176    H    ALA  24           HN       ALA  24  -2.789   5.751   5.751
  177    HA   ALA  24           HA       ALA  24  -3.950   7.358   7.358
  178   1HB   ALA  24           HB3      ALA  24  -5.544   6.958   6.958
  179   2HB   ALA  24           HB2      ALA  24  -4.400   7.744   7.744
  180   3HB   ALA  24           HB1      ALA  24  -5.157   8.665   8.665
  181    H    SER  25           HN       SER  25  -2.563   8.946   8.946
  182    HA   SER  25           HA       SER  25  -0.504   9.922   9.922
  183   1HB   SER  25           HB2      SER  25   0.995  10.080  10.080
  184   2HB   SER  25           HB1      SER  25   0.356   8.444   8.444
  185    HG   SER  25           HG       SER  25  -0.129   8.851   8.851
  186    HA   PRO  26           HA       PRO  26  -2.179  13.930  13.930
  187   1HB   PRO  26           HB2      PRO  26   0.030  15.501  15.501
  188   2HB   PRO  26           HB1      PRO  26  -0.883  14.742  14.742
  189   1HG   PRO  26           HG2      PRO  26   1.657  13.861  13.861
  190   2HG   PRO  26           HG1      PRO  26   1.208  13.867  13.867
  191   1HD   PRO  26           HD2      PRO  26   1.146  11.624  11.624
  192   2HD   PRO  26           HD1      PRO  26   0.006  11.910  11.910
  193    H    GLY  27           HN       GLY  27   0.437  12.645  12.645
  194   1HA   GLY  27           HA2      GLY  27  -0.467  13.986  13.986
  195   2HA   GLY  27           HA1      GLY  27   1.022  14.722  14.722
  196    H    LYS  28           HN       LYS  28   1.658  13.800  13.800
  197    HA   LYS  28           HA       LYS  28   2.441  10.917  10.917
  198   1HB   LYS  28           HB2      LYS  28   1.017  11.689  11.689
  199   2HB   LYS  28           HB1      LYS  28   2.293  12.812  12.812
  200   1HG   LYS  28           HG2      LYS  28   3.849  10.901  10.901
  201   2HG   LYS  28           HG1      LYS  28   2.543   9.792   9.792
  202   1HD   LYS  28           HD2      LYS  28   1.900  11.735  11.735
  203   2HD   LYS  28           HD1      LYS  28   3.134  10.545  10.545
  204   1HE   LYS  28           HE2      LYS  28   1.628   8.710   8.710
  205   2HE   LYS  28           HE1      LYS  28   0.394   9.871   9.871
  206   1HZ   LYS  28           HZ1      LYS  28   1.566   9.733   9.733
  207   2HZ   LYS  28           HZ3      LYS  28   0.025   9.170   9.170
  208   3HZ   LYS  28           HZ2      LYS  28   0.377  10.830  10.830
  209    H    ALA  29           HN       ALA  29   4.599  10.463  10.463
  210    HA   ALA  29           HA       ALA  29   6.604  12.580  12.580
  211   1HB   ALA  29           HB3      ALA  29   6.385  10.872  10.872
  212   2HB   ALA  29           HB2      ALA  29   7.752  11.926  11.926
  213   3HB   ALA  29           HB1      ALA  29   6.151  12.618  12.618
  214    H    THR  30           HN       THR  30   8.916  11.429  11.429
  215    HA   THR  30           HA       THR  30   9.011   9.231   9.231
  216    HB   THR  30           HB       THR  30  11.492   9.397   9.397
  217    HG1  THR  30           HG1      THR  30  10.792  11.937  11.937
  218   1HG2  THR  30          HG23      THR  30   9.922  10.826  10.826
  219   2HG2  THR  30          HG22      THR  30  11.036  11.982  11.982
  220   3HG2  THR  30          HG21      THR  30  11.657  10.520  10.520
  221    H    GLU  31           HN       GLU  31   8.850   9.385   9.385
  222    HA   GLU  31           HA       GLU  31   9.873   6.560   6.560
  223   1HB   GLU  31           HB2      GLU  31  10.123   8.747   8.747
  224   2HB   GLU  31           HB1      GLU  31  10.873   7.159   7.159
  225   1HG   GLU  31           HG2      GLU  31  11.562   8.581   8.581
  226   2HG   GLU  31           HG1      GLU  31  12.017   9.490   9.490
  227    H    VAL  32           HN       VAL  32   8.538   5.120   5.120
  228    HA   VAL  32           HA       VAL  32   6.533   5.941   5.941
  229    HB   VAL  32           HB       VAL  32   6.011   4.310   4.310
  230   1HG1  VAL  32          HG11      VAL  32   4.821   3.935   3.935
  231   2HG1  VAL  32          HG13      VAL  32   3.743   5.123   5.123
  232   3HG1  VAL  32          HG12      VAL  32   4.045   3.586   3.586
  233   1HG2  VAL  32          HG23      VAL  32   5.500   7.125   7.125
  234   2HG2  VAL  32          HG22      VAL  32   5.772   6.457   6.457
  235   3HG2  VAL  32          HG21      VAL  32   4.188   6.307   6.307
  236    H    ARG  33           HN       ARG  33   8.124   4.907   4.907
  237    HA   ARG  33           HA       ARG  33   9.189   2.294   2.294
  238   1HB   ARG  33           HB2      ARG  33  10.005   4.069   4.069
  239   2HB   ARG  33           HB1      ARG  33   8.632   3.705   3.705
  240   1HG   ARG  33           HG2      ARG  33   9.580   1.805   1.805
  241   2HG   ARG  33           HG1      ARG  33  10.139   1.312   1.312
  242   1HD   ARG  33           HD2      ARG  33  12.041   2.880   2.880
  243   2HD   ARG  33           HD1      ARG  33  11.480   3.393   3.393
  244    HE   ARG  33           HE       ARG  33  11.731   0.504   0.504
  245   1HH1  ARG  33          HH21      ARG  33  13.520   3.468   3.468
  246   2HH1  ARG  33          HH22      ARG  33  14.771   2.677   2.677
  247   1HH2  ARG  33          HH11      ARG  33  13.371  -0.476  -0.476
  248   2HH2  ARG  33          HH12      ARG  33  14.690   0.469   0.469
  249    H    VAL  34           HN       VAL  34   8.026   0.466   0.466
  250    HA   VAL  34           HA       VAL  34   5.696   0.120   0.120
  251    HB   VAL  34           HB       VAL  34   4.852  -1.428  -1.428
  252   1HG1  VAL  34          HG12      VAL  34   5.420   1.464   1.464
  253   2HG1  VAL  34          HG11      VAL  34   4.667   0.500   0.500
  254   3HG1  VAL  34          HG13      VAL  34   3.877   0.664   0.664
  255   1HG2  VAL  34          HG23      VAL  34   7.512  -1.312  -1.312
  256   2HG2  VAL  34          HG22      VAL  34   6.159  -2.115  -2.115
  257   3HG2  VAL  34          HG21      VAL  34   6.573  -0.457  -0.457
  258    H    THR  35           HN       THR  35   5.583  -1.895  -1.895
  259    HA   THR  35           HA       THR  35   7.784  -3.850  -3.850
  260    HB   THR  35           HB       THR  35   7.142  -2.429  -2.429
  261    HG1  THR  35           HG1      THR  35   8.397  -1.055  -1.055
  262   1HG2  THR  35          HG21      THR  35   8.185  -4.986  -4.986
  263   2HG2  THR  35          HG23      THR  35   9.615  -3.975  -3.975
  264   3HG2  THR  35          HG22      THR  35   8.356  -3.986  -3.986
  265    H    VAL  36           HN       VAL  36   7.162  -5.932  -5.932
  266    HA   VAL  36           HA       VAL  36   4.382  -6.359  -6.359
  267    HB   VAL  36           HB       VAL  36   6.345  -8.090  -8.090
  268   1HG1  VAL  36          HG13      VAL  36   4.857  -9.429  -9.429
  269   2HG1  VAL  36          HG12      VAL  36   3.455  -8.623  -8.623
  270   3HG1  VAL  36          HG11      VAL  36   4.471  -9.661  -9.661
  271   1HG2  VAL  36          HG21      VAL  36   4.095  -6.272  -6.272
  272   2HG2  VAL  36          HG23      VAL  36   5.574  -6.645  -6.645
  273   3HG2  VAL  36          HG22      VAL  36   4.229  -7.782  -7.782
  274    H    LEU  37           HN       LEU  37   4.153  -7.313  -7.313
  275    HA   LEU  37           HA       LEU  37   6.721  -8.329  -8.329
  276   1HB   LEU  37           HB2      LEU  37   4.316  -6.948  -6.948
  277   2HB   LEU  37           HB1      LEU  37   5.753  -7.452  -7.452
  278    HG   LEU  37           HG       LEU  37   6.199  -5.725  -5.725
  279   1HD1  LEU  37          HD13      LEU  37   4.150  -4.945  -4.945
  280   2HD1  LEU  37          HD12      LEU  37   5.525  -4.256  -4.256
  281   3HD1  LEU  37          HD11      LEU  37   5.237  -3.813  -3.813
  282   1HD2  LEU  37          HD22      LEU  37   7.530  -6.544  -6.544
  283   2HD2  LEU  37          HD21      LEU  37   8.207  -5.748  -5.748
  284   3HD2  LEU  37          HD23      LEU  37   7.501  -4.782  -4.782
  285    H    ARG  38           HN       ARG  38   6.302  -9.776  -9.776
  286    HA   ARG  38           HA       ARG  38   3.991 -11.632 -11.632
  287   1HB   ARG  38           HB2      ARG  38   6.833 -12.066 -12.066
  288   2HB   ARG  38           HB1      ARG  38   5.589 -13.308 -13.308
  289   1HG   ARG  38           HG2      ARG  38   5.952 -12.012 -12.012
  290   2HG   ARG  38           HG1      ARG  38   7.192 -13.151 -13.151
  291   1HD   ARG  38           HD2      ARG  38   4.217 -13.766 -13.766
  292   2HD   ARG  38           HD1      ARG  38   5.374 -14.298 -14.298
  293    HE   ARG  38           HE       ARG  38   6.603 -15.122 -15.122
  294   1HH1  ARG  38          HH21      ARG  38   3.329 -15.523 -15.523
  295   2HH1  ARG  38          HH22      ARG  38   3.108 -17.016 -17.016
  296   1HH2  ARG  38          HH11      ARG  38   6.272 -17.055 -17.055
  297   2HH2  ARG  38          HH12      ARG  38   4.753 -17.876 -17.876
  298    H    GLN  39           HN       GLN  39   2.479 -11.320 -11.320
  299    HA   GLN  39           HA       GLN  39   3.494 -10.427 -10.427
  300   1HB   GLN  39           HB2      GLN  39   1.777  -9.115  -9.115
  301   2HB   GLN  39           HB1      GLN  39   0.716 -10.514 -10.514
  302   1HG   GLN  39           HG2      GLN  39   1.035 -10.480 -10.480
  303   2HG   GLN  39           HG1      GLN  39   1.643  -8.838  -8.838
  304   1HE2  GLN  39          HE22      GLN  39  -2.245  -9.565  -9.565
  305   2HE2  GLN  39          HE21      GLN  39  -1.094 -10.804 -10.804
  306    H    ALA  40           HN       ALA  40   3.195 -11.605 -11.605
  307    HA   ALA  40           HA       ALA  40   1.564 -14.101 -14.101
  308   1HB   ALA  40           HB1      ALA  40   4.260 -14.118 -14.118
  309   2HB   ALA  40           HB3      ALA  40   4.209 -14.225 -14.225
  310   3HB   ALA  40           HB2      ALA  40   3.396 -15.444 -15.444
  311    H    ASP  41           HN       ASP  41   0.939 -14.778 -14.778
  312    HA   ASP  41           HA       ASP  41   0.311 -12.662 -12.662
  313   1HB   ASP  41           HB2      ASP  41   0.522 -15.644 -15.644
  314   2HB   ASP  41           HB1      ASP  41  -0.107 -14.629 -14.629
  315    H    SER  42           HN       SER  42   2.939 -15.059 -15.059
  316    HA   SER  42           HA       SER  42   4.099 -14.134 -14.134
  317   1HB   SER  42           HB2      SER  42   5.091 -15.769 -15.769
  318   2HB   SER  42           HB1      SER  42   6.050 -15.512 -15.512
  319    HG   SER  42           HG       SER  42   4.944 -17.315 -17.315
  320    H    GLN  43           HN       GLN  43   4.929 -13.488 -13.488
  321    HA   GLN  43           HA       GLN  43   6.104 -10.903 -10.903
  322   1HB   GLN  43           HB2      GLN  43   7.808 -12.556 -12.556
  323   2HB   GLN  43           HB1      GLN  43   7.727 -13.274 -13.274
  324   1HG   GLN  43           HG2      GLN  43   9.636 -11.858 -11.858
  325   2HG   GLN  43           HG1      GLN  43   8.394 -11.005 -11.005
  326   1HE2  GLN  43          HE22      GLN  43   9.916  -8.640  -8.640
  327   2HE2  GLN  43          HE21      GLN  43  10.538  -9.571  -9.571
  328    H    VAL  44           HN       VAL  44   6.794  -9.697  -9.697
  329    HA   VAL  44           HA       VAL  44   5.554 -10.716 -10.716
  330    HB   VAL  44           HB       VAL  44   5.890  -7.889  -7.889
  331   1HG1  VAL  44          HG12      VAL  44   5.751  -8.597  -8.597
  332   2HG1  VAL  44          HG11      VAL  44   4.035  -8.469  -8.469
  333   3HG1  VAL  44          HG13      VAL  44   5.101  -7.087  -7.087
  334   1HG2  VAL  44          HG23      VAL  44   4.188  -9.252  -9.252
  335   2HG2  VAL  44          HG22      VAL  44   3.455  -7.933  -7.933
  336   3HG2  VAL  44          HG21      VAL  44   3.388  -9.581  -9.581
  337    H    THR  45           HN       THR  45   6.900 -10.563 -10.563
  338    HA   THR  45           HA       THR  45   9.632  -9.381  -9.381
  339    HB   THR  45           HB       THR  45  10.490 -11.340 -11.340
  340    HG1  THR  45           HG1      THR  45   8.930 -12.111 -12.111
  341   1HG2  THR  45          HG23      THR  45  10.300 -11.394 -11.394
  342   2HG2  THR  45          HG22      THR  45   8.710 -12.138 -12.138
  343   3HG2  THR  45          HG21      THR  45  10.146 -12.993 -12.993
  344    H    GLU  46           HN       GLU  46  10.745  -8.765  -8.765
  345    HA   GLU  46           HA       GLU  46   8.932  -7.603  -7.603
  346   1HB   GLU  46           HB2      GLU  46  11.910  -7.481  -7.481
  347   2HB   GLU  46           HB1      GLU  46  11.118  -6.577  -6.577
  348   1HG   GLU  46           HG2      GLU  46   9.807  -5.321  -5.321
  349   2HG   GLU  46           HG1      GLU  46  10.266  -6.376  -6.376
  350    H    VAL  47           HN       VAL  47   9.297  -7.930  -7.930
  351    HA   VAL  47           HA       VAL  47  10.767 -10.442 -10.442
  352    HB   VAL  47           HB       VAL  47   7.890  -9.723  -9.723
  353   1HG1  VAL  47          HG13      VAL  47   9.702 -11.875 -11.875
  354   2HG1  VAL  47          HG12      VAL  47   7.954 -12.131 -12.131
  355   3HG1  VAL  47          HG11      VAL  47   8.590 -10.823 -10.823
  356   1HG2  VAL  47          HG22      VAL  47   9.289 -11.529 -11.529
  357   2HG2  VAL  47          HG21      VAL  47   7.753 -10.679 -10.679
  358   3HG2  VAL  47          HG23      VAL  47   7.835 -12.162 -12.162
  359    H    CYS  48           HN       CYS  48   8.567  -8.580  -8.580
  360    HA   CYS  48           HA       CYS  48  10.886  -8.045  -8.045
  361   1HB   CYS  48           HB2      CYS  48   7.904  -8.293  -8.293
  362   2HB   CYS  48           HB1      CYS  48   8.985  -7.770  -7.770
  363    H    ALA  49           HN       ALA  49  11.236  -5.949  -5.949
  364    HA   ALA  49           HA       ALA  49   9.460  -3.716  -3.716
  365   1HB   ALA  49           HB2      ALA  49  11.201  -4.578  -4.578
  366   2HB   ALA  49           HB1      ALA  49  12.197  -3.380  -3.380
  367   3HB   ALA  49           HB3      ALA  49  10.649  -2.907  -2.907
  368    H    ALA  50           HN       ALA  50   9.880  -1.882  -1.882
  369    HA   ALA  50           HA       ALA  50  12.388  -1.363  -1.363
  370   1HB   ALA  50           HB1      ALA  50  10.090  -2.655  -2.655
  371   2HB   ALA  50           HB3      ALA  50  11.394  -1.805  -1.805
  372   3HB   ALA  50           HB2      ALA  50  11.745  -3.246  -3.246
  373    H    THR  51           HN       THR  51  12.220   0.653   0.653
  374    HA   THR  51           HA       THR  51   9.875   2.295   2.295
  375    HB   THR  51           HB       THR  51  12.334   3.295   3.295
  376    HG1  THR  51           HG1      THR  51  13.510   2.941   2.941
  377   1HG2  THR  51          HG23      THR  51  10.147   4.377   4.377
  378   2HG2  THR  51          HG22      THR  51  11.739   5.117   5.117
  379   3HG2  THR  51          HG21      THR  51  10.936   5.087   5.087
  380    H    TYR  52           HN       TYR  52   8.210   2.135   2.135
  381    HA   TYR  52           HA       TYR  52   8.620   1.493   1.493
  382   1HB   TYR  52           HB2      TYR  52   6.544   1.196   1.196
  383   2HB   TYR  52           HB1      TYR  52   6.222   2.900   2.900
  384    HD1  TYR  52           HD1      TYR  52   6.752  -0.432  -0.432
  385    HD2  TYR  52           HD2      TYR  52   5.314   3.617   3.617
  386    HE1  TYR  52           HE1      TYR  52   5.791  -1.058  -1.058
  387    HE2  TYR  52           HE2      TYR  52   4.349   2.997   2.997
  388    HH   TYR  52           HH       TYR  52   3.517   0.609   0.609
  389    H    MET  53           HN       MET  53   9.345   2.880   2.880
  390    HA   MET  53           HA       MET  53   9.191   5.817   5.817
  391   1HB   MET  53           HB2      MET  53  11.016   4.244   4.244
  392   2HB   MET  53           HB1      MET  53  11.179   5.949   5.949
  393   1HG   MET  53           HG2      MET  53  11.437   3.597   3.597
  394   2HG   MET  53           HG1      MET  53  12.749   4.625   4.625
  395   1HE   MET  53           HE1      MET  53  13.164   6.631   6.631
  396   2HE   MET  53           HE3      MET  53  12.487   7.867   7.867
  397   3HE   MET  53           HE2      MET  53  13.562   6.618   6.618
  398    H    MET  54           HN       MET  54   6.959   4.367   4.367
  399    HA   MET  54           HA       MET  54   5.435   4.487   4.487
  400   1HB   MET  54           HB2      MET  54   7.265   6.783   6.783
  401   2HB   MET  54           HB1      MET  54   5.636   6.507   6.507
  402   1HG   MET  54           HG2      MET  54   6.323   6.947   6.947
  403   2HG   MET  54           HG1      MET  54   5.690   8.189   8.189
  404   1HE   MET  54           HE2      MET  54   5.111   6.438   6.438
  405   2HE   MET  54           HE1      MET  54   3.763   7.572   7.572
  406   3HE   MET  54           HE3      MET  54   3.460   5.830   5.830
  407    H    GLY  55           HN       GLY  55   7.728   2.731   2.731
  408   1HA   GLY  55           HA2      GLY  55   7.798   2.279   2.279
  409   2HA   GLY  55           HA1      GLY  55   9.354   2.471   2.471
  410    H    ASN  56           HN       ASN  56   9.054   0.092   0.092
  411    HA   ASN  56           HA       ASN  56   7.799  -1.893  -1.893
  412   1HB   ASN  56           HB2      ASN  56   8.024  -1.959  -1.959
  413   2HB   ASN  56           HB1      ASN  56   9.750  -2.238  -2.238
  414   1HD2  ASN  56          HD22      ASN  56   7.272  -5.364  -5.364
  415   2HD2  ASN  56          HD21      ASN  56   6.842  -3.861  -3.861
  416    H    GLU  57           HN       GLU  57  10.869  -0.452  -0.452
  417    HA   GLU  57           HA       GLU  57  12.388  -2.606  -2.606
  418   1HB   GLU  57           HB2      GLU  57  14.194  -0.982  -0.982
  419   2HB   GLU  57           HB1      GLU  57  13.295  -0.882  -0.882
  420   1HG   GLU  57           HG2      GLU  57  11.920   0.952   0.952
  421   2HG   GLU  57           HG1      GLU  57  13.159   0.967   0.967
  422    H    LEU  58           HN       LEU  58  12.441  -3.146  -3.146
  423    HA   LEU  58           HA       LEU  58  11.911  -1.034  -1.034
  424   1HB   LEU  58           HB2      LEU  58  10.893  -3.894  -3.894
  425   2HB   LEU  58           HB1      LEU  58  10.652  -2.835  -2.835
  426    HG   LEU  58           HG       LEU  58   9.766  -2.096  -2.096
  427   1HD1  LEU  58          HD12      LEU  58   8.682  -4.214  -4.214
  428   2HD1  LEU  58          HD11      LEU  58   7.993  -3.170  -3.170
  429   3HD1  LEU  58          HD13      LEU  58   7.584  -2.911  -2.911
  430   1HD2  LEU  58          HD21      LEU  58  10.098  -0.510  -0.510
  431   2HD2  LEU  58          HD23      LEU  58   8.855  -0.227  -0.227
  432   3HD2  LEU  58          HD22      LEU  58   8.449  -1.068  -1.068
  433    H    THR  59           HN       THR  59  13.135  -1.392  -1.392
  434    HA   THR  59           HA       THR  59  15.594  -2.940  -2.940
  435    HB   THR  59           HB       THR  59  16.132  -1.763  -1.763
  436    HG1  THR  59           HG1      THR  59  14.588  -0.950  -0.950
  437   1HG2  THR  59          HG22      THR  59  16.485  -0.724  -0.724
  438   2HG2  THR  59          HG21      THR  59  14.909   0.050   0.050
  439   3HG2  THR  59          HG23      THR  59  16.216   0.454   0.454
  440    H    PHE  60           HN       PHE  60  14.986  -5.130  -5.130
  441    HA   PHE  60           HA       PHE  60  13.816  -6.017  -6.017
  442   1HB   PHE  60           HB2      PHE  60  13.939  -7.256  -7.256
  443   2HB   PHE  60           HB1      PHE  60  13.264  -8.066  -8.066
  444    HD1  PHE  60           HD1      PHE  60  11.867  -5.503  -5.503
  445    HD2  PHE  60           HD2      PHE  60  11.977  -7.239  -7.239
  446    HE1  PHE  60           HE1      PHE  60   9.614  -4.535  -4.535
  447    HE2  PHE  60           HE2      PHE  60   9.737  -6.246  -6.246
  448    HZ   PHE  60           HZ       PHE  60   8.556  -4.898  -4.898
  449    H    LEU  61           HN       LEU  61  15.892  -6.332  -6.332
  450    HA   LEU  61           HA       LEU  61  17.705  -8.367  -8.367
  451   1HB   LEU  61           HB2      LEU  61  18.419  -5.788  -5.788
  452   2HB   LEU  61           HB1      LEU  61  19.596  -7.006  -7.006
  453    HG   LEU  61           HG       LEU  61  17.666  -5.634  -5.634
  454   1HD1  LEU  61          HD13      LEU  61  19.370  -4.084  -4.084
  455   2HD1  LEU  61          HD12      LEU  61  20.638  -5.180  -5.180
  456   3HD1  LEU  61          HD11      LEU  61  19.608  -4.363  -4.363
  457   1HD2  LEU  61          HD22      LEU  61  19.994  -7.540  -7.540
  458   2HD2  LEU  61          HD21      LEU  61  18.314  -7.801  -7.801
  459   3HD2  LEU  61          HD23      LEU  61  19.292  -6.610  -6.610
  460    H    ASP  62           HN       ASP  62  15.843  -7.774  -7.774
  461    HA   ASP  62           HA       ASP  62  17.777  -9.255  -9.255
  462   1HB   ASP  62           HB2      ASP  62  16.931  -6.968  -6.968
  463   2HB   ASP  62           HB1      ASP  62  15.315  -7.658  -7.658
  464    H    ASP  63           HN       ASP  63  17.304 -11.322 -11.322
  465    HA   ASP  63           HA       ASP  63  16.117 -13.352 -13.352
  466   1HB   ASP  63           HB2      ASP  63  14.048 -11.227 -11.227
  467   2HB   ASP  63           HB1      ASP  63  13.775 -12.944 -12.944
  468    H    SER  64           HN       SER  64  16.296 -12.542 -12.542
  469    HA   SER  64           HA       SER  64  15.429 -13.236 -13.236
  470   1HB   SER  64           HB2      SER  64  14.575 -15.152 -15.152
  471   2HB   SER  64           HB1      SER  64  13.026 -14.314 -14.314
  472    HG   SER  64           HG       SER  64  14.187 -15.823 -15.823
  473    H    ILE  67           HN       ILE  67  12.930 -11.792 -11.792
  474    HA   ILE  67           HA       ILE  67  11.382 -10.075 -10.075
  475    HB   ILE  67           HB       ILE  67  13.111  -9.570  -9.570
  476   1HG1  ILE  67          HG12      ILE  67  14.431  -9.697  -9.697
  477   2HG1  ILE  67          HG11      ILE  67  14.458  -8.117  -8.117
  478   1HG2  ILE  67          HG23      ILE  67  11.001  -8.052  -8.052
  479   2HG2  ILE  67          HG22      ILE  67  12.347  -7.164  -7.164
  480   3HG2  ILE  67          HG21      ILE  67  11.323  -8.155  -8.155
  481   1HD1  ILE  67          HD13      ILE  67  12.691  -7.339  -7.339
  482   2HD1  ILE  67          HD12      ILE  67  12.656  -8.923  -8.923
  483   3HD1  ILE  67          HD11      ILE  67  14.088  -7.908  -7.908
  484    H    CYS  68           HN       CYS  68   9.732  -9.362  -9.362
  485    HA   CYS  68           HA       CYS  68   8.912 -11.632 -11.632
  486   1HB   CYS  68           HB2      CYS  68   7.213  -9.346  -9.346
  487   2HB   CYS  68           HB1      CYS  68   6.698 -10.966 -10.966
  488    H    THR  69           HN       THR  69   7.364 -10.609 -10.609
  489    HA   THR  69           HA       THR  69   8.634  -8.135  -8.135
  490    HB   THR  69           HB       THR  69   9.510 -10.183 -10.183
  491    HG1  THR  69           HG1      THR  69   7.646  -8.722  -8.722
  492   1HG2  THR  69          HG22      THR  69   7.569 -11.641 -11.641
  493   2HG2  THR  69          HG21      THR  69   6.610 -10.750 -10.750
  494   3HG2  THR  69          HG23      THR  69   8.002 -11.695 -11.695
  495    H    GLY  70           HN       GLY  70   7.097  -6.792  -6.792
  496   1HA   GLY  70           HA2      GLY  70   4.417  -7.661  -7.661
  497   2HA   GLY  70           HA1      GLY  70   4.447  -6.792  -6.792
  498    H    THR  71           HN       THR  71   2.945  -5.486  -5.486
  499    HA   THR  71           HA       THR  71   4.478  -3.301  -3.301
  500    HB   THR  71           HB       THR  71   1.909  -4.659  -4.659
  501    HG1  THR  71           HG1      THR  71   3.066  -5.358  -5.358
  502   1HG2  THR  71          HG21      THR  71   3.219  -2.190  -2.190
  503   2HG2  THR  71          HG23      THR  71   2.142  -3.172  -3.172
  504   3HG2  THR  71          HG22      THR  71   1.538  -2.431  -2.431
  505    H    SER  72           HN       SER  72   3.089  -1.271  -1.271
  506    HA   SER  72           HA       SER  72   1.051  -1.104  -1.104
  507   1HB   SER  72           HB2      SER  72   3.364  -0.476  -0.476
  508   2HB   SER  72           HB1      SER  72   3.363   0.827   0.827
  509    HG   SER  72           HG       SER  72   1.669   1.772   1.772
  510    H    SER  73           HN       SER  73  -0.735   0.065   0.065
  511    HA   SER  73           HA       SER  73  -0.249   1.911   1.911
  512   1HB   SER  73           HB2      SER  73  -2.430  -0.154  -0.154
  513   2HB   SER  73           HB1      SER  73  -2.411   1.009   1.009
  514    HG   SER  73           HG       SER  73  -0.648  -1.129  -1.129
  515    H    GLY  74           HN       GLY  74  -1.167   3.910   3.910
  516   1HA   GLY  74           HA2      GLY  74  -2.339   5.658   5.658
  517   2HA   GLY  74           HA1      GLY  74  -3.667   4.501   4.501
  518    H    ASN  75           HN       ASN  75  -4.397   4.329   4.329
  519    HA   ASN  75           HA       ASN  75  -2.527   4.763   4.763
  520   1HB   ASN  75           HB2      ASN  75  -5.548   4.636   4.636
  521   2HB   ASN  75           HB1      ASN  75  -4.693   4.961   4.961
  522   1HD2  ASN  75          HD22      ASN  75  -5.439   8.038   8.038
  523   2HD2  ASN  75          HD21      ASN  75  -6.288   6.569   6.569
  524    H    GLN  76           HN       GLN  76  -3.232   2.130   2.130
  525    HA   GLN  76           HA       GLN  76  -3.679   0.333   0.333
  526   1HB   GLN  76           HB2      GLN  76  -4.304   0.128   0.128
  527   2HB   GLN  76           HB1      GLN  76  -4.431  -1.248  -1.248
  528   1HG   GLN  76           HG2      GLN  76  -6.024   0.004   0.004
  529   2HG   GLN  76           HG1      GLN  76  -5.910   1.380   1.380
  530   1HE2  GLN  76          HE22      GLN  76  -7.438  -0.758  -0.758
  531   2HE2  GLN  76          HE21      GLN  76  -5.940   0.016   0.016
  532    H    VAL  77           HN       VAL  77  -1.982  -1.062  -1.062
  533    HA   VAL  77           HA       VAL  77   0.238  -1.190  -1.190
  534    HB   VAL  77           HB       VAL  77   1.671  -1.457  -1.457
  535   1HG1  VAL  77          HG11      VAL  77   0.167   0.826   0.826
  536   2HG1  VAL  77          HG13      VAL  77   0.106   0.627   0.627
  537   3HG1  VAL  77          HG12      VAL  77   1.662   0.740   0.740
  538   1HG2  VAL  77          HG23      VAL  77  -0.781  -2.233  -2.233
  539   2HG2  VAL  77          HG22      VAL  77   0.887  -2.647  -2.647
  540   3HG2  VAL  77          HG21      VAL  77   0.207  -1.118  -1.118
  541    H    ASN  78           HN       ASN  78   0.388  -3.073  -3.073
  542    HA   ASN  78           HA       ASN  78  -0.804  -5.568  -5.568
  543   1HB   ASN  78           HB2      ASN  78   0.492  -4.619  -4.619
  544   2HB   ASN  78           HB1      ASN  78   0.115  -6.319  -6.319
  545    HD2  ASN  78          HD22      ASN  78  -3.211  -6.145  -6.145
  546    H    LEU  79           HN       LEU  79   0.514  -6.776  -6.776
  547    HA   LEU  79           HA       LEU  79   3.451  -6.913  -6.913
  548   1HB   LEU  79           HB2      LEU  79   1.897  -7.190  -7.190
  549   2HB   LEU  79           HB1      LEU  79   3.606  -7.596  -7.596
  550    HG   LEU  79           HG       LEU  79   2.393  -4.880  -4.880
  551   1HD1  LEU  79          HD12      LEU  79   2.866  -5.966  -5.966
  552   2HD1  LEU  79          HD11      LEU  79   4.406  -5.175  -5.175
  553   3HD1  LEU  79          HD13      LEU  79   2.911  -4.240  -4.240
  554   1HD2  LEU  79          HD23      LEU  79   5.229  -5.941  -5.941
  555   2HD2  LEU  79          HD22      LEU  79   4.313  -5.170  -5.170
  556   3HD2  LEU  79          HD21      LEU  79   4.863  -4.218  -4.218
  557    H    THR  80           HN       THR  80   4.094  -8.886  -8.886
  558    HA   THR  80           HA       THR  80   2.349 -11.266 -11.266
  559    HB   THR  80           HB       THR  80   4.198 -10.644 -10.644
  560    HG1  THR  80           HG1      THR  80   2.545  -9.577  -9.577
  561   1HG2  THR  80          HG21      THR  80   2.440 -12.980 -12.980
  562   2HG2  THR  80          HG23      THR  80   2.775 -12.584 -12.584
  563   3HG2  THR  80          HG22      THR  80   4.101 -12.983 -12.983
  564    H    ILE  81           HN       ILE  81   3.301 -12.982 -12.982
  565    HA   ILE  81           HA       ILE  81   6.254 -12.862 -12.862
  566    HB   ILE  81           HB       ILE  81   3.946 -14.255 -14.255
  567   1HG1  ILE  81          HG12      ILE  81   5.706 -12.078 -12.078
  568   2HG1  ILE  81          HG11      ILE  81   4.287 -11.681 -11.681
  569   1HG2  ILE  81          HG21      ILE  81   6.902 -14.142 -14.142
  570   2HG2  ILE  81          HG23      ILE  81   5.649 -14.759 -14.759
  571   3HG2  ILE  81          HG22      ILE  81   5.987 -15.586 -15.586
  572   1HD1  ILE  81          HD12      ILE  81   3.094 -13.402 -13.402
  573   2HD1  ILE  81          HD11      ILE  81   4.434 -12.994 -12.994
  574   3HD1  ILE  81          HD13      ILE  81   3.343 -11.730 -11.730
  575    H    GLN  82           HN       GLN  82   7.533 -14.544 -14.544
  576    HA   GLN  82           HA       GLN  82   6.116 -16.911 -16.911
  577   1HB   GLN  82           HB2      GLN  82   8.654 -15.498 -15.498
  578   2HB   GLN  82           HB1      GLN  82   8.031 -16.982 -16.982
  579   1HG   GLN  82           HG2      GLN  82   5.981 -15.842 -15.842
  580   2HG   GLN  82           HG1      GLN  82   6.502 -14.365 -14.365
  581   1HE2  GLN  82          HE22      GLN  82   7.684 -14.990 -14.990
  582   2HE2  GLN  82          HE21      GLN  82   6.432 -15.857 -15.857
  583    H    GLY  83           HN       GLY  83   6.524 -18.678 -18.678
  584   1HA   GLY  83           HA2      GLY  83   8.163 -20.383 -20.383
  585   2HA   GLY  83           HA1      GLY  83   9.224 -19.066 -19.066
  586    H    LEU  84           HN       LEU  84   5.771 -19.779 -19.779
  587    HA   LEU  84           HA       LEU  84   6.142 -19.039 -19.039
  588   1HB   LEU  84           HB2      LEU  84   3.795 -19.711 -19.711
  589   2HB   LEU  84           HB1      LEU  84   3.617 -19.329 -19.329
  590    HG   LEU  84           HG       LEU  84   5.050 -17.503 -17.503
  591   1HD1  LEU  84          HD11      LEU  84   2.628 -17.899 -17.899
  592   2HD1  LEU  84          HD13      LEU  84   2.191 -17.264 -17.264
  593   3HD1  LEU  84          HD12      LEU  84   3.011 -16.228 -16.228
  594   1HD2  LEU  84          HD21      LEU  84   4.212 -17.449 -17.449
  595   2HD2  LEU  84          HD23      LEU  84   5.665 -16.796 -16.796
  596   3HD2  LEU  84          HD22      LEU  84   4.132 -15.935 -15.935
  597    H    ARG  85           HN       ARG  85   6.818 -20.652 -20.652
  598    HA   ARG  85           HA       ARG  85   6.271 -23.491 -23.491
  599   1HB   ARG  85           HB2      ARG  85   7.615 -21.856 -21.856
  600   2HB   ARG  85           HB1      ARG  85   7.438 -23.605 -23.605
  601   1HG   ARG  85           HG2      ARG  85   8.619 -22.374 -22.374
  602   2HG   ARG  85           HG1      ARG  85   9.624 -22.662 -22.662
  603   1HD   ARG  85           HD2      ARG  85   8.928 -25.062 -25.062
  604   2HD   ARG  85           HD1      ARG  85   8.028 -24.749 -24.749
  605    HE   ARG  85           HE       ARG  85  10.945 -24.854 -24.854
  606   1HH1  ARG  85          HH21      ARG  85   8.251 -23.610 -23.610
  607   2HH1  ARG  85          HH22      ARG  85   9.190 -23.450 -23.450
  608   1HH2  ARG  85          HH11      ARG  85  12.121 -24.624 -24.624
  609   2HH2  ARG  85          HH12      ARG  85  11.356 -24.014 -24.014
  610    H    ALA  86           HN       ALA  86   5.169 -24.791 -24.791
  611    HA   ALA  86           HA       ALA  86   2.545 -23.864 -23.864
  612   1HB   ALA  86           HB2      ALA  86   3.613 -26.225 -26.225
  613   2HB   ALA  86           HB1      ALA  86   4.128 -25.795 -25.795
  614   3HB   ALA  86           HB3      ALA  86   2.410 -25.850 -25.850
  615    H    MET  87           HN       MET  87   5.596 -23.419 -23.419
  616    HA   MET  87           HA       MET  87   4.565 -22.484 -22.484
  617   1HB   MET  87           HB2      MET  87   6.871 -22.092 -22.092
  618   2HB   MET  87           HB1      MET  87   6.887 -23.408 -23.408
  619   1HG   MET  87           HG2      MET  87   7.207 -21.701 -21.701
  620   2HG   MET  87           HG1      MET  87   7.403 -20.478 -20.478
  621   1HE   MET  87           HE3      MET  87   8.898 -20.423 -20.423
  622   2HE   MET  87           HE2      MET  87   9.178 -22.046 -22.046
  623   3HE   MET  87           HE1      MET  87  10.536 -21.089 -21.089
  624    H    ASP  88           HN       ASP  88   5.438 -20.920 -20.920
  625    HA   ASP  88           HA       ASP  88   5.402 -18.197 -18.197
  626   1HB   ASP  88           HB2      ASP  88   4.783 -19.615 -19.615
  627   2HB   ASP  88           HB1      ASP  88   4.866 -17.858 -17.858
  628    H    THR  89           HN       THR  89   2.731 -20.400 -20.400
  629    HA   THR  89           HA       THR  89   0.609 -18.713 -18.713
  630    HB   THR  89           HB       THR  89   0.571 -20.957 -20.957
  631    HG1  THR  89           HG1      THR  89   1.283 -22.110 -22.110
  632   1HG2  THR  89          HG23      THR  89  -1.537 -19.736 -19.736
  633   2HG2  THR  89          HG22      THR  89  -1.464 -19.953 -19.953
  634   3HG2  THR  89          HG21      THR  89  -1.676 -21.351 -21.351
  635    H    GLY  90           HN       GLY  90  -0.416 -17.115 -17.115
  636   1HA   GLY  90           HA2      GLY  90  -1.133 -16.823 -16.823
  637   2HA   GLY  90           HA1      GLY  90   0.573 -16.387 -16.387
  638    H    LEU  91           HN       LEU  91  -0.401 -14.257 -14.257
  639    HA   LEU  91           HA       LEU  91  -1.764 -12.654 -12.654
  640   1HB   LEU  91           HB2      LEU  91  -2.296 -12.596 -12.596
  641   2HB   LEU  91           HB1      LEU  91  -0.678 -11.972 -11.972
  642    HG   LEU  91           HG       LEU  91  -1.318 -10.126 -10.126
  643   1HD1  LEU  91          HD13      LEU  91  -3.392 -11.212 -11.212
  644   2HD1  LEU  91          HD12      LEU  91  -4.042 -11.098 -11.098
  645   3HD1  LEU  91          HD11      LEU  91  -3.723  -9.630  -9.630
  646   1HD2  LEU  91          HD21      LEU  91  -0.952  -9.788  -9.788
  647   2HD2  LEU  91          HD23      LEU  91  -2.221  -8.745  -8.745
  648   3HD2  LEU  91          HD22      LEU  91  -2.650 -10.181 -10.181
  649    H    TYR  92           HN       TYR  92  -0.816 -11.300 -11.300
  650    HA   TYR  92           HA       TYR  92   2.035 -10.501 -10.501
  651   1HB   TYR  92           HB2      TYR  92   0.339 -11.008 -11.008
  652   2HB   TYR  92           HB1      TYR  92   1.845 -10.095 -10.095
  653    HD1  TYR  92           HD2      TYR  92   4.020 -11.142 -11.142
  654    HD2  TYR  92           HD1      TYR  92   0.342 -13.425 -13.425
  655    HE1  TYR  92           HE2      TYR  92   5.347 -13.258 -13.258
  656    HE2  TYR  92           HE1      TYR  92   1.665 -15.550 -15.550
  657    HH   TYR  92           HH       TYR  92   4.720 -15.829 -15.829
  658    H    ILE  93           HN       ILE  93   2.449  -8.254  -8.254
  659    HA   ILE  93           HA       ILE  93   0.020  -6.512  -6.512
  660    HB   ILE  93           HB       ILE  93   2.754  -6.185  -6.185
  661   1HG1  ILE  93          HG12      ILE  93   1.235  -6.363  -6.363
  662   2HG1  ILE  93          HG11      ILE  93   0.090  -7.136  -7.136
  663   1HG2  ILE  93          HG21      ILE  93   0.361  -4.403  -4.403
  664   2HG2  ILE  93          HG23      ILE  93   1.228  -4.441  -4.441
  665   3HG2  ILE  93          HG22      ILE  93   2.072  -3.980  -3.980
  666   1HD1  ILE  93          HD13      ILE  93   2.793  -8.199  -8.199
  667   2HD1  ILE  93          HD12      ILE  93   2.186  -8.392  -8.392
  668   3HD1  ILE  93          HD11      ILE  93   1.280  -9.054  -9.054
  669    H    CYS  94           HN       CYS  94  -0.187  -5.114  -5.114
  670    HA   CYS  94           HA       CYS  94   2.103  -4.500  -4.500
  671   1HB   CYS  94           HB2      CYS  94   0.450  -3.607  -3.607
  672   2HB   CYS  94           HB1      CYS  94  -0.565  -4.677  -4.677
  673    H    LYS  95           HN       LYS  95   3.524  -2.916  -2.916
  674    HA   LYS  95           HA       LYS  95   2.622  -0.913  -0.913
  675   1HB   LYS  95           HB2      LYS  95   4.550  -2.412  -2.412
  676   2HB   LYS  95           HB1      LYS  95   5.373  -1.740  -1.740
  677   1HG   LYS  95           HG2      LYS  95   6.121  -0.007  -0.007
  678   2HG   LYS  95           HG1      LYS  95   4.465   0.431   0.431
  679   1HD   LYS  95           HD2      LYS  95   4.508  -1.301  -1.301
  680   2HD   LYS  95           HD1      LYS  95   6.201  -1.616  -1.616
  681   1HE   LYS  95           HE2      LYS  95   6.808   0.684   0.684
  682   2HE   LYS  95           HE1      LYS  95   5.104   1.081   1.081
  683   1HZ   LYS  95           HZ1      LYS  95   5.033  -0.719  -0.719
  684   2HZ   LYS  95           HZ3      LYS  95   6.688  -1.004  -1.004
  685   3HZ   LYS  95           HZ2      LYS  95   6.167   0.471   0.471
  686    H    VAL  96           HN       VAL  96   2.789   1.328   1.328
  687    HA   VAL  96           HA       VAL  96   3.817   1.999   1.999
  688    HB   VAL  96           HB       VAL  96   1.170   2.906   2.906
  689   1HG1  VAL  96          HG12      VAL  96   2.632   4.045   4.045
  690   2HG1  VAL  96          HG11      VAL  96   1.627   2.918   2.918
  691   3HG1  VAL  96          HG13      VAL  96   0.876   4.135   4.135
  692   1HG2  VAL  96          HG21      VAL  96   1.882   0.526   0.526
  693   2HG2  VAL  96          HG23      VAL  96   0.713   0.655   0.655
  694   3HG2  VAL  96          HG22      VAL  96   0.335   1.328   1.328
  695    H    GLU  97           HN       GLU  97   5.505   3.389   3.389
  696    HA   GLU  97           HA       GLU  97   4.713   5.716   5.716
  697   1HB   GLU  97           HB2      GLU  97   7.159   3.949   3.949
  698   2HB   GLU  97           HB1      GLU  97   6.903   5.435   5.435
  699   1HG   GLU  97           HG2      GLU  97   4.826   4.474   4.474
  700   2HG   GLU  97           HG1      GLU  97   5.075   3.006   3.006
  701    H    LEU  98           HN       LEU  98   5.213   7.573   7.573
  702    HA   LEU  98           HA       LEU  98   7.121   7.658   7.658
  703   1HB   LEU  98           HB2      LEU  98   5.477   9.604   9.604
  704   2HB   LEU  98           HB1      LEU  98   6.644  10.194  10.194
  705    HG   LEU  98           HG       LEU  98   5.544   8.636   8.636
  706   1HD1  LEU  98          HD11      LEU  98   3.728   8.318   8.318
  707   2HD1  LEU  98          HD13      LEU  98   3.083   8.162   8.162
  708   3HD1  LEU  98          HD12      LEU  98   4.378   7.091   7.091
  709   1HD2  LEU  98          HD22      LEU  98   3.882  10.856  10.856
  710   2HD2  LEU  98          HD21      LEU  98   5.070  11.029  11.029
  711   3HD2  LEU  98          HD23      LEU  98   3.575  10.140  10.140
  712    H    MET  99           HN       MET  99   8.913   6.731   6.731
  713    HA   MET  99           HA       MET  99   9.889   7.986   7.986
  714   1HB   MET  99           HB2      MET  99  10.872   5.862   5.862
  715   2HB   MET  99           HB1      MET  99  11.863   6.413   6.413
  716   1HG   MET  99           HG2      MET  99   8.992   5.547   5.547
  717   2HG   MET  99           HG1      MET  99  10.350   4.431   4.431
  718   1HE   MET  99           HE3      MET  99   8.563   4.465   4.465
  719   2HE   MET  99           HE2      MET  99   9.006   5.140   5.140
  720   3HE   MET  99           HE1      MET  99   8.030   6.090   6.090
  721    H    TYR 100           HN       TYR 100  11.193   7.798   7.798
  722    HA   TYR 100           HA       TYR 100  13.412   9.556   9.556
  723   1HB   TYR 100           HB2      TYR 100  12.060   8.655   8.655
  724   2HB   TYR 100           HB1      TYR 100  13.582   9.539   9.539
  725    HD1  TYR 100           HD2      TYR 100  15.655   8.489   8.489
  726    HD2  TYR 100           HD1      TYR 100  11.930   6.288   6.288
  727    HE1  TYR 100           HE2      TYR 100  16.886   6.355   6.355
  728    HE2  TYR 100           HE1      TYR 100  13.160   4.157   4.157
  729    HH   TYR 100           HH       TYR 100  16.474   3.808   3.808
  730    HA   PRO 101           HA       PRO 101  10.794  13.066  13.066
  731   1HB   PRO 101           HB2      PRO 101   8.055  12.619  12.619
  732   2HB   PRO 101           HB1      PRO 101   9.230  12.449  12.449
  733   1HG   PRO 101           HG2      PRO 101   7.713  10.426  10.426
  734   2HG   PRO 101           HG1      PRO 101   8.812  10.242  10.242
  735   1HD   PRO 101           HD2      PRO 101   9.272   9.658   9.658
  736   2HD   PRO 101           HD1      PRO 101  10.231   9.167   9.167
  737    HA   PRO 102           HA       PRO 102   9.060  13.958  13.958
  738   1HB   PRO 102           HB2      PRO 102  10.032  16.492  16.492
  739   2HB   PRO 102           HB1      PRO 102  10.991  15.046  15.046
  740   1HG   PRO 102           HG2      PRO 102  11.054  16.899  16.899
  741   2HG   PRO 102           HG1      PRO 102  12.318  15.856  15.856
  742   1HD   PRO 102           HD2      PRO 102  10.706  15.347  15.347
  743   2HD   PRO 102           HD1      PRO 102  11.858  14.243  14.243
  744    HA   PRO 103           HA       PRO 103   8.810  15.475  15.475
  745   1HB   PRO 103           HB2      PRO 103   6.805  15.023  15.023
  746   2HB   PRO 103           HB1      PRO 103   7.788  16.511  16.511
  747   1HG   PRO 103           HG2      PRO 103   5.520  15.952  15.952
  748   2HG   PRO 103           HG1      PRO 103   5.460  17.113  17.113
  749   1HD   PRO 103           HD2      PRO 103   6.052  18.260  18.260
  750   2HD   PRO 103           HD1      PRO 103   7.655  18.043  18.043
  751    H    TYR 104           HN       TYR 104   8.030  13.360  13.360
  752    HA   TYR 104           HA       TYR 104   6.724  11.347  11.347
  753   1HB   TYR 104           HB2      TYR 104   8.604  10.744  10.744
  754   2HB   TYR 104           HB1      TYR 104   7.807  11.484  11.484
  755    HD1  TYR 104           HD1      TYR 104   6.554   9.097   9.097
  756    HD2  TYR 104           HD2      TYR 104   7.342   9.772   9.772
  757    HE1  TYR 104           HE1      TYR 104   5.526   6.913   6.913
  758    HE2  TYR 104           HE2      TYR 104   6.297   7.539   7.539
  759    HH   TYR 104           HH       TYR 104   5.731   5.384   5.384
  760    H    TYR 105           HN       TYR 105   4.564  10.679  10.679
  761    HA   TYR 105           HA       TYR 105   2.957  11.194  11.194
  762   1HB   TYR 105           HB2      TYR 105   3.147  13.156  13.156
  763   2HB   TYR 105           HB1      TYR 105   2.180  12.161  12.161
  764    HD1  TYR 105           HD2      TYR 105   2.265  13.889  13.889
  765    HD2  TYR 105           HD1      TYR 105  -0.065  11.613  11.613
  766    HE1  TYR 105           HE2      TYR 105   0.187  14.502  14.502
  767    HE2  TYR 105           HE1      TYR 105  -2.157  12.207  12.207
  768    HH   TYR 105           HH       TYR 105  -2.290  14.674  14.674
  769    H    LEU 106           HN       LEU 106   2.698   8.767   8.767
  770    HA   LEU 106           HA       LEU 106   0.512   8.047   8.047
  771   1HB   LEU 106           HB2      LEU 106   3.294   7.570   7.570
  772   2HB   LEU 106           HB1      LEU 106   2.461   6.041   6.041
  773    HG   LEU 106           HG       LEU 106   2.126   8.240   8.240
  774   1HD1  LEU 106          HD11      LEU 106   3.309   6.042   6.042
  775   2HD1  LEU 106          HD13      LEU 106   1.716   5.289   5.289
  776   3HD1  LEU 106          HD12      LEU 106   2.085   6.482   6.482
  777   1HD2  LEU 106          HD23      LEU 106  -0.176   6.638   6.638
  778   2HD2  LEU 106          HD22      LEU 106  -0.119   8.332   8.332
  779   3HD2  LEU 106          HD21      LEU 106  -0.102   7.045   7.045
  780    H    GLY 108           HN       GLY 108   0.884   5.231   5.231
  781   1HA   GLY 108           HA2      GLY 108   1.147   4.449   4.449
  782   2HA   GLY 108           HA1      GLY 108  -0.529   4.525   4.525
  783    H    ILE 109           HN       ILE 109  -0.048   2.186   2.186
  784    HA   ILE 109           HA       ILE 109   0.714   0.540   0.540
  785    HB   ILE 109           HB       ILE 109   0.908   0.051   0.051
  786   1HG1  ILE 109          HG12      ILE 109   3.357  -0.231  -0.231
  787   2HG1  ILE 109          HG11      ILE 109   2.974   0.486   0.486
  788   1HG2  ILE 109          HG21      ILE 109   0.311  -1.970  -1.970
  789   2HG2  ILE 109          HG23      ILE 109   1.860  -1.754  -1.754
  790   3HG2  ILE 109          HG22      ILE 109   1.808  -2.110  -2.110
  791   1HD1  ILE 109          HD12      ILE 109   1.962   2.017   2.017
  792   2HD1  ILE 109          HD11      ILE 109   3.721   1.892   1.892
  793   3HD1  ILE 109          HD13      ILE 109   2.841   2.571   2.571
  794    H    GLY 110           HN       GLY 110  -0.708  -1.331  -1.331
  795   1HA   GLY 110           HA2      GLY 110  -3.440  -0.947  -0.947
  796   2HA   GLY 110           HA1      GLY 110  -3.024  -1.988  -1.988
  797    H    ASN 111           HN       ASN 111  -4.586  -3.011  -3.011
  798    HA   ASN 111           HA       ASN 111  -3.137  -4.258  -4.258
  799   1HB   ASN 111           HB2      ASN 111  -5.737  -4.859  -4.859
  800   2HB   ASN 111           HB1      ASN 111  -5.197  -5.780  -5.780
  801    HD2  ASN 111          HD22      ASN 111  -4.325  -2.259  -2.259
  802    H    GLY 112           HN       GLY 112  -3.718  -5.352  -5.352
  803   1HA   GLY 112           HA2      GLY 112  -1.879  -6.793  -6.793
  804   2HA   GLY 112           HA1      GLY 112  -1.941  -7.678  -7.678
  805    H    THR 113           HN       THR 113  -2.143  -8.885  -8.885
  806    HA   THR 113           HA       THR 113  -4.995  -9.862  -9.862
  807    HB   THR 113           HB       THR 113  -2.813  -9.711  -9.711
  808    HG1  THR 113           HG1      THR 113  -3.653  -7.764  -7.764
  809   1HG2  THR 113          HG21      THR 113  -5.616 -10.862 -10.862
  810   2HG2  THR 113          HG23      THR 113  -4.662 -10.490 -10.490
  811   3HG2  THR 113          HG22      THR 113  -4.097 -11.723 -11.723
  812    H    GLN 114           HN       GLN 114  -5.189 -12.169 -12.169
  813    HA   GLN 114           HA       GLN 114  -2.717 -13.616 -13.616
  814   1HB   GLN 114           HB2      GLN 114  -4.907 -13.890 -13.890
  815   2HB   GLN 114           HB1      GLN 114  -5.568 -14.653 -14.653
  816   1HG   GLN 114           HG2      GLN 114  -4.202 -16.516 -16.516
  817   2HG   GLN 114           HG1      GLN 114  -2.963 -15.647 -15.647
  818   1HE2  GLN 114          HE22      GLN 114  -4.297 -17.447 -17.447
  819   2HE2  GLN 114          HE21      GLN 114  -3.037 -17.398 -17.398
  820    H    ILE 115           HN       ILE 115  -1.856 -15.312 -15.312
  821    HA   ILE 115           HA       ILE 115  -3.044 -15.447 -15.447
  822    HB   ILE 115           HB       ILE 115  -0.159 -15.626 -15.626
  823   1HG1  ILE 115          HG12      ILE 115  -1.642 -13.666 -13.666
  824   2HG1  ILE 115          HG11      ILE 115  -1.049 -13.343 -13.343
  825   1HG2  ILE 115          HG22      ILE 115  -0.638 -17.250 -17.250
  826   2HG2  ILE 115          HG21      ILE 115  -1.234 -15.917 -15.917
  827   3HG2  ILE 115          HG23      ILE 115   0.461 -15.967 -15.967
  828   1HD1  ILE 115          HD12      ILE 115   1.277 -13.777 -13.777
  829   2HD1  ILE 115          HD11      ILE 115   0.647 -13.995 -13.995
  830   3HD1  ILE 115          HD13      ILE 115   0.523 -12.421 -12.421
  831    H    TYR 116           HN       TYR 116  -3.658 -17.517 -17.517
  832    HA   TYR 116           HA       TYR 116  -2.848 -19.832 -19.832
  833   1HB   TYR 116           HB2      TYR 116  -5.309 -19.167 -19.167
  834   2HB   TYR 116           HB1      TYR 116  -5.011 -20.791 -20.791
  835    HD1  TYR 116           HD1      TYR 116  -3.932 -20.468 -20.468
  836    HD2  TYR 116           HD2      TYR 116  -6.998 -18.111 -18.111
  837    HE1  TYR 116           HE1      TYR 116  -4.890 -19.828 -19.828
  838    HE2  TYR 116           HE2      TYR 116  -7.929 -17.468 -17.468
  839    HH   TYR 116           HH       TYR 116  -7.919 -18.557 -18.557
  840    H    VAL 117           HN       VAL 117  -2.429 -21.867 -21.867
  841    HA   VAL 117           HA       VAL 117  -1.837 -21.531 -21.531
  842    HB   VAL 117           HB       VAL 117  -0.290 -23.078 -23.078
  843   1HG1  VAL 117          HG13      VAL 117  -0.056 -22.837 -22.837
  844   2HG1  VAL 117          HG12      VAL 117   1.360 -23.207 -23.207
  845   3HG1  VAL 117          HG11      VAL 117  -0.030 -24.295 -24.295
  846   1HG2  VAL 117          HG22      VAL 117   0.397 -20.583 -20.583
  847   2HG2  VAL 117          HG21      VAL 117   0.007 -20.625 -20.625
  848   3HG2  VAL 117          HG23      VAL 117   1.474 -21.406 -21.406
  849    H    ILE 118           HN       ILE 118  -1.837 -23.598 -23.598
  850    HA   ILE 118           HA       ILE 118  -3.940 -25.452 -25.452
  851    HB   ILE 118           HB       ILE 118  -2.987 -24.443 -24.443
  852   1HG1  ILE 118          HG12      ILE 118  -5.551 -23.898 -23.898
  853   2HG1  ILE 118          HG11      ILE 118  -5.471 -24.144 -24.144
  854   1HG2  ILE 118          HG22      ILE 118  -4.857 -26.747 -26.747
  855   2HG2  ILE 118          HG21      ILE 118  -4.994 -25.839 -25.839
  856   3HG2  ILE 118          HG23      ILE 118  -3.506 -26.711 -26.711
  857   1HD1  ILE 118          HD11      ILE 118  -3.339 -22.429 -22.429
  858   2HD1  ILE 118          HD13      ILE 118  -4.968 -21.759 -21.759
  859   3HD1  ILE 118          HD12      ILE 118  -4.294 -22.226 -22.226
  860    H    ASP 119           HN       ASP 119  -3.358 -27.588 -27.588
  861    HA   ASP 119           HA       ASP 119  -0.650 -28.461 -28.461
  862   1HB   ASP 119           HB2      ASP 119  -1.176 -28.452 -28.452
  863   2HB   ASP 119           HB1      ASP 119  -2.504 -29.569 -29.569
  864    HA   PRO 120           HA       PRO 120  -3.324 -30.819 -30.819
  865   1HB   PRO 120           HB2      PRO 120  -1.313 -31.750 -31.750
  866   2HB   PRO 120           HB1      PRO 120  -2.014 -30.127 -30.127
  867   1HG   PRO 120           HG2      PRO 120   0.518 -30.970 -30.970
  868   2HG   PRO 120           HG1      PRO 120   0.190 -29.550 -29.550
  869   1HD   PRO 120           HD2      PRO 120   0.325 -29.437 -29.437
  870   2HD   PRO 120           HD1      PRO 120  -0.705 -28.354 -28.354
  871    H    GLU 121           HN       GLU 121  -3.800 -33.045 -33.045
  872    HA   GLU 121           HA       GLU 121  -1.923 -34.882 -34.882
  873   1HB   GLU 121           HB2      GLU 121  -4.941 -34.615 -34.615
  874   2HB   GLU 121           HB1      GLU 121  -4.005 -35.889 -35.889
  875   1HG   GLU 121           HG2      GLU 121  -3.595 -32.920 -32.920
  876   2HG   GLU 121           HG1      GLU 121  -4.493 -33.990 -33.990
  877    HA   PRO 122           HA       PRO 122  -2.519 -37.171 -37.171
  878   1HB   PRO 122           HB2      PRO 122  -1.389 -39.542 -39.542
  879   2HB   PRO 122           HB1      PRO 122  -0.436 -38.116 -38.116
  880   1HG   PRO 122           HG2      PRO 122  -1.152 -39.119 -39.119
  881   2HG   PRO 122           HG1      PRO 122   0.384 -38.461 -38.461
  882   1HD   PRO 122           HD2      PRO 122  -1.349 -37.000 -37.000
  883   2HD   PRO 122           HD1      PRO 122  -0.312 -36.277 -36.277
  884    H    CYS 123           HN       CYS 123  -3.755 -38.093 -38.093
  885    HA   CYS 123           HA       CYS 123  -5.705 -39.958 -39.958
  886   1HB   CYS 123           HB2      CYS 123  -4.523 -39.896 -39.896
  887   2HB   CYS 123           HB1      CYS 123  -5.766 -41.030 -41.030
  888    HG   CYS 123           HG       CYS 123  -4.007 -41.925 -41.925
  889    HA   PRO 124           HA       PRO 124  -8.863 -37.191 -37.191
  890   1HB   PRO 124           HB2      PRO 124 -10.947 -38.919 -38.919
  891   2HB   PRO 124           HB1      PRO 124 -10.390 -38.446 -38.446
  892   1HG   PRO 124           HG2      PRO 124  -9.816 -40.927 -40.927
  893   2HG   PRO 124           HG1      PRO 124 -10.159 -40.729 -40.729
  894   1HD   PRO 124           HD2      PRO 124  -7.652 -41.085 -41.085
  895   2HD   PRO 124           HD1      PRO 124  -7.994 -40.147 -40.147
  896    H    ASP 125           HN       ASP 125 -10.072 -36.593 -36.593
  897    HA   ASP 125           HA       ASP 125  -9.653 -38.270 -38.270
  898   1HB   ASP 125           HB2      ASP 125  -8.553 -36.387 -36.387
  899   2HB   ASP 125           HB1      ASP 125  -7.650 -36.838 -36.838
  900    H    SER 126           HN       SER 126 -10.775 -37.138 -37.138
  901    HA   SER 126           HA       SER 126 -13.166 -35.575 -35.575
  902   1HB   SER 126           HB2      SER 126 -14.515 -37.024 -37.024
  903   2HB   SER 126           HB1      SER 126 -13.633 -38.003 -38.003
  904    HG   SER 126           HG       SER 126 -12.965 -38.991 -38.991
  905    H    ASP 127           HN       ASP 127 -14.159 -34.313 -34.313
  906    HA   ASP 127           HA       ASP 127 -12.143 -33.486 -33.486
  907   1HB   ASP 127           HB2      ASP 127 -13.004 -31.855 -31.855
  908   2HB   ASP 127           HB1      ASP 127 -14.626 -32.091 -32.091
  909    H    GLN 128           HN       GLN 128 -12.534 -34.240 -34.240
  910    HA   GLN 128           HA       GLN 128 -15.381 -34.717 -34.717
  911   1HB   GLN 128           HB2      GLN 128 -12.802 -36.148 -36.148
  912   2HB   GLN 128           HB1      GLN 128 -14.374 -36.511 -36.511
  913   1HG   GLN 128           HG2      GLN 128 -15.275 -37.099 -37.099
  914   2HG   GLN 128           HG1      GLN 128 -13.755 -36.646 -36.646
  915   1HE2  GLN 128          HE22      GLN 128 -11.997 -39.535 -39.535
  916   2HE2  GLN 128          HE21      GLN 128 -11.753 -37.884 -37.884
  917    H    GLU 129           HN       GLU 129 -15.872 -34.179 -34.179
  918    HA   GLU 129           HA       GLU 129 -15.777 -32.777 -32.777
  919   1HB   GLU 129           HB2      GLU 129 -12.875 -33.606 -33.606
  920   2HB   GLU 129           HB1      GLU 129 -13.537 -32.869 -32.869
  921   1HG   GLU 129           HG2      GLU 129 -15.097 -34.727 -34.727
  922   2HG   GLU 129           HG1      GLU 129 -14.544 -35.449 -35.449
  923    HA   PRO 130           HA       PRO 130 -13.774 -29.378 -29.378
  924   1HB   PRO 130           HB2      PRO 130 -16.048 -28.198 -28.198
  925   2HB   PRO 130           HB1      PRO 130 -15.184 -29.487 -29.487
  926   1HG   PRO 130           HG2      PRO 130 -17.633 -29.652 -29.652
  927   2HG   PRO 130           HG1      PRO 130 -17.255 -30.473 -30.473
  928   1HD   PRO 130           HD2      PRO 130 -17.071 -31.693 -31.693
  929   2HD   PRO 130           HD1      PRO 130 -16.037 -32.121 -32.121
  930    H    LYS 131           HN       LYS 131 -13.893 -27.072 -27.072
  931    HA   LYS 131           HA       LYS 131 -14.466 -26.546 -26.546
  932   1HB   LYS 131           HB2      LYS 131 -14.144 -24.718 -24.718
  933   2HB   LYS 131           HB1      LYS 131 -14.082 -24.175 -24.175
  934   1HG   LYS 131           HG2      LYS 131 -12.160 -25.620 -25.620
  935   2HG   LYS 131           HG1      LYS 131 -12.250 -26.272 -26.272
  936   1HD   LYS 131           HD2      LYS 131 -10.535 -24.576 -24.576
  937   2HD   LYS 131           HD1      LYS 131 -11.924 -23.918 -23.918
  938   1HE   LYS 131           HE2      LYS 131 -12.631 -22.680 -22.680
  939   2HE   LYS 131           HE1      LYS 131 -11.306 -23.397 -23.397
  940   1HZ   LYS 131           HZ3      LYS 131  -9.735 -22.478 -22.478
  941   2HZ   LYS 131           HZ2      LYS 131 -11.012 -21.745 -21.745
  942   3HZ   LYS 131           HZ1      LYS 131 -10.642 -21.248 -21.248
  943    H1   NAG 132           H1       NAG 132  -4.971  -3.730  -3.730
  944    H2   NAG 132           H2       NAG 132  -2.809  -1.626  -1.626
  945    H3   NAG 132           H3       NAG 132  -3.133  -3.420  -3.420
  946    H4   NAG 132           H4       NAG 132  -3.507  -0.400  -0.400
  947    H5   NAG 132           H5       NAG 132  -5.665  -2.517  -2.517
  948   1H6   NAG 132           H61      NAG 132  -5.529   0.496   0.496
  949   2H6   NAG 132           H62      NAG 132  -7.093  -0.370  -0.370
  950   1H8   NAG 132           H81      NAG 132   0.241  -2.732  -2.732
  951   2H8   NAG 132           H82      NAG 132  -1.483  -2.282  -2.282
  952   3H8   NAG 132           H83      NAG 132  -0.438  -1.437  -1.437
  953    HN2  NAG 132           HN2      NAG 132  -2.752  -4.477  -4.477
  954    HO3  NAG 132           HO3      NAG 132  -1.294  -2.500  -2.500
  955    H1   NAG 133           H1       NAG 133  -3.718   0.357   0.357
  956    H2   NAG 133           H2       NAG 133  -1.905  -1.954  -1.954
  957    H3   NAG 133           H3       NAG 133  -2.267   0.810   0.810
  958    H4   NAG 133           H4       NAG 133   0.185  -0.295  -0.295
  959    H5   NAG 133           H5       NAG 133  -1.803   1.859   1.859
  960   1H6   NAG 133           H61      NAG 133   0.470   0.496   0.496
  961   2H6   NAG 133           H62      NAG 133   0.566   2.111   2.111
  962   1H8   NAG 133           H81      NAG 133  -6.297  -2.916  -2.916
  963   2H8   NAG 133           H82      NAG 133  -5.732  -1.534  -1.534
  964   3H8   NAG 133           H83      NAG 133  -5.544  -3.191  -3.191
  965    HN2  NAG 133           HN2      NAG 133  -3.879  -0.829  -0.829
  966    HO3  NAG 133           HO3      NAG 133  -0.553  -1.401  -1.401
  967    HO6  NAG 133           HO6      NAG 133  -0.653   2.906   2.906
  968    H1   FUC 134           H1       FUC 134  -6.973   0.590   0.590
  969    H2   FUC 134           H2       FUC 134  -7.252  -0.521  -0.521
  970    H3   FUC 134           H3       FUC 134  -9.760   1.021   1.021
  971    H4   FUC 134           H4       FUC 134 -10.996  -1.150  -1.150
  972    H5   FUC 134           H5       FUC 134 -10.145  -0.856  -0.856
  973   1H6   FUC 134           H61      FUC 134 -10.845  -3.268  -3.268
  974   2H6   FUC 134           H62      FUC 134  -9.337  -3.613  -3.613
  975   3H6   FUC 134           H63      FUC 134 -10.761  -2.947  -2.947
  976    HO2  FUC 134           HO2      FUC 134  -7.570   2.072   2.072
  977    HO3  FUC 134           HO3      FUC 134  -9.594   1.389   1.389
  978    HO4  FUC 134           HO4      FUC 134  -9.329  -1.813  -1.813
  979    H1   MAN 135           H1       MAN 135   1.558   0.229   0.229
  980    H2   MAN 135           H2       MAN 135   2.417   1.450   1.450
  981    H3   MAN 135           H3       MAN 135   4.127   0.673   0.673
  982    H4   MAN 135           H4       MAN 135   3.874   3.329   3.329
  983    H5   MAN 135           H5       MAN 135   3.005   0.519   0.519
  984   1H6   MAN 135           H61      MAN 135   3.147   3.209   3.209
  985   2H6   MAN 135           H62      MAN 135   1.804   2.114   2.114
  986    HO2  MAN 135           HO2      MAN 135   1.276   3.465   3.465
  987    HO3  MAN 135           HO3      MAN 135   4.855   2.050   2.050
  988    HO4  MAN 135           HO4      MAN 135   5.873   2.565   2.565
  989    HO6  MAN 135           HO6      MAN 135   3.232   0.634   0.634
  990    H1   NAG 136           H1       NAG 136  -0.582  -6.950  -6.950
  991    H2   NAG 136           H2       NAG 136  -3.422  -7.854  -7.854
  992    H3   NAG 136           H3       NAG 136  -0.763  -9.294  -9.294
  993    H4   NAG 136           H4       NAG 136  -2.532  -7.850  -7.850
  994    H5   NAG 136           H5       NAG 136   0.115  -6.946  -6.946
  995   1H6   NAG 136           H61      NAG 136   0.222  -5.658  -5.658
  996   2H6   NAG 136           H62      NAG 136  -1.168  -6.505  -6.505
  997   1H8   NAG 136           H81      NAG 136  -4.665  -8.049  -8.049
  998   2H8   NAG 136           H82      NAG 136  -5.431  -9.664  -9.664
  999   3H8   NAG 136           H83      NAG 136  -4.464  -9.186  -9.186
 1000    HN2  NAG 136           HN2      NAG 136  -1.595  -8.708  -8.708
 1001    HO3  NAG 136           HO3      NAG 136  -2.060 -10.880 -10.880
 1002    H1   NAG 137           H1       NAG 137   0.659  -7.846  -7.846
 1003    H2   NAG 137           H2       NAG 137   0.685 -10.662 -10.662
 1004    H3   NAG 137           H3       NAG 137   3.059  -8.826  -8.826
 1005    H4   NAG 137           H4       NAG 137   2.088  -9.615  -9.615
 1006    H5   NAG 137           H5       NAG 137   1.845  -6.892  -6.892
 1007   1H6   NAG 137           H61      NAG 137   2.115  -6.688  -6.688
 1008   2H6   NAG 137           H62      NAG 137   0.434  -6.346  -6.346
 1009   1H8   NAG 137           H81      NAG 137   1.684 -13.583 -13.583
 1010   2H8   NAG 137           H82      NAG 137   0.200 -12.622 -12.622
 1011   3H8   NAG 137           H83      NAG 137   0.771 -12.940 -12.940
 1012    HN2  NAG 137           HN2      NAG 137   0.926  -9.819  -9.819
 1013    HO3  NAG 137           HO3      NAG 137   4.159 -10.603 -10.603
 1014    HO6  NAG 137           HO6      NAG 137  -0.075  -8.533  -8.533
 1015    H1   FUC 138           H1       FUC 138  -2.845  -5.232  -5.232
 1016    H2   FUC 138           H2       FUC 138  -3.240  -2.377  -2.377
 1017    H3   FUC 138           H3       FUC 138  -1.906  -2.463  -2.463
 1018    H4   FUC 138           H4       FUC 138  -0.115  -1.164  -1.164
 1019    H5   FUC 138           H5       FUC 138   0.240  -3.760  -3.760
 1020   1H6   FUC 138           H61      FUC 138   1.692  -2.425  -2.425
 1021   2H6   FUC 138           H62      FUC 138   0.365  -2.244  -2.244
 1022   3H6   FUC 138           H63      FUC 138   1.072  -3.859  -3.859
 1023    HO2  FUC 138           HO2      FUC 138  -4.780  -2.652  -2.652
 1024    HO3  FUC 138           HO3      FUC 138  -3.565  -0.998  -0.998
 1025    HO4  FUC 138           HO4      FUC 138  -1.764  -1.587  -1.587
 1026    H1   MAN 139           H1       MAN 139   4.215 -10.324 -10.324
 1027    H2   MAN 139           H2       MAN 139   4.344  -9.078  -9.078
 1028    H3   MAN 139           H3       MAN 139   5.906 -10.919 -10.919
 1029    H4   MAN 139           H4       MAN 139   7.898  -8.954  -8.954
 1030    H5   MAN 139           H5       MAN 139   6.369 -11.253 -11.253
 1031   1H6   MAN 139           H61      MAN 139   7.393 -10.613 -10.613
 1032   2H6   MAN 139           H62      MAN 139   8.694 -10.740 -10.740
 1033    HO2  MAN 139           HO2      MAN 139   4.900  -7.033  -7.033
 1034    HO3  MAN 139           HO3      MAN 139   6.952 -10.209 -10.209
 1035    HO4  MAN 139           HO4      MAN 139   9.165 -10.482 -10.482
 1036    HO6  MAN 139           HO6      MAN 139   8.993  -8.605  -8.605

  Start of MODEL    4
    1   1H    ALA   1           HT3      ALA   1  -5.114   9.748   9.748
    2   2H    ALA   1           HT2      ALA   1  -4.578  10.396  10.396
    3   3H    ALA   1           HT1      ALA   1  -3.492  10.206  10.206
    4    HA   ALA   1           HA       ALA   1  -3.476   7.870   7.870
    5   1HB   ALA   1           HB1      ALA   1  -2.180   9.199   9.199
    6   2HB   ALA   1           HB3      ALA   1  -3.564   9.178   9.178
    7   3HB   ALA   1           HB2      ALA   1  -2.729   7.675   7.675
    8    H    MET   1           HN       MET   1  -4.201   6.231   6.231
    9    HA   MET   1           HA       MET   1  -5.974   4.850   4.850
   10   1HB   MET   1           HB2      MET   1  -7.205   7.619   7.619
   11   2HB   MET   1           HB1      MET   1  -7.881   6.177   6.177
   12   1HG   MET   1           HG2      MET   1  -5.853   5.875   5.875
   13   2HG   MET   1           HG1      MET   1  -5.091   7.244   7.244
   14   1HE   MET   1           HE1      MET   1  -7.605   5.884   5.884
   15   2HE   MET   1           HE3      MET   1  -8.535   7.260   7.260
   16   3HE   MET   1           HE2      MET   1  -8.795   6.672   6.672
   17    H    HIS   2           HN       HIS   2  -5.819   5.725   5.725
   18    HA   HIS   2           HA       HIS   2  -8.621   4.943   4.943
   19   1HB   HIS   2           HB2      HIS   2  -6.775   7.012   7.012
   20   2HB   HIS   2           HB1      HIS   2  -8.263   6.467   6.467
   21    HD1  HIS   2           HD1      HIS   2  -7.752   9.415   9.415
   22    HD2  HIS   2           HD2      HIS   2  -9.914   6.413   6.413
   23    HE1  HIS   2           HE1      HIS   2  -9.319  10.581  10.581
   24    H    VAL   3           HN       VAL   3  -6.311   3.226   3.226
   25    HA   VAL   3           HA       VAL   3  -5.222   2.602   2.602
   26    HB   VAL   3           HB       VAL   3  -5.181   1.151   1.151
   27   1HG1  VAL   3          HG12      VAL   3  -3.896   0.623   0.623
   28   2HG1  VAL   3          HG11      VAL   3  -2.960   0.296   0.296
   29   3HG1  VAL   3          HG13      VAL   3  -4.502  -0.521  -0.521
   30   1HG2  VAL   3          HG23      VAL   3  -4.171   3.521   3.521
   31   2HG2  VAL   3          HG22      VAL   3  -3.124   2.254   2.254
   32   3HG2  VAL   3          HG21      VAL   3  -2.961   2.768   2.768
   33    H    ALA   4           HN       ALA   4  -5.986   1.037   1.037
   34    HA   ALA   4           HA       ALA   4  -8.386  -0.552  -0.552
   35   1HB   ALA   4           HB3      ALA   4  -7.833   1.257   1.257
   36   2HB   ALA   4           HB2      ALA   4  -8.513  -0.290  -0.290
   37   3HB   ALA   4           HB1      ALA   4  -9.382   0.716   0.716
   38    H    GLN   5           HN       GLN   5  -8.275  -2.754  -2.754
   39    HA   GLN   5           HA       GLN   5  -6.270  -3.841  -3.841
   40   1HB   GLN   5           HB2      GLN   5  -6.424  -4.379  -4.379
   41   2HB   GLN   5           HB1      GLN   5  -5.528  -5.407  -5.407
   42   1HG   GLN   5           HG2      GLN   5  -4.368  -3.203  -3.203
   43   2HG   GLN   5           HG1      GLN   5  -4.987  -2.554  -2.554
   44   1HE2  GLN   5          HE22      GLN   5  -1.841  -5.097  -5.097
   45   2HE2  GLN   5          HE21      GLN   5  -2.542  -4.576  -4.576
   46    HA   PRO   6           HA       PRO   6  -9.508  -6.879  -6.879
   47   1HB   PRO   6           HB2      PRO   6  -8.037  -8.913  -8.913
   48   2HB   PRO   6           HB1      PRO   6  -8.515  -7.475  -7.475
   49   1HG   PRO   6           HG2      PRO   6  -5.903  -8.125  -8.125
   50   2HG   PRO   6           HG1      PRO   6  -6.243  -7.329  -7.329
   51   1HD   PRO   6           HD2      PRO   6  -5.502  -5.985  -5.985
   52   2HD   PRO   6           HD1      PRO   6  -6.511  -5.274  -5.274
   53    H    ALA   7           HN       ALA   7 -10.292  -8.495  -8.495
   54    HA   ALA   7           HA       ALA   7  -8.827  -9.070  -9.070
   55   1HB   ALA   7           HB3      ALA   7 -11.349 -10.104 -10.104
   56   2HB   ALA   7           HB2      ALA   7 -10.788 -10.760 -10.760
   57   3HB   ALA   7           HB1      ALA   7 -11.204  -9.051  -9.051
   58    H    VAL   8           HN       VAL   8  -9.069 -10.777 -10.777
   59    HA   VAL   8           HA       VAL   8  -6.973 -12.567 -12.567
   60    HB   VAL   8           HB       VAL   8  -9.346 -13.388 -13.388
   61   1HG1  VAL   8          HG12      VAL   8  -9.607 -13.276 -13.276
   62   2HG1  VAL   8          HG11      VAL   8  -9.797 -14.946 -14.946
   63   3HG1  VAL   8          HG13      VAL   8 -10.823 -13.657 -13.657
   64   1HG2  VAL   8          HG23      VAL   8  -6.991 -14.670 -14.670
   65   2HG2  VAL   8          HG22      VAL   8  -8.435 -15.418 -15.418
   66   3HG2  VAL   8          HG21      VAL   8  -8.055 -15.546 -15.546
   67    H    VAL   9           HN       VAL   9  -6.311 -14.073 -14.073
   68    HA   VAL   9           HA       VAL   9  -6.833 -13.107 -13.107
   69    HB   VAL   9           HB       VAL   9  -4.283 -12.812 -12.812
   70   1HG1  VAL   9          HG11      VAL   9  -4.527 -13.045 -13.045
   71   2HG1  VAL   9          HG13      VAL   9  -3.136 -12.319 -12.319
   72   3HG1  VAL   9          HG12      VAL   9  -3.515 -14.024 -14.024
   73   1HG2  VAL   9          HG23      VAL   9  -6.222 -11.118 -11.118
   74   2HG2  VAL   9          HG22      VAL   9  -5.183 -10.729 -10.729
   75   3HG2  VAL   9          HG21      VAL   9  -4.534 -10.686 -10.686
   76    H    LEU  10           HN       LEU  10  -6.079 -14.628 -14.628
   77    HA   LEU  10           HA       LEU  10  -5.618 -17.376 -17.376
   78   1HB   LEU  10           HB2      LEU  10  -6.863 -16.420 -16.420
   79   2HB   LEU  10           HB1      LEU  10  -6.729 -18.105 -18.105
   80    HG   LEU  10           HG       LEU  10  -8.225 -15.950 -15.950
   81   1HD1  LEU  10          HD12      LEU  10  -9.201 -18.208 -18.208
   82   2HD1  LEU  10          HD11      LEU  10 -10.242 -17.241 -17.241
   83   3HD1  LEU  10          HD13      LEU  10  -9.387 -16.480 -16.480
   84   1HD2  LEU  10          HD23      LEU  10  -7.631 -18.854 -18.854
   85   2HD2  LEU  10          HD22      LEU  10  -7.650 -17.513 -17.513
   86   3HD2  LEU  10          HD21      LEU  10  -9.167 -18.192 -18.192
   87    H    ALA  11           HN       ALA  11  -3.716 -18.374 -18.374
   88    HA   ALA  11           HA       ALA  11  -1.893 -16.947 -16.947
   89   1HB   ALA  11           HB3      ALA  11  -1.189 -17.551 -17.551
   90   2HB   ALA  11           HB2      ALA  11  -1.463 -19.253 -19.253
   91   3HB   ALA  11           HB1      ALA  11  -0.194 -18.357 -18.357
   92    H    SER  12           HN       SER  12  -1.308 -17.821 -17.821
   93    HA   SER  12           HA       SER  12  -2.788 -20.032 -20.032
   94   1HB   SER  12           HB2      SER  12  -1.441 -19.536 -19.536
   95   2HB   SER  12           HB1      SER  12  -1.830 -18.007 -18.007
   96    HG   SER  12           HG       SER  12   0.220 -17.718 -17.718
   97    H    SER  13           HN       SER  13  -1.488 -21.875 -21.875
   98    HA   SER  13           HA       SER  13  -0.271 -23.553 -23.553
   99   1HB   SER  13           HB2      SER  13   0.242 -24.958 -24.958
  100   2HB   SER  13           HB1      SER  13  -1.366 -24.258 -24.258
  101    HG   SER  13           HG       SER  13   0.276 -24.137 -24.137
  102    H    ARG  14           HN       ARG  14   1.111 -21.206 -21.206
  103    HA   ARG  14           HA       ARG  14   3.859 -21.966 -21.966
  104   1HB   ARG  14           HB2      ARG  14   2.813 -20.312 -20.312
  105   2HB   ARG  14           HB1      ARG  14   2.620 -19.203 -19.203
  106   1HG   ARG  14           HG2      ARG  14   4.644 -18.528 -18.528
  107   2HG   ARG  14           HG1      ARG  14   5.151 -19.465 -19.465
  108   1HD   ARG  14           HD2      ARG  14   4.726 -20.974 -20.974
  109   2HD   ARG  14           HD1      ARG  14   6.176 -19.958 -19.958
  110    HE   ARG  14           HE       ARG  14   5.784 -21.492 -21.492
  111   1HH1  ARG  14          HH21      ARG  14   6.946 -21.719 -21.719
  112   2HH1  ARG  14          HH22      ARG  14   8.020 -23.024 -23.024
  113   1HH2  ARG  14          HH11      ARG  14   7.186 -23.180 -23.180
  114   2HH2  ARG  14          HH12      ARG  14   8.156 -23.844 -23.844
  115    H    GLY  15           HN       GLY  15   1.819 -20.205 -20.205
  116   1HA   GLY  15           HA2      GLY  15   2.332 -20.115 -20.115
  117   2HA   GLY  15           HA1      GLY  15   4.046 -20.234 -20.234
  118    H    ILE  16           HN       ILE  16   1.967 -18.093 -18.093
  119    HA   ILE  16           HA       ILE  16   3.357 -15.790 -15.790
  120    HB   ILE  16           HB       ILE  16   2.402 -16.433 -16.433
  121   1HG1  ILE  16          HG12      ILE  16   4.697 -15.572 -15.572
  122   2HG1  ILE  16          HG11      ILE  16   4.948 -15.328 -15.328
  123   1HG2  ILE  16          HG21      ILE  16   2.766 -13.687 -13.687
  124   2HG2  ILE  16          HG23      ILE  16   3.112 -13.973 -13.973
  125   3HG2  ILE  16          HG22      ILE  16   1.490 -14.258 -14.258
  126   1HD1  ILE  16          HD12      ILE  16   4.081 -18.038 -18.038
  127   2HD1  ILE  16          HD11      ILE  16   5.756 -17.544 -17.544
  128   3HD1  ILE  16          HD13      ILE  16   5.108 -17.579 -17.579
  129    H    ALA  17           HN       ALA  17   2.096 -14.874 -14.874
  130    HA   ALA  17           HA       ALA  17  -0.840 -14.559 -14.559
  131   1HB   ALA  17           HB2      ALA  17  -0.182 -15.832 -15.832
  132   2HB   ALA  17           HB1      ALA  17   0.776 -14.455 -14.455
  133   3HB   ALA  17           HB3      ALA  17  -0.979 -14.320 -14.320
  134    H    SER  18           HN       SER  18  -1.503 -12.462 -12.462
  135    HA   SER  18           HA       SER  18   0.356 -10.245 -10.245
  136   1HB   SER  18           HB2      SER  18   0.404 -10.830 -10.830
  137   2HB   SER  18           HB1      SER  18  -1.330 -10.540 -10.540
  138    HG   SER  18           HG       SER  18   0.768  -8.772  -8.772
  139    H    PHE  19           HN       PHE  19  -0.556  -8.569  -8.569
  140    HA   PHE  19           HA       PHE  19  -3.500  -8.130  -8.130
  141   1HB   PHE  19           HB2      PHE  19  -3.499  -7.888  -7.888
  142   2HB   PHE  19           HB1      PHE  19  -3.094  -9.515  -9.515
  143    HD1  PHE  19           HD1      PHE  19  -1.793  -6.390  -6.390
  144    HD2  PHE  19           HD2      PHE  19  -0.821 -10.412 -10.412
  145    HE1  PHE  19           HE1      PHE  19   0.369  -6.267  -6.267
  146    HE2  PHE  19           HE2      PHE  19   1.342 -10.288 -10.288
  147    HZ   PHE  19           HZ       PHE  19   1.937  -8.218  -8.218
  148    H    VAL  20           HN       VAL  20  -4.043  -5.915  -5.915
  149    HA   VAL  20           HA       VAL  20  -1.723  -4.047  -4.047
  150    HB   VAL  20           HB       VAL  20  -4.582  -3.825  -3.825
  151   1HG1  VAL  20          HG12      VAL  20  -2.248  -1.913  -1.913
  152   2HG1  VAL  20          HG11      VAL  20  -3.772  -1.765  -1.765
  153   3HG1  VAL  20          HG13      VAL  20  -3.747  -1.611  -1.611
  154   1HG2  VAL  20          HG21      VAL  20  -3.155  -5.395  -5.395
  155   2HG2  VAL  20          HG23      VAL  20  -3.594  -3.978  -3.978
  156   3HG2  VAL  20          HG22      VAL  20  -1.983  -4.101  -4.101
  157    H    CYS  21           HN       CYS  21  -1.381  -2.778  -2.778
  158    HA   CYS  21           HA       CYS  21  -3.596  -2.419  -2.419
  159   1HB   CYS  21           HB2      CYS  21  -1.404  -3.327  -3.327
  160   2HB   CYS  21           HB1      CYS  21  -0.613  -1.866  -1.866
  161    H    GLU  22           HN       GLU  22  -4.718  -0.541  -0.541
  162    HA   GLU  22           HA       GLU  22  -3.494   1.709   1.709
  163   1HB   GLU  22           HB2      GLU  22  -5.693   0.869   0.869
  164   2HB   GLU  22           HB1      GLU  22  -6.256   1.164   1.164
  165   1HG   GLU  22           HG2      GLU  22  -5.905   3.571   3.571
  166   2HG   GLU  22           HG1      GLU  22  -5.257   3.301   3.301
  167    H    TYR  23           HN       TYR  23  -2.905   3.620   3.620
  168    HA   TYR  23           HA       TYR  23  -3.437   4.069   4.069
  169   1HB   TYR  23           HB2      TYR  23  -1.093   4.689   4.689
  170   2HB   TYR  23           HB1      TYR  23  -1.154   3.120   3.120
  171    HD1  TYR  23           HD1      TYR  23  -0.897   3.004   3.004
  172    HD2  TYR  23           HD2      TYR  23  -0.085   6.592   6.592
  173    HE1  TYR  23           HE1      TYR  23   0.403   3.936   3.936
  174    HE2  TYR  23           HE2      TYR  23   1.208   7.523   7.523
  175    HH   TYR  23           HH       TYR  23   1.179   7.114   7.114
  176    H    ALA  24           HN       ALA  24  -2.647   6.505   6.505
  177    HA   ALA  24           HA       ALA  24  -3.483   8.252   8.252
  178   1HB   ALA  24           HB3      ALA  24  -4.617   8.067   8.067
  179   2HB   ALA  24           HB2      ALA  24  -4.846   9.501   9.501
  180   3HB   ALA  24           HB1      ALA  24  -5.479   7.943   7.943
  181    H    SER  25           HN       SER  25  -1.952   9.818   9.818
  182    HA   SER  25           HA       SER  25  -0.564  10.893  10.893
  183   1HB   SER  25           HB2      SER  25   1.532  10.811  10.811
  184   2HB   SER  25           HB1      SER  25   0.815   9.206   9.206
  185    HG   SER  25           HG       SER  25   1.301  10.761  10.761
  186    HA   PRO  26           HA       PRO  26  -1.725  14.708  14.708
  187   1HB   PRO  26           HB2      PRO  26  -0.149  16.441  16.441
  188   2HB   PRO  26           HB1      PRO  26  -1.613  15.700  15.700
  189   1HG   PRO  26           HG2      PRO  26   1.238  15.001  15.001
  190   2HG   PRO  26           HG1      PRO  26  -0.124  14.959  14.959
  191   1HD   PRO  26           HD2      PRO  26   0.933  12.747  12.747
  192   2HD   PRO  26           HD1      PRO  26  -0.724  12.850  12.850
  193    H    GLY  27           HN       GLY  27  -0.934  15.986  15.986
  194   1HA   GLY  27           HA2      GLY  27   0.519  16.666  16.666
  195   2HA   GLY  27           HA1      GLY  27   1.781  16.666  16.666
  196    H    LYS  28           HN       LYS  28   3.289  15.816  15.816
  197    HA   LYS  28           HA       LYS  28   2.937  12.883  12.883
  198   1HB   LYS  28           HB2      LYS  28   4.084  15.070  15.070
  199   2HB   LYS  28           HB1      LYS  28   4.126  13.350  13.350
  200   1HG   LYS  28           HG2      LYS  28   1.667  13.263  13.263
  201   2HG   LYS  28           HG1      LYS  28   1.611  14.977  14.977
  202   1HD   LYS  28           HD2      LYS  28   2.797  15.494  15.494
  203   2HD   LYS  28           HD1      LYS  28   2.727  13.782  13.782
  204   1HE   LYS  28           HE2      LYS  28   0.278  13.834  13.834
  205   2HE   LYS  28           HE1      LYS  28   0.300  15.530  15.530
  206   1HZ   LYS  28           HZ2      LYS  28   1.614  16.062  16.062
  207   2HZ   LYS  28           HZ1      LYS  28   1.474  14.452  14.452
  208   3HZ   LYS  28           HZ3      LYS  28   0.091  15.428  15.428
  209    H    ALA  29           HN       ALA  29   4.897  11.656  11.656
  210    HA   ALA  29           HA       ALA  29   7.406  13.070  13.070
  211   1HB   ALA  29           HB1      ALA  29   5.759  11.274  11.274
  212   2HB   ALA  29           HB3      ALA  29   7.480  11.532  11.532
  213   3HB   ALA  29           HB2      ALA  29   6.363  12.895  12.895
  214    H    THR  30           HN       THR  30   9.271  11.658  11.658
  215    HA   THR  30           HA       THR  30   8.872   9.339   9.339
  216    HB   THR  30           HB       THR  30  11.296   9.479   9.479
  217    HG1  THR  30           HG1      THR  30  12.485  10.817  10.817
  218   1HG2  THR  30          HG21      THR  30   9.604  11.400  11.400
  219   2HG2  THR  30          HG23      THR  30  10.714  12.356  12.356
  220   3HG2  THR  30          HG22      THR  30  11.332  11.389  11.389
  221    H    GLU  31           HN       GLU  31   8.651   9.562   9.562
  222    HA   GLU  31           HA       GLU  31  10.213   7.030   7.030
  223   1HB   GLU  31           HB2      GLU  31   9.918   9.413   9.413
  224   2HB   GLU  31           HB1      GLU  31  10.825   7.953   7.953
  225   1HG   GLU  31           HG2      GLU  31  11.480   9.522   9.522
  226   2HG   GLU  31           HG1      GLU  31  12.090  10.052  10.052
  227    H    VAL  32           HN       VAL  32   8.108   5.843   5.843
  228    HA   VAL  32           HA       VAL  32   6.363   6.217   6.217
  229    HB   VAL  32           HB       VAL  32   4.822   4.667   4.667
  230   1HG1  VAL  32          HG13      VAL  32   5.176   7.386   7.386
  231   2HG1  VAL  32          HG12      VAL  32   5.203   6.928   6.928
  232   3HG1  VAL  32          HG11      VAL  32   3.812   6.510   6.510
  233   1HG2  VAL  32          HG21      VAL  32   7.047   4.173   4.173
  234   2HG2  VAL  32          HG23      VAL  32   5.393   3.819   3.819
  235   3HG2  VAL  32          HG22      VAL  32   6.168   5.319   5.319
  236    H    ARG  33           HN       ARG  33   7.811   5.222   5.222
  237    HA   ARG  33           HA       ARG  33   9.265   2.832   2.832
  238   1HB   ARG  33           HB2      ARG  33   9.307   4.514   4.514
  239   2HB   ARG  33           HB1      ARG  33   7.815   3.792   3.792
  240   1HG   ARG  33           HG2      ARG  33   9.325   2.550   2.550
  241   2HG   ARG  33           HG1      ARG  33   9.258   1.550   1.550
  242   1HD   ARG  33           HD2      ARG  33  11.270   2.610   2.610
  243   2HD   ARG  33           HD1      ARG  33  11.303   3.748   3.748
  244    HE   ARG  33           HE       ARG  33  12.092   2.009   2.009
  245   1HH1  ARG  33          HH21      ARG  33  10.852   0.689   0.689
  246   2HH1  ARG  33          HH22      ARG  33  11.453  -0.896  -0.896
  247   1HH2  ARG  33          HH11      ARG  33  12.848  -0.057  -0.057
  248   2HH2  ARG  33          HH12      ARG  33  12.570  -1.317  -1.317
  249    H    VAL  34           HN       VAL  34   8.221   1.064   1.064
  250    HA   VAL  34           HA       VAL  34   5.693   0.136   0.136
  251    HB   VAL  34           HB       VAL  34   5.374  -1.082  -1.082
  252   1HG1  VAL  34          HG12      VAL  34   5.500   1.832   1.832
  253   2HG1  VAL  34          HG11      VAL  34   5.543   1.327   1.327
  254   3HG1  VAL  34          HG13      VAL  34   4.206   0.830   0.830
  255   1HG2  VAL  34          HG22      VAL  34   7.833  -1.249  -1.249
  256   2HG2  VAL  34          HG21      VAL  34   6.842  -0.668  -0.668
  257   3HG2  VAL  34          HG23      VAL  34   7.807   0.468   0.468
  258    H    THR  35           HN       THR  35   5.695  -1.733  -1.733
  259    HA   THR  35           HA       THR  35   7.889  -3.710  -3.710
  260    HB   THR  35           HB       THR  35   6.892  -2.650  -2.650
  261    HG1  THR  35           HG1      THR  35   8.859  -1.711  -1.711
  262   1HG2  THR  35          HG22      THR  35   8.393  -5.071  -5.071
  263   2HG2  THR  35          HG21      THR  35   9.139  -4.119  -4.119
  264   3HG2  THR  35          HG23      THR  35   7.493  -4.722  -4.722
  265    H    VAL  36           HN       VAL  36   7.237  -5.861  -5.861
  266    HA   VAL  36           HA       VAL  36   4.301  -6.304  -6.304
  267    HB   VAL  36           HB       VAL  36   6.407  -7.797  -7.797
  268   1HG1  VAL  36          HG13      VAL  36   3.440  -8.334  -8.334
  269   2HG1  VAL  36          HG12      VAL  36   4.479  -9.142  -9.142
  270   3HG1  VAL  36          HG11      VAL  36   4.759  -9.367  -9.367
  271   1HG2  VAL  36          HG23      VAL  36   5.079  -5.485  -5.485
  272   2HG2  VAL  36          HG22      VAL  36   5.678  -6.661  -6.661
  273   3HG2  VAL  36          HG21      VAL  36   3.994  -6.712  -6.712
  274    H    LEU  37           HN       LEU  37   3.774  -7.710  -7.710
  275    HA   LEU  37           HA       LEU  37   6.172  -9.060  -9.060
  276   1HB   LEU  37           HB2      LEU  37   3.663  -7.906  -7.906
  277   2HB   LEU  37           HB1      LEU  37   4.988  -8.651  -8.651
  278    HG   LEU  37           HG       LEU  37   5.568  -6.368  -6.368
  279   1HD1  LEU  37          HD12      LEU  37   3.604  -6.026  -6.026
  280   2HD1  LEU  37          HD11      LEU  37   5.016  -5.745  -5.745
  281   3HD1  LEU  37          HD13      LEU  37   4.763  -4.755  -4.755
  282   1HD2  LEU  37          HD21      LEU  37   6.861  -7.874  -7.874
  283   2HD2  LEU  37          HD23      LEU  37   7.587  -6.976  -6.976
  284   3HD2  LEU  37          HD22      LEU  37   7.060  -6.122  -6.122
  285    H    ARG  38           HN       ARG  38   5.504 -10.907 -10.907
  286    HA   ARG  38           HA       ARG  38   3.214 -12.439 -12.439
  287   1HB   ARG  38           HB2      ARG  38   5.482 -13.217 -13.217
  288   2HB   ARG  38           HB1      ARG  38   5.898 -13.439 -13.439
  289   1HG   ARG  38           HG2      ARG  38   4.000 -15.040 -15.040
  290   2HG   ARG  38           HG1      ARG  38   3.691 -14.871 -14.871
  291   1HD   ARG  38           HD2      ARG  38   5.915 -15.752 -15.752
  292   2HD   ARG  38           HD1      ARG  38   6.310 -15.842 -15.842
  293    HE   ARG  38           HE       ARG  38   3.830 -17.229 -17.229
  294   1HH1  ARG  38          HH21      ARG  38   7.310 -17.511 -17.511
  295   2HH1  ARG  38          HH22      ARG  38   7.258 -19.228 -19.228
  296   1HH2  ARG  38          HH11      ARG  38   3.811 -19.450 -19.450
  297   2HH2  ARG  38          HH12      ARG  38   5.300 -20.315 -20.315
  298    H    GLN  39           HN       GLN  39   1.663 -12.743 -12.743
  299    HA   GLN  39           HA       GLN  39   2.412 -12.584 -12.584
  300   1HB   GLN  39           HB2      GLN  39   0.588 -11.226 -11.226
  301   2HB   GLN  39           HB1      GLN  39  -0.257 -12.718 -12.718
  302   1HG   GLN  39           HG2      GLN  39  -0.437 -13.266 -13.266
  303   2HG   GLN  39           HG1      GLN  39   0.506 -11.836 -11.836
  304   1HE2  GLN  39          HE22      GLN  39  -2.234  -9.659  -9.659
  305   2HE2  GLN  39          HE21      GLN  39  -0.577  -9.849  -9.849
  306    H    ALA  40           HN       ALA  40   1.917 -14.258 -14.258
  307    HA   ALA  40           HA       ALA  40   1.114 -16.881 -16.881
  308   1HB   ALA  40           HB2      ALA  40   3.625 -16.305 -16.305
  309   2HB   ALA  40           HB1      ALA  40   3.032 -16.716 -16.716
  310   3HB   ALA  40           HB3      ALA  40   2.948 -17.904 -17.904
  311    H    ASP  41           HN       ASP  41   0.784 -18.437 -18.437
  312    HA   ASP  41           HA       ASP  41  -1.617 -17.605 -17.605
  313   1HB   ASP  41           HB2      ASP  41   0.436 -19.704 -19.704
  314   2HB   ASP  41           HB1      ASP  41  -1.075 -19.595 -19.595
  315    H    SER  42           HN       SER  42   1.743 -17.521 -17.521
  316    HA   SER  42           HA       SER  42   0.720 -15.849 -15.849
  317   1HB   SER  42           HB2      SER  42   2.873 -17.975 -17.975
  318   2HB   SER  42           HB1      SER  42   2.541 -16.961 -16.961
  319    HG   SER  42           HG       SER  42   1.105 -19.071 -19.071
  320    H    GLN  43           HN       GLN  43   3.182 -16.183 -16.183
  321    HA   GLN  43           HA       GLN  43   4.399 -13.618 -13.618
  322   1HB   GLN  43           HB2      GLN  43   5.725 -16.128 -16.128
  323   2HB   GLN  43           HB1      GLN  43   6.579 -14.609 -14.609
  324   1HG   GLN  43           HG2      GLN  43   5.981 -14.656 -14.656
  325   2HG   GLN  43           HG1      GLN  43   5.024 -16.118 -16.118
  326   1HE2  GLN  43          HE22      GLN  43   8.530 -16.979 -16.979
  327   2HE2  GLN  43          HE21      GLN  43   7.364 -15.898 -15.898
  328    H    VAL  44           HN       VAL  44   5.562 -12.424 -12.424
  329    HA   VAL  44           HA       VAL  44   4.592 -13.007 -13.007
  330    HB   VAL  44           HB       VAL  44   4.590 -10.340 -10.340
  331   1HG1  VAL  44          HG13      VAL  44   4.875 -10.703 -10.703
  332   2HG1  VAL  44          HG12      VAL  44   3.116 -10.710 -10.710
  333   3HG1  VAL  44          HG11      VAL  44   4.039  -9.323  -9.323
  334   1HG2  VAL  44          HG21      VAL  44   2.485 -12.405 -12.405
  335   2HG2  VAL  44          HG23      VAL  44   2.728 -11.418 -11.418
  336   3HG2  VAL  44          HG22      VAL  44   2.026 -10.702 -10.702
  337    H    THR  45           HN       THR  45   6.141 -12.488 -12.488
  338    HA   THR  45           HA       THR  45   8.720 -11.282 -11.282
  339    HB   THR  45           HB       THR  45   9.850 -12.976 -12.976
  340    HG1  THR  45           HG1      THR  45   7.216 -13.957 -13.957
  341   1HG2  THR  45          HG23      THR  45   9.339 -13.464 -13.464
  342   2HG2  THR  45          HG22      THR  45   7.835 -14.233 -14.233
  343   3HG2  THR  45          HG21      THR  45   9.385 -14.919 -14.919
  344    H    GLU  46           HN       GLU  46   9.990 -10.274 -10.274
  345    HA   GLU  46           HA       GLU  46   8.299  -8.845  -8.845
  346   1HB   GLU  46           HB2      GLU  46  10.250  -7.909  -7.909
  347   2HB   GLU  46           HB1      GLU  46  11.310  -8.876  -8.876
  348   1HG   GLU  46           HG2      GLU  46  10.186  -7.721  -7.721
  349   2HG   GLU  46           HG1      GLU  46   9.507  -6.597  -6.597
  350    H    VAL  47           HN       VAL  47   8.687  -8.858  -8.858
  351    HA   VAL  47           HA       VAL  47   9.857 -11.429 -11.429
  352    HB   VAL  47           HB       VAL  47   7.373  -9.896  -9.896
  353   1HG1  VAL  47          HG11      VAL  47   8.895 -12.098 -12.098
  354   2HG1  VAL  47          HG13      VAL  47   7.135 -12.233 -12.233
  355   3HG1  VAL  47          HG12      VAL  47   7.907 -10.831 -10.831
  356   1HG2  VAL  47          HG23      VAL  47   7.928 -12.332 -12.332
  357   2HG2  VAL  47          HG22      VAL  47   6.721 -11.069 -11.069
  358   3HG2  VAL  47          HG21      VAL  47   6.466 -12.307 -12.307
  359    H    CYS  48           HN       CYS  48   8.671  -8.325  -8.325
  360    HA   CYS  48           HA       CYS  48  11.352  -7.941  -7.941
  361   1HB   CYS  48           HB2      CYS  48   8.645  -8.107  -8.107
  362   2HB   CYS  48           HB1      CYS  48  10.048  -7.382  -7.382
  363    H    ALA  49           HN       ALA  49  11.943  -5.765  -5.765
  364    HA   ALA  49           HA       ALA  49   9.872  -3.687  -3.687
  365   1HB   ALA  49           HB2      ALA  49  11.559  -4.858  -4.858
  366   2HB   ALA  49           HB1      ALA  49  12.057  -3.180  -3.180
  367   3HB   ALA  49           HB3      ALA  49  10.386  -3.556  -3.556
  368    H    ALA  50           HN       ALA  50  10.352  -1.827  -1.827
  369    HA   ALA  50           HA       ALA  50  13.020  -0.802  -0.802
  370   1HB   ALA  50           HB3      ALA  50  12.577  -2.875  -2.875
  371   2HB   ALA  50           HB2      ALA  50  11.661  -1.693  -1.693
  372   3HB   ALA  50           HB1      ALA  50  13.378  -1.436  -1.436
  373    H    THR  51           HN       THR  51  12.864   1.381   1.381
  374    HA   THR  51           HA       THR  51  10.176   2.550   2.550
  375    HB   THR  51           HB       THR  51  12.661   3.974   3.974
  376    HG1  THR  51           HG1      THR  51  13.598   3.569   3.569
  377   1HG2  THR  51          HG21      THR  51  10.219   4.667   4.667
  378   2HG2  THR  51          HG23      THR  51  11.623   5.729   5.729
  379   3HG2  THR  51          HG22      THR  51  10.711   5.329   5.329
  380    H    TYR  52           HN       TYR  52   8.827   2.259   2.259
  381    HA   TYR  52           HA       TYR  52   9.863   1.835   1.835
  382   1HB   TYR  52           HB2      TYR  52   7.700   0.953   0.953
  383   2HB   TYR  52           HB1      TYR  52   7.061   2.593   2.593
  384    HD1  TYR  52           HD2      TYR  52   7.082   3.737   3.737
  385    HD2  TYR  52           HD1      TYR  52   7.757  -0.502  -0.502
  386    HE1  TYR  52           HE2      TYR  52   6.589   3.295   3.295
  387    HE2  TYR  52           HE1      TYR  52   7.268  -0.938  -0.938
  388    HH   TYR  52           HH       TYR  52   7.264   0.268   0.268
  389    H    MET  53           HN       MET  53  10.771   3.513   3.513
  390    HA   MET  53           HA       MET  53   9.928   6.283   6.283
  391   1HB   MET  53           HB2      MET  53  11.743   5.105   5.105
  392   2HB   MET  53           HB1      MET  53  11.684   6.793   6.793
  393   1HG   MET  53           HG2      MET  53  12.137   5.516   5.516
  394   2HG   MET  53           HG1      MET  53  13.059   4.522   4.522
  395   1HE   MET  53           HE3      MET  53  12.697   7.146   7.146
  396   2HE   MET  53           HE2      MET  53  14.067   8.250   8.250
  397   3HE   MET  53           HE1      MET  53  12.598   8.544   8.544
  398    H    MET  54           HN       MET  54   9.065   7.577   7.577
  399    HA   MET  54           HA       MET  54   6.842   6.288   6.288
  400   1HB   MET  54           HB2      MET  54   8.355   8.821   8.821
  401   2HB   MET  54           HB1      MET  54   6.764   8.405   8.405
  402   1HG   MET  54           HG2      MET  54   7.461   8.761   8.761
  403   2HG   MET  54           HG1      MET  54   6.534   9.891   9.891
  404   1HE   MET  54           HE3      MET  54   7.026   7.019   7.019
  405   2HE   MET  54           HE2      MET  54   5.453   6.835   6.835
  406   3HE   MET  54           HE1      MET  54   5.911   5.758   5.758
  407    H    GLY  55           HN       GLY  55  10.207   6.460   6.460
  408   1HA   GLY  55           HA2      GLY  55   9.429   4.752   4.752
  409   2HA   GLY  55           HA1      GLY  55  10.187   6.283   6.283
  410    H    ASN  56           HN       ASN  56  11.053   4.047   4.047
  411    HA   ASN  56           HA       ASN  56  13.622   3.493   3.493
  412   1HB   ASN  56           HB2      ASN  56  13.321   4.342   4.342
  413   2HB   ASN  56           HB1      ASN  56  14.831   3.902   3.902
  414   1HD2  ASN  56          HD22      ASN  56  14.132   7.676   7.676
  415   2HD2  ASN  56          HD21      ASN  56  13.936   6.583   6.583
  416    H    GLU  57           HN       GLU  57  14.724   1.536   1.536
  417    HA   GLU  57           HA       GLU  57  12.786  -0.544  -0.544
  418   1HB   GLU  57           HB2      GLU  57  14.415  -0.814  -0.814
  419   2HB   GLU  57           HB1      GLU  57  15.736  -0.659  -0.659
  420   1HG   GLU  57           HG2      GLU  57  15.318  -3.025  -3.025
  421   2HG   GLU  57           HG1      GLU  57  14.836  -2.635  -2.635
  422    H    LEU  58           HN       LEU  58  12.744  -1.465  -1.465
  423    HA   LEU  58           HA       LEU  58  14.637  -0.396  -0.396
  424   1HB   LEU  58           HB2      LEU  58  12.002  -1.888  -1.888
  425   2HB   LEU  58           HB1      LEU  58  12.869  -1.096  -1.096
  426    HG   LEU  58           HG       LEU  58  11.222   0.467   0.467
  427   1HD1  LEU  58          HD12      LEU  58  13.515   1.484   1.484
  428   2HD1  LEU  58          HD11      LEU  58  13.477   1.322   1.322
  429   3HD1  LEU  58          HD13      LEU  58  12.315   2.370   2.370
  430   1HD2  LEU  58          HD22      LEU  58  10.761  -0.899  -0.899
  431   2HD2  LEU  58          HD21      LEU  58  10.233   0.776   0.776
  432   3HD2  LEU  58          HD23      LEU  58  11.712   0.389   0.389
  433    H    THR  59           HN       THR  59  15.603  -1.928  -1.928
  434    HA   THR  59           HA       THR  59  16.112  -4.587  -4.587
  435    HB   THR  59           HB       THR  59  18.037  -4.432  -4.432
  436    HG1  THR  59           HG1      THR  59  17.744  -3.117  -3.117
  437   1HG2  THR  59          HG21      THR  59  17.526  -2.184  -2.184
  438   2HG2  THR  59          HG23      THR  59  19.084  -2.401  -2.401
  439   3HG2  THR  59          HG22      THR  59  18.459  -3.655  -3.655
  440    H    PHE  60           HN       PHE  60  15.093  -6.319  -6.319
  441    HA   PHE  60           HA       PHE  60  14.164  -6.214  -6.214
  442   1HB   PHE  60           HB2      PHE  60  13.166  -7.620  -7.620
  443   2HB   PHE  60           HB1      PHE  60  12.600  -8.052  -8.052
  444    HD1  PHE  60           HD1      PHE  60  12.020  -5.796  -5.796
  445    HD2  PHE  60           HD2      PHE  60  11.770  -6.175  -6.175
  446    HE1  PHE  60           HE1      PHE  60  10.350  -3.934  -3.934
  447    HE2  PHE  60           HE2      PHE  60  10.102  -4.309  -4.309
  448    HZ   PHE  60           HZ       PHE  60   9.396  -3.190  -3.190
  449    H    LEU  61           HN       LEU  61  16.870  -6.982  -6.982
  450    HA   LEU  61           HA       LEU  61  17.329  -9.738  -9.738
  451   1HB   LEU  61           HB2      LEU  61  18.960  -7.887  -7.887
  452   2HB   LEU  61           HB1      LEU  61  19.005  -7.671  -7.671
  453    HG   LEU  61           HG       LEU  61  19.776 -10.031 -10.031
  454   1HD1  LEU  61          HD12      LEU  61  19.806  -9.887  -9.887
  455   2HD1  LEU  61          HD11      LEU  61  20.614 -11.146 -11.146
  456   3HD1  LEU  61          HD13      LEU  61  18.859 -10.990 -10.990
  457   1HD2  LEU  61          HD23      LEU  61  21.401  -8.190  -8.190
  458   2HD2  LEU  61          HD22      LEU  61  21.462  -8.296  -8.296
  459   3HD2  LEU  61          HD21      LEU  61  22.060  -9.631  -9.631
  460    H    ASP  62           HN       ASP  62  17.149  -7.875  -7.875
  461    HA   ASP  62           HA       ASP  62  17.763 -10.107 -10.107
  462   1HB   ASP  62           HB2      ASP  62  16.879  -8.594  -8.594
  463   2HB   ASP  62           HB1      ASP  62  17.947  -7.737  -7.737
  464    H    ASP  63           HN       ASP  63  16.397 -11.539 -11.539
  465    HA   ASP  63           HA       ASP  63  14.513 -12.941 -12.941
  466   1HB   ASP  63           HB2      ASP  63  13.336 -10.167 -10.167
  467   2HB   ASP  63           HB1      ASP  63  12.373 -11.570 -11.570
  468    H    SER  64           HN       SER  64  15.438 -13.257 -13.257
  469    HA   SER  64           HA       SER  64  14.854 -13.956 -13.956
  470   1HB   SER  64           HB2      SER  64  13.128 -15.188 -15.188
  471   2HB   SER  64           HB1      SER  64  12.050 -13.805 -13.805
  472    HG   SER  64           HG       SER  64  12.918 -15.626 -15.626
  473    H    ILE  67           HN       ILE  67  13.740 -13.160 -13.160
  474    HA   ILE  67           HA       ILE  67  13.501 -10.200 -10.200
  475    HB   ILE  67           HB       ILE  67  13.945 -12.205 -12.205
  476   1HG1  ILE  67          HG12      ILE  67  15.765 -10.155 -10.155
  477   2HG1  ILE  67          HG11      ILE  67  15.786 -11.884 -11.884
  478   1HG2  ILE  67          HG23      ILE  67  13.820  -9.171  -9.171
  479   2HG2  ILE  67          HG22      ILE  67  14.540 -10.127 -10.127
  480   3HG2  ILE  67          HG21      ILE  67  12.822 -10.287 -10.287
  481   1HD1  ILE  67          HD13      ILE  67  16.135 -12.232 -12.232
  482   2HD1  ILE  67          HD12      ILE  67  16.464 -10.503 -10.503
  483   3HD1  ILE  67          HD11      ILE  67  17.495 -11.550 -11.550
  484    H    CYS  68           HN       CYS  68  11.671  -9.126  -9.126
  485    HA   CYS  68           HA       CYS  68   9.296 -10.771 -10.771
  486   1HB   CYS  68           HB2      CYS  68   9.587  -8.333  -8.333
  487   2HB   CYS  68           HB1      CYS  68   8.027  -8.905  -8.905
  488    H    THR  69           HN       THR  69   7.885  -9.719  -9.719
  489    HA   THR  69           HA       THR  69   9.052  -7.311  -7.311
  490    HB   THR  69           HB       THR  69   9.669  -9.402  -9.402
  491    HG1  THR  69           HG1      THR  69   7.649  -7.894  -7.894
  492   1HG2  THR  69          HG21      THR  69   6.671  -9.834  -9.834
  493   2HG2  THR  69          HG23      THR  69   7.827 -10.752 -10.752
  494   3HG2  THR  69          HG22      THR  69   7.869 -10.856 -10.856
  495    H    GLY  70           HN       GLY  70   7.464  -5.926  -5.926
  496   1HA   GLY  70           HA2      GLY  70   4.704  -6.563  -6.563
  497   2HA   GLY  70           HA1      GLY  70   4.937  -5.798  -5.798
  498    H    THR  71           HN       THR  71   3.431  -4.260  -4.260
  499    HA   THR  71           HA       THR  71   5.038  -2.155  -2.155
  500    HB   THR  71           HB       THR  71   2.233  -3.122  -3.122
  501    HG1  THR  71           HG1      THR  71   3.043  -4.183  -4.183
  502   1HG2  THR  71          HG22      THR  71   3.768  -0.801  -0.801
  503   2HG2  THR  71          HG21      THR  71   2.498  -1.574  -1.574
  504   3HG2  THR  71          HG23      THR  71   2.113  -0.848  -0.848
  505    H    SER  72           HN       SER  72   3.901   0.020   0.020
  506    HA   SER  72           HA       SER  72   2.000   0.361   0.361
  507   1HB   SER  72           HB2      SER  72   4.889   1.270   1.270
  508   2HB   SER  72           HB1      SER  72   3.633   1.760   1.760
  509    HG   SER  72           HG       SER  72   5.036  -0.570  -0.570
  510    H    SER  73           HN       SER  73   0.718   2.115   2.115
  511    HA   SER  73           HA       SER  73   1.982   4.439   4.439
  512   1HB   SER  73           HB2      SER  73   0.572   4.190   4.190
  513   2HB   SER  73           HB1      SER  73   1.561   2.750   2.750
  514    HG   SER  73           HG       SER  73  -0.238   1.685   1.685
  515    H    GLY  74           HN       GLY  74   0.521   6.278   6.278
  516   1HA   GLY  74           HA2      GLY  74  -1.111   7.665   7.665
  517   2HA   GLY  74           HA1      GLY  74  -2.207   6.313   6.313
  518    H    ASN  75           HN       ASN  75  -3.243   5.773   5.773
  519    HA   ASN  75           HA       ASN  75  -1.814   6.045   6.045
  520   1HB   ASN  75           HB2      ASN  75  -4.746   5.979   5.979
  521   2HB   ASN  75           HB1      ASN  75  -4.162   6.113   6.113
  522   1HD2  ASN  75          HD22      ASN  75  -4.526   9.461   9.461
  523   2HD2  ASN  75          HD21      ASN  75  -5.347   8.013   8.013
  524    H    GLN  76           HN       GLN  76  -2.205   3.646   3.646
  525    HA   GLN  76           HA       GLN  76  -2.956   1.596   1.596
  526   1HB   GLN  76           HB2      GLN  76  -3.314   1.760   1.760
  527   2HB   GLN  76           HB1      GLN  76  -3.553   0.263   0.263
  528   1HG   GLN  76           HG2      GLN  76  -5.219   1.431   1.431
  529   2HG   GLN  76           HG1      GLN  76  -5.036   2.871   2.871
  530   1HE2  GLN  76          HE22      GLN  76  -6.352   0.825   0.825
  531   2HE2  GLN  76          HE21      GLN  76  -4.842   1.523   1.523
  532    H    VAL  77           HN       VAL  77  -1.249   0.289   0.289
  533    HA   VAL  77           HA       VAL  77   1.067   0.143   0.143
  534    HB   VAL  77           HB       VAL  77   2.397  -0.212  -0.212
  535   1HG1  VAL  77          HG11      VAL  77   1.085   2.093   2.093
  536   2HG1  VAL  77          HG13      VAL  77   0.544   1.698   1.698
  537   3HG1  VAL  77          HG12      VAL  77   2.267   1.855   1.855
  538   1HG2  VAL  77          HG23      VAL  77  -0.106  -1.115  -1.115
  539   2HG2  VAL  77          HG22      VAL  77   1.545  -1.656  -1.656
  540   3HG2  VAL  77          HG21      VAL  77   0.951  -0.186  -0.186
  541    H    ASN  78           HN       ASN  78   1.348  -1.734  -1.734
  542    HA   ASN  78           HA       ASN  78  -0.148  -4.156  -4.156
  543   1HB   ASN  78           HB2      ASN  78  -0.370  -3.085  -3.085
  544   2HB   ASN  78           HB1      ASN  78   1.312  -3.521  -3.521
  545    HD2  ASN  78          HD22      ASN  78  -1.716  -4.783  -4.783
  546    H    LEU  79           HN       LEU  79   1.062  -5.592  -5.592
  547    HA   LEU  79           HA       LEU  79   3.977  -5.914  -5.914
  548   1HB   LEU  79           HB2      LEU  79   2.434  -6.319  -6.319
  549   2HB   LEU  79           HB1      LEU  79   4.150  -6.671  -6.671
  550    HG   LEU  79           HG       LEU  79   2.876  -3.953  -3.953
  551   1HD1  LEU  79          HD13      LEU  79   3.225  -5.086  -5.086
  552   2HD1  LEU  79          HD12      LEU  79   4.853  -4.452  -4.452
  553   3HD1  LEU  79          HD11      LEU  79   3.468  -3.362  -3.362
  554   1HD2  LEU  79          HD22      LEU  79   5.669  -5.038  -5.038
  555   2HD2  LEU  79          HD21      LEU  79   4.788  -3.955  -3.955
  556   3HD2  LEU  79          HD23      LEU  79   5.426  -3.351  -3.351
  557    H    THR  80           HN       THR  80   4.566  -7.970  -7.970
  558    HA   THR  80           HA       THR  80   2.556 -10.175 -10.175
  559    HB   THR  80           HB       THR  80   4.383  -9.554  -9.554
  560    HG1  THR  80           HG1      THR  80   2.822  -8.206  -8.206
  561   1HG2  THR  80          HG23      THR  80   2.343 -11.716 -11.716
  562   2HG2  THR  80          HG22      THR  80   2.836 -11.271 -11.271
  563   3HG2  THR  80          HG21      THR  80   4.025 -11.903 -11.903
  564    H    ILE  81           HN       ILE  81   3.388 -12.245 -12.245
  565    HA   ILE  81           HA       ILE  81   6.298 -12.384 -12.384
  566    HB   ILE  81           HB       ILE  81   3.828 -13.867 -13.867
  567   1HG1  ILE  81          HG12      ILE  81   5.618 -12.078 -12.078
  568   2HG1  ILE  81          HG11      ILE  81   4.289 -11.406 -11.406
  569   1HG2  ILE  81          HG22      ILE  81   5.829 -15.320 -15.320
  570   2HG2  ILE  81          HG21      ILE  81   6.709 -14.077 -14.077
  571   3HG2  ILE  81          HG23      ILE  81   5.327 -14.886 -14.886
  572   1HD1  ILE  81          HD13      ILE  81   2.776 -13.119 -13.119
  573   2HD1  ILE  81          HD12      ILE  81   4.119 -13.450 -13.450
  574   3HD1  ILE  81          HD11      ILE  81   3.394 -11.843 -11.843
  575    H    GLN  82           HN       GLN  82   7.522 -13.892 -13.892
  576    HA   GLN  82           HA       GLN  82   6.020 -15.884 -15.884
  577   1HB   GLN  82           HB2      GLN  82   8.763 -14.630 -14.630
  578   2HB   GLN  82           HB1      GLN  82   8.189 -15.969 -15.969
  579   1HG   GLN  82           HG2      GLN  82   6.592 -14.674 -14.674
  580   2HG   GLN  82           HG1      GLN  82   6.520 -13.483 -13.483
  581   1HE2  GLN  82          HE22      GLN  82   9.797 -12.094 -12.094
  582   2HE2  GLN  82          HE21      GLN  82   9.167 -12.736 -12.736
  583    H    GLY  83           HN       GLY  83   6.108 -17.884 -17.884
  584   1HA   GLY  83           HA2      GLY  83   7.494 -19.863 -19.863
  585   2HA   GLY  83           HA1      GLY  83   8.571 -18.790 -18.790
  586    H    LEU  84           HN       LEU  84   5.013 -19.033 -19.033
  587    HA   LEU  84           HA       LEU  84   5.040 -18.997 -18.997
  588   1HB   LEU  84           HB2      LEU  84   2.914 -19.048 -19.048
  589   2HB   LEU  84           HB1      LEU  84   2.534 -19.005 -19.005
  590    HG   LEU  84           HG       LEU  84   4.353 -16.983 -16.983
  591   1HD1  LEU  84          HD13      LEU  84   1.996 -17.009 -17.009
  592   2HD1  LEU  84          HD12      LEU  84   1.423 -16.626 -16.626
  593   3HD1  LEU  84          HD11      LEU  84   2.473 -15.496 -15.496
  594   1HD2  LEU  84          HD23      LEU  84   3.130 -17.412 -17.412
  595   2HD2  LEU  84          HD22      LEU  84   4.730 -16.800 -16.800
  596   3HD2  LEU  84          HD21      LEU  84   3.319 -15.751 -15.751
  597    H    ARG  85           HN       ARG  85   5.033 -20.804 -20.804
  598    HA   ARG  85           HA       ARG  85   4.281 -23.421 -23.421
  599   1HB   ARG  85           HB2      ARG  85   5.933 -22.667 -22.667
  600   2HB   ARG  85           HB1      ARG  85   5.654 -24.319 -24.319
  601   1HG   ARG  85           HG2      ARG  85   6.615 -23.576 -23.576
  602   2HG   ARG  85           HG1      ARG  85   7.158 -22.116 -22.116
  603   1HD   ARG  85           HD2      ARG  85   8.405 -23.521 -23.521
  604   2HD   ARG  85           HD1      ARG  85   7.904 -24.968 -24.968
  605    HE   ARG  85           HE       ARG  85   9.073 -23.023 -23.023
  606   1HH1  ARG  85          HH21      ARG  85   9.892 -25.425 -25.425
  607   2HH1  ARG  85          HH22      ARG  85  11.454 -25.718 -25.718
  608   1HH2  ARG  85          HH11      ARG  85  11.100 -23.435 -23.435
  609   2HH2  ARG  85          HH12      ARG  85  12.132 -24.605 -24.605
  610    H    ALA  86           HN       ALA  86   3.344 -24.955 -24.955
  611    HA   ALA  86           HA       ALA  86   0.829 -23.935 -23.935
  612   1HB   ALA  86           HB2      ALA  86   1.439 -26.326 -26.326
  613   2HB   ALA  86           HB1      ALA  86   2.483 -26.254 -26.254
  614   3HB   ALA  86           HB3      ALA  86   0.738 -26.065 -26.065
  615    H    MET  87           HN       MET  87   3.905 -24.402 -24.402
  616    HA   MET  87           HA       MET  87   3.060 -23.569 -23.569
  617   1HB   MET  87           HB2      MET  87   5.165 -24.768 -24.768
  618   2HB   MET  87           HB1      MET  87   5.756 -23.295 -23.295
  619   1HG   MET  87           HG2      MET  87   5.409 -22.128 -22.128
  620   2HG   MET  87           HG1      MET  87   5.139 -23.724 -23.724
  621   1HE   MET  87           HE1      MET  87   6.588 -25.514 -25.514
  622   2HE   MET  87           HE3      MET  87   7.216 -25.686 -25.686
  623   3HE   MET  87           HE2      MET  87   8.326 -25.578 -25.578
  624    H    ASP  88           HN       ASP  88   4.227 -21.761 -21.761
  625    HA   ASP  88           HA       ASP  88   4.557 -19.208 -19.208
  626   1HB   ASP  88           HB2      ASP  88   3.957 -20.015 -20.015
  627   2HB   ASP  88           HB1      ASP  88   4.482 -18.406 -18.406
  628    H    THR  89           HN       THR  89   1.714 -20.856 -20.856
  629    HA   THR  89           HA       THR  89  -0.071 -18.791 -18.791
  630    HB   THR  89           HB       THR  89  -0.670 -21.304 -21.304
  631    HG1  THR  89           HG1      THR  89  -0.231 -20.823 -20.823
  632   1HG2  THR  89          HG22      THR  89  -2.511 -19.642 -19.642
  633   2HG2  THR  89          HG21      THR  89  -2.287 -19.775 -19.775
  634   3HG2  THR  89          HG23      THR  89  -2.822 -21.175 -21.175
  635    H    GLY  90           HN       GLY  90  -1.024 -17.274 -17.274
  636   1HA   GLY  90           HA2      GLY  90  -1.915 -17.497 -17.497
  637   2HA   GLY  90           HA1      GLY  90  -0.242 -16.965 -16.965
  638    H    LEU  91           HN       LEU  91  -0.653 -14.888 -14.888
  639    HA   LEU  91           HA       LEU  91  -2.334 -13.108 -13.108
  640   1HB   LEU  91           HB2      LEU  91  -2.949 -13.451 -13.451
  641   2HB   LEU  91           HB1      LEU  91  -1.343 -12.925 -12.925
  642    HG   LEU  91           HG       LEU  91  -1.929 -10.765 -10.765
  643   1HD1  LEU  91          HD12      LEU  91  -4.071 -11.863 -11.863
  644   2HD1  LEU  91          HD11      LEU  91  -4.697 -11.681 -11.681
  645   3HD1  LEU  91          HD13      LEU  91  -4.256 -10.252 -10.252
  646   1HD2  LEU  91          HD23      LEU  91  -1.691 -11.238 -11.238
  647   2HD2  LEU  91          HD22      LEU  91  -2.474  -9.743  -9.743
  648   3HD2  LEU  91          HD21      LEU  91  -3.452 -11.111 -11.111
  649    H    TYR  92           HN       TYR  92  -1.350 -11.481 -11.481
  650    HA   TYR  92           HA       TYR  92   1.491 -10.823 -10.823
  651   1HB   TYR  92           HB2      TYR  92  -0.080 -10.867 -10.867
  652   2HB   TYR  92           HB1      TYR  92   1.505 -10.097 -10.097
  653    HD1  TYR  92           HD1      TYR  92  -0.325 -13.340 -13.340
  654    HD2  TYR  92           HD2      TYR  92   3.537 -11.382 -11.382
  655    HE1  TYR  92           HE1      TYR  92   0.799 -15.566 -15.566
  656    HE2  TYR  92           HE2      TYR  92   4.662 -13.606 -13.606
  657    HH   TYR  92           HH       TYR  92   3.404 -16.388 -16.388
  658    H    ILE  93           HN       ILE  93   1.887  -8.741  -8.741
  659    HA   ILE  93           HA       ILE  93  -0.409  -6.835  -6.835
  660    HB   ILE  93           HB       ILE  93   2.184  -6.950  -6.950
  661   1HG1  ILE  93          HG12      ILE  93   0.482  -7.453  -7.453
  662   2HG1  ILE  93          HG11      ILE  93  -0.605  -7.902  -7.902
  663   1HG2  ILE  93          HG23      ILE  93   0.341  -4.805  -4.805
  664   2HG2  ILE  93          HG22      ILE  93   0.104  -5.425  -5.425
  665   3HG2  ILE  93          HG21      ILE  93   1.702  -4.890  -4.890
  666   1HD1  ILE  93          HD12      ILE  93   2.105  -9.055  -9.055
  667   2HD1  ILE  93          HD11      ILE  93   1.157  -9.618  -9.618
  668   3HD1  ILE  93          HD13      ILE  93   0.539  -9.817  -9.817
  669    H    CYS  94           HN       CYS  94  -0.279  -4.986  -4.986
  670    HA   CYS  94           HA       CYS  94   2.238  -4.361  -4.361
  671   1HB   CYS  94           HB2      CYS  94   0.882  -2.673  -2.673
  672   2HB   CYS  94           HB1      CYS  94  -0.114  -4.120  -4.120
  673    H    LYS  95           HN       LYS  95   3.214  -2.121  -2.121
  674    HA   LYS  95           HA       LYS  95   2.619  -0.897  -0.897
  675   1HB   LYS  95           HB2      LYS  95   4.102  -2.782  -2.782
  676   2HB   LYS  95           HB1      LYS  95   5.179  -2.259  -2.259
  677   1HG   LYS  95           HG2      LYS  95   6.291  -0.930  -0.930
  678   2HG   LYS  95           HG1      LYS  95   4.802  -0.050  -0.050
  679   1HD   LYS  95           HD2      LYS  95   4.176  -1.788  -1.788
  680   2HD   LYS  95           HD1      LYS  95   5.705  -2.615  -2.615
  681   1HE   LYS  95           HE2      LYS  95   6.929  -0.550  -0.550
  682   2HE   LYS  95           HE1      LYS  95   5.372   0.184   0.184
  683   1HZ   LYS  95           HZ2      LYS  95   4.950  -1.878  -1.878
  684   2HZ   LYS  95           HZ1      LYS  95   6.585  -2.281  -2.281
  685   3HZ   LYS  95           HZ3      LYS  95   6.169  -0.862  -0.862
  686    H    VAL  96           HN       VAL  96   2.038   0.738   0.738
  687    HA   VAL  96           HA       VAL  96   4.321   1.943   1.943
  688    HB   VAL  96           HB       VAL  96   2.245   1.457   1.457
  689   1HG1  VAL  96          HG13      VAL  96   1.046   2.384   2.384
  690   2HG1  VAL  96          HG12      VAL  96   0.474   3.415   3.415
  691   3HG1  VAL  96          HG11      VAL  96   0.269   1.663   1.663
  692   1HG2  VAL  96          HG21      VAL  96   3.265   4.206   4.206
  693   2HG2  VAL  96          HG23      VAL  96   2.987   3.260   3.260
  694   3HG2  VAL  96          HG22      VAL  96   1.646   4.106   4.106
  695    H    GLU  97           HN       GLU  97   5.504   3.392   3.392
  696    HA   GLU  97           HA       GLU  97   4.051   5.350   5.350
  697   1HB   GLU  97           HB2      GLU  97   6.725   3.986   3.986
  698   2HB   GLU  97           HB1      GLU  97   6.051   5.216   5.216
  699   1HG   GLU  97           HG2      GLU  97   4.010   3.683   3.683
  700   2HG   GLU  97           HG1      GLU  97   4.964   2.441   2.441
  701    H    LEU  98           HN       LEU  98   4.491   7.458   7.458
  702    HA   LEU  98           HA       LEU  98   6.539   8.094   8.094
  703   1HB   LEU  98           HB2      LEU  98   4.999   9.997   9.997
  704   2HB   LEU  98           HB1      LEU  98   5.658  10.338  10.338
  705    HG   LEU  98           HG       LEU  98   3.307   8.543   8.543
  706   1HD1  LEU  98          HD13      LEU  98   2.983  11.036  11.036
  707   2HD1  LEU  98          HD12      LEU  98   3.453  11.017  11.017
  708   3HD1  LEU  98          HD11      LEU  98   2.007  10.156  10.156
  709   1HD2  LEU  98          HD23      LEU  98   4.767   9.033   9.033
  710   2HD2  LEU  98          HD22      LEU  98   4.522   7.489   7.489
  711   3HD2  LEU  98          HD21      LEU  98   3.151   8.330   8.330
  712    H    MET  99           HN       MET  99   8.210   7.036   7.036
  713    HA   MET  99           HA       MET  99   8.808   8.126   8.126
  714   1HB   MET  99           HB2      MET  99   9.122   5.769   5.769
  715   2HB   MET  99           HB1      MET  99  10.480   6.341   6.341
  716   1HG   MET  99           HG2      MET  99  11.185   5.396   5.396
  717   2HG   MET  99           HG1      MET  99  11.653   7.084   7.084
  718   1HE   MET  99           HE3      MET  99   9.265   4.524   4.524
  719   2HE   MET  99           HE2      MET  99   8.077   5.504   5.504
  720   3HE   MET  99           HE1      MET  99   8.120   5.524   5.524
  721    H    TYR 100           HN       TYR 100  10.550   8.208   8.208
  722    HA   TYR 100           HA       TYR 100  12.690   9.874   9.874
  723   1HB   TYR 100           HB2      TYR 100  11.598   9.148   9.148
  724   2HB   TYR 100           HB1      TYR 100  13.078  10.077  10.077
  725    HD1  TYR 100           HD1      TYR 100  15.112   9.038   9.038
  726    HD2  TYR 100           HD2      TYR 100  11.459   6.762   6.762
  727    HE1  TYR 100           HE1      TYR 100  16.370   6.909   6.909
  728    HE2  TYR 100           HE2      TYR 100  12.730   4.642   4.642
  729    HH   TYR 100           HH       TYR 100  15.918   4.326   4.326
  730    HA   PRO 101           HA       PRO 101  10.470  13.557  13.557
  731   1HB   PRO 101           HB2      PRO 101   7.884  13.388  13.388
  732   2HB   PRO 101           HB1      PRO 101   9.250  12.972  12.972
  733   1HG   PRO 101           HG2      PRO 101   7.304  11.217  11.217
  734   2HG   PRO 101           HG1      PRO 101   8.306  10.906  10.906
  735   1HD   PRO 101           HD2      PRO 101   8.736  10.022  10.022
  736   2HD   PRO 101           HD1      PRO 101   9.785   9.771   9.771
  737    HA   PRO 102           HA       PRO 102   8.444  13.974  13.974
  738   1HB   PRO 102           HB2      PRO 102   9.522  16.382  16.382
  739   2HB   PRO 102           HB1      PRO 102  10.364  14.845  14.845
  740   1HG   PRO 102           HG2      PRO 102  10.707  16.904  16.904
  741   2HG   PRO 102           HG1      PRO 102  11.938  15.881  15.881
  742   1HD   PRO 102           HD2      PRO 102  10.852  15.494  15.494
  743   2HD   PRO 102           HD1      PRO 102  11.614  14.235  14.235
  744    HA   PRO 103           HA       PRO 103   7.710  14.965  14.965
  745   1HB   PRO 103           HB2      PRO 103   5.857  14.878  14.878
  746   2HB   PRO 103           HB1      PRO 103   7.133  16.108  16.108
  747   1HG   PRO 103           HG2      PRO 103   4.464  16.634  16.634
  748   2HG   PRO 103           HG1      PRO 103   5.782  17.630  17.630
  749   1HD   PRO 103           HD2      PRO 103   4.535  15.224  15.224
  750   2HD   PRO 103           HD1      PRO 103   4.312  16.876  16.876
  751    H    TYR 104           HN       TYR 104   6.716  12.889  12.889
  752    HA   TYR 104           HA       TYR 104   5.660  11.171  11.171
  753   1HB   TYR 104           HB2      TYR 104   7.523  10.322  10.322
  754   2HB   TYR 104           HB1      TYR 104   6.761  10.724  10.724
  755    HD1  TYR 104           HD1      TYR 104   5.118   9.113   9.113
  756    HD2  TYR 104           HD2      TYR 104   6.684   8.568   8.568
  757    HE1  TYR 104           HE1      TYR 104   4.028   6.861   6.861
  758    HE2  TYR 104           HE2      TYR 104   5.605   6.300   6.300
  759    HH   TYR 104           HH       TYR 104   3.221   5.339   5.339
  760    H    TYR 105           HN       TYR 105   3.551  10.718  10.718
  761    HA   TYR 105           HA       TYR 105   1.770  10.604  10.604
  762   1HB   TYR 105           HB2      TYR 105   1.905  12.917  12.917
  763   2HB   TYR 105           HB1      TYR 105   1.347  12.293  12.293
  764    HD1  TYR 105           HD1      TYR 105   0.386  12.651  12.651
  765    HD2  TYR 105           HD2      TYR 105  -0.942  11.884  11.884
  766    HE1  TYR 105           HE1      TYR 105  -1.997  12.841  12.841
  767    HE2  TYR 105           HE2      TYR 105  -3.335  12.076  12.076
  768    HH   TYR 105           HH       TYR 105  -4.466  11.699  11.699
  769    H    LEU 106           HN       LEU 106   2.062   8.275   8.275
  770    HA   LEU 106           HA       LEU 106  -0.136   7.715   7.715
  771   1HB   LEU 106           HB2      LEU 106   2.567   7.643   7.643
  772   2HB   LEU 106           HB1      LEU 106   2.181   5.955   5.955
  773    HG   LEU 106           HG       LEU 106   0.253   6.125   6.125
  774   1HD1  LEU 106          HD12      LEU 106   1.262   8.954   8.954
  775   2HD1  LEU 106          HD11      LEU 106   0.506   8.238   8.238
  776   3HD1  LEU 106          HD13      LEU 106  -0.400   8.373   8.373
  777   1HD2  LEU 106          HD22      LEU 106   3.089   6.632   6.632
  778   2HD2  LEU 106          HD21      LEU 106   2.067   5.240   5.240
  779   3HD2  LEU 106          HD23      LEU 106   1.868   6.724   6.724
  780    H    GLY 108           HN       GLY 108   0.589   4.796   4.796
  781   1HA   GLY 108           HA2      GLY 108   0.647   3.896   3.896
  782   2HA   GLY 108           HA1      GLY 108  -0.977   3.831   3.831
  783    H    ILE 109           HN       ILE 109  -0.445   1.509   1.509
  784    HA   ILE 109           HA       ILE 109   0.991   0.035   0.035
  785    HB   ILE 109           HB       ILE 109   0.210  -0.599  -0.599
  786   1HG1  ILE 109          HG12      ILE 109   2.860  -0.100  -0.100
  787   2HG1  ILE 109          HG11      ILE 109   2.022   1.040   1.040
  788   1HG2  ILE 109          HG21      ILE 109   0.206  -2.587  -2.587
  789   2HG2  ILE 109          HG23      ILE 109   1.908  -2.247  -2.247
  790   3HG2  ILE 109          HG22      ILE 109   1.373  -2.691  -2.691
  791   1HD1  ILE 109          HD12      ILE 109   2.929  -1.706  -1.706
  792   2HD1  ILE 109          HD11      ILE 109   3.774  -0.215  -0.215
  793   3HD1  ILE 109          HD13      ILE 109   2.167  -0.521  -0.521
  794    H    GLY 110           HN       GLY 110  -0.154  -1.719  -1.719
  795   1HA   GLY 110           HA2      GLY 110  -3.060  -1.492  -1.492
  796   2HA   GLY 110           HA1      GLY 110  -2.093  -2.692  -2.692
  797    H    ASN 111           HN       ASN 111  -4.544  -2.968  -2.968
  798    HA   ASN 111           HA       ASN 111  -3.806  -4.169  -4.169
  799   1HB   ASN 111           HB2      ASN 111  -6.104  -3.453  -3.453
  800   2HB   ASN 111           HB1      ASN 111  -6.141  -5.054  -5.054
  801    HD2  ASN 111          HD22      ASN 111  -5.436  -3.816  -3.816
  802    H    GLY 112           HN       GLY 112  -3.842  -5.459  -5.459
  803   1HA   GLY 112           HA2      GLY 112  -2.233  -7.281  -7.281
  804   2HA   GLY 112           HA1      GLY 112  -2.707  -8.011  -8.011
  805    H    THR 113           HN       THR 113  -2.782  -8.869  -8.869
  806    HA   THR 113           HA       THR 113  -5.689  -9.643  -9.643
  807    HB   THR 113           HB       THR 113  -3.428  -9.492  -9.492
  808    HG1  THR 113           HG1      THR 113  -5.774  -7.934  -7.934
  809   1HG2  THR 113          HG22      THR 113  -6.227 -10.553 -10.553
  810   2HG2  THR 113          HG21      THR 113  -5.571  -9.748  -9.748
  811   3HG2  THR 113          HG23      THR 113  -4.762 -11.180 -11.180
  812    H    GLN 114           HN       GLN 114  -6.060 -11.930 -11.930
  813    HA   GLN 114           HA       GLN 114  -3.809 -13.671 -13.671
  814   1HB   GLN 114           HB2      GLN 114  -6.202 -13.826 -13.826
  815   2HB   GLN 114           HB1      GLN 114  -6.673 -14.429 -14.429
  816   1HG   GLN 114           HG2      GLN 114  -6.222 -16.439 -16.439
  817   2HG   GLN 114           HG1      GLN 114  -4.594 -16.050 -16.050
  818   1HE2  GLN 114          HE22      GLN 114  -3.783 -16.732 -16.732
  819   2HE2  GLN 114          HE21      GLN 114  -3.846 -17.419 -17.419
  820    H    ILE 115           HN       ILE 115  -2.753 -15.035 -15.035
  821    HA   ILE 115           HA       ILE 115  -3.745 -14.830 -14.830
  822    HB   ILE 115           HB       ILE 115  -0.980 -15.288 -15.288
  823   1HG1  ILE 115          HG12      ILE 115  -2.132 -13.119 -13.119
  824   2HG1  ILE 115          HG11      ILE 115  -1.815 -12.956 -12.956
  825   1HG2  ILE 115          HG23      ILE 115  -1.903 -15.445 -15.445
  826   2HG2  ILE 115          HG22      ILE 115  -0.214 -15.281 -15.281
  827   3HG2  ILE 115          HG21      ILE 115  -1.125 -16.719 -16.719
  828   1HD1  ILE 115          HD12      ILE 115   0.615 -13.812 -13.812
  829   2HD1  ILE 115          HD11      ILE 115   0.089 -12.976 -12.976
  830   3HD1  ILE 115          HD13      ILE 115   0.178 -12.104 -12.104
  831    H    TYR 116           HN       TYR 116  -4.529 -16.750 -16.750
  832    HA   TYR 116           HA       TYR 116  -4.182 -19.235 -19.235
  833   1HB   TYR 116           HB2      TYR 116  -6.129 -18.327 -18.327
  834   2HB   TYR 116           HB1      TYR 116  -6.107 -19.977 -19.977
  835    HD1  TYR 116           HD1      TYR 116  -5.318 -18.937 -18.937
  836    HD2  TYR 116           HD2      TYR 116  -8.476 -17.963 -17.963
  837    HE1  TYR 116           HE1      TYR 116  -6.811 -18.270 -18.270
  838    HE2  TYR 116           HE2      TYR 116  -9.957 -17.334 -17.334
  839    HH   TYR 116           HH       TYR 116  -9.411 -18.177 -18.177
  840    H    VAL 117           HN       VAL 117  -3.264 -21.044 -21.044
  841    HA   VAL 117           HA       VAL 117  -2.362 -21.026 -21.026
  842    HB   VAL 117           HB       VAL 117  -0.915 -22.033 -22.033
  843   1HG1  VAL 117          HG11      VAL 117  -0.212 -22.173 -22.173
  844   2HG1  VAL 117          HG13      VAL 117   0.947 -22.481 -22.481
  845   3HG1  VAL 117          HG12      VAL 117  -0.458 -23.533 -23.533
  846   1HG2  VAL 117          HG21      VAL 117  -0.924 -19.540 -19.540
  847   2HG2  VAL 117          HG23      VAL 117   0.681 -20.269 -20.269
  848   3HG2  VAL 117          HG22      VAL 117  -0.138 -19.857 -19.857
  849    H    ILE 118           HN       ILE 118  -2.026 -23.314 -23.314
  850    HA   ILE 118           HA       ILE 118  -4.215 -25.035 -25.035
  851    HB   ILE 118           HB       ILE 118  -2.522 -25.063 -25.063
  852   1HG1  ILE 118          HG12      ILE 118  -3.764 -23.026 -23.026
  853   2HG1  ILE 118          HG11      ILE 118  -4.631 -24.149 -24.149
  854   1HG2  ILE 118          HG22      ILE 118  -5.008 -26.577 -26.577
  855   2HG2  ILE 118          HG21      ILE 118  -4.496 -26.426 -26.426
  856   3HG2  ILE 118          HG23      ILE 118  -3.457 -27.240 -27.240
  857   1HD1  ILE 118          HD12      ILE 118  -5.782 -24.673 -24.673
  858   2HD1  ILE 118          HD11      ILE 118  -5.450 -22.946 -22.946
  859   3HD1  ILE 118          HD13      ILE 118  -6.441 -23.543 -23.543
  860    H    ASP 119           HN       ASP 119  -3.623 -26.674 -26.674
  861    HA   ASP 119           HA       ASP 119  -1.125 -28.196 -28.196
  862   1HB   ASP 119           HB2      ASP 119  -0.633 -26.356 -26.356
  863   2HB   ASP 119           HB1      ASP 119  -1.880 -26.989 -26.989
  864    HA   PRO 120           HA       PRO 120  -3.970 -31.475 -31.475
  865   1HB   PRO 120           HB2      PRO 120  -2.179 -33.512 -33.512
  866   2HB   PRO 120           HB1      PRO 120  -2.618 -32.901 -32.901
  867   1HG   PRO 120           HG2      PRO 120  -0.214 -32.308 -32.308
  868   2HG   PRO 120           HG1      PRO 120  -0.342 -32.580 -32.580
  869   1HD   PRO 120           HD2      PRO 120  -0.111 -30.108 -30.108
  870   2HD   PRO 120           HD1      PRO 120  -0.985 -30.418 -30.418
  871    H    GLU 121           HN       GLU 121  -4.546 -32.845 -32.845
  872    HA   GLU 121           HA       GLU 121  -3.686 -31.650 -31.650
  873   1HB   GLU 121           HB2      GLU 121  -5.700 -33.781 -33.781
  874   2HB   GLU 121           HB1      GLU 121  -5.531 -33.122 -33.122
  875   1HG   GLU 121           HG2      GLU 121  -6.065 -30.880 -30.880
  876   2HG   GLU 121           HG1      GLU 121  -6.139 -31.473 -31.473
  877    HA   PRO 122           HA       PRO 122  -0.699 -35.045 -35.045
  878   1HB   PRO 122           HB2      PRO 122   0.474 -34.204 -34.204
  879   2HB   PRO 122           HB1      PRO 122   0.877 -33.527 -33.527
  880   1HG   PRO 122           HG2      PRO 122  -0.918 -32.443 -32.443
  881   2HG   PRO 122           HG1      PRO 122   0.243 -31.597 -31.597
  882   1HD   PRO 122           HD2      PRO 122  -2.426 -31.582 -31.582
  883   2HD   PRO 122           HD1      PRO 122  -1.218 -31.481 -31.481
  884    H    CYS 123           HN       CYS 123  -3.282 -34.167 -34.167
  885    HA   CYS 123           HA       CYS 123  -2.831 -36.514 -36.514
  886   1HB   CYS 123           HB2      CYS 123  -4.762 -34.175 -34.175
  887   2HB   CYS 123           HB1      CYS 123  -4.690 -35.423 -35.423
  888    HG   CYS 123           HG       CYS 123  -2.174 -34.648 -34.648
  889    HA   PRO 124           HA       PRO 124  -5.808 -38.765 -38.765
  890   1HB   PRO 124           HB2      PRO 124  -6.333 -40.799 -40.799
  891   2HB   PRO 124           HB1      PRO 124  -4.853 -40.718 -40.718
  892   1HG   PRO 124           HG2      PRO 124  -5.277 -39.976 -39.976
  893   2HG   PRO 124           HG1      PRO 124  -3.913 -40.816 -40.816
  894   1HD   PRO 124           HD2      PRO 124  -3.832 -38.191 -38.191
  895   2HD   PRO 124           HD1      PRO 124  -2.932 -38.865 -38.865
  896    H    ASP 125           HN       ASP 125  -6.447 -37.266 -37.266
  897    HA   ASP 125           HA       ASP 125  -9.355 -37.256 -37.256
  898   1HB   ASP 125           HB2      ASP 125  -9.859 -38.011 -38.011
  899   2HB   ASP 125           HB1      ASP 125  -8.884 -39.210 -39.210
  900    H    SER 126           HN       SER 126 -10.480 -35.711 -35.711
  901    HA   SER 126           HA       SER 126  -8.638 -33.521 -33.521
  902   1HB   SER 126           HB2      SER 126 -10.172 -31.920 -31.920
  903   2HB   SER 126           HB1      SER 126  -9.594 -33.083 -33.083
  904    HG   SER 126           HG       SER 126 -11.570 -33.737 -33.737
  905    H    ASP 127           HN       ASP 127  -9.651 -32.102 -32.102
  906    HA   ASP 127           HA       ASP 127 -11.253 -33.568 -33.568
  907   1HB   ASP 127           HB2      ASP 127  -9.445 -31.901 -31.901
  908   2HB   ASP 127           HB1      ASP 127 -10.489 -30.633 -30.633
  909    H    GLN 128           HN       GLN 128 -13.459 -33.534 -33.534
  910    HA   GLN 128           HA       GLN 128 -15.006 -31.517 -31.517
  911   1HB   GLN 128           HB2      GLN 128 -15.584 -34.411 -34.411
  912   2HB   GLN 128           HB1      GLN 128 -16.705 -33.357 -33.357
  913   1HG   GLN 128           HG2      GLN 128 -13.903 -34.032 -34.032
  914   2HG   GLN 128           HG1      GLN 128 -15.376 -34.795 -34.795
  915   1HE2  GLN 128          HE22      GLN 128 -14.424 -31.850 -31.850
  916   2HE2  GLN 128          HE21      GLN 128 -13.553 -33.203 -33.203
  917    H    GLU 129           HN       GLU 129 -16.792 -30.549 -30.549
  918    HA   GLU 129           HA       GLU 129 -18.000 -29.690 -29.690
  919   1HB   GLU 129           HB2      GLU 129 -17.702 -32.622 -32.622
  920   2HB   GLU 129           HB1      GLU 129 -18.843 -31.519 -31.519
  921   1HG   GLU 129           HG2      GLU 129 -18.768 -32.121 -32.121
  922   2HG   GLU 129           HG1      GLU 129 -19.892 -32.855 -32.855
  923    HA   PRO 130           HA       PRO 130 -14.074 -29.956 -29.956
  924   1HB   PRO 130           HB2      PRO 130 -12.971 -27.524 -27.524
  925   2HB   PRO 130           HB1      PRO 130 -12.565 -29.018 -29.018
  926   1HG   PRO 130           HG2      PRO 130 -14.431 -26.827 -26.827
  927   2HG   PRO 130           HG1      PRO 130 -13.290 -27.742 -27.742
  928   1HD   PRO 130           HD2      PRO 130 -15.954 -28.251 -28.251
  929   2HD   PRO 130           HD1      PRO 130 -14.733 -29.507 -29.507
  930    H    LYS 131           HN       LYS 131 -14.016 -28.900 -28.900
  931    HA   LYS 131           HA       LYS 131 -14.942 -27.706 -27.706
  932   1HB   LYS 131           HB2      LYS 131 -15.107 -25.716 -25.716
  933   2HB   LYS 131           HB1      LYS 131 -15.298 -25.285 -25.285
  934   1HG   LYS 131           HG2      LYS 131 -13.039 -26.237 -26.237
  935   2HG   LYS 131           HG1      LYS 131 -12.847 -26.545 -26.545
  936   1HD   LYS 131           HD2      LYS 131 -13.059 -24.160 -24.160
  937   2HD   LYS 131           HD1      LYS 131 -13.362 -23.815 -23.815
  938   1HE   LYS 131           HE2      LYS 131 -11.107 -24.718 -24.718
  939   2HE   LYS 131           HE1      LYS 131 -10.799 -24.960 -24.960
  940   1HZ   LYS 131           HZ1      LYS 131 -11.594 -22.373 -22.373
  941   2HZ   LYS 131           HZ3      LYS 131 -10.003 -22.783 -22.783
  942   3HZ   LYS 131           HZ2      LYS 131 -11.187 -22.638 -22.638
  943    H1   NAG 132           H1       NAG 132  -4.594  -6.589  -6.589
  944    H2   NAG 132           H2       NAG 132  -3.852  -4.328  -4.328
  945    H3   NAG 132           H3       NAG 132  -2.490  -7.049  -7.049
  946    H4   NAG 132           H4       NAG 132  -4.145  -6.118  -6.118
  947    H5   NAG 132           H5       NAG 132  -4.897  -8.184  -8.184
  948   1H6   NAG 132           H61      NAG 132  -6.818  -8.582  -8.582
  949   2H6   NAG 132           H62      NAG 132  -5.700  -8.291  -8.291
  950   1H8   NAG 132           H81      NAG 132  -0.583  -3.893  -3.893
  951   2H8   NAG 132           H82      NAG 132  -1.847  -2.656  -2.656
  952   3H8   NAG 132           H83      NAG 132  -0.455  -2.311  -2.311
  953    HN2  NAG 132           HN2      NAG 132  -2.559  -5.242  -5.242
  954    HO3  NAG 132           HO3      NAG 132  -0.991  -6.155  -6.155
  955    H1   NAG 133           H1       NAG 133  -3.755  -7.652  -7.652
  956    H2   NAG 133           H2       NAG 133  -1.231  -9.173  -9.173
  957    H3   NAG 133           H3       NAG 133  -2.256  -8.725  -8.725
  958    H4   NAG 133           H4       NAG 133   0.186  -7.480  -7.480
  959    H5   NAG 133           H5       NAG 133  -2.460  -6.136  -6.136
  960   1H6   NAG 133           H61      NAG 133   0.073  -5.130  -5.130
  961   2H6   NAG 133           H62      NAG 133  -0.641  -4.647  -4.647
  962   1H8   NAG 133           H81      NAG 133  -5.926 -10.974 -10.974
  963   2H8   NAG 133           H82      NAG 133  -5.757  -9.201  -9.201
  964   3H8   NAG 133           H83      NAG 133  -5.221 -10.254 -10.254
  965    HN2  NAG 133           HN2      NAG 133  -2.675 -10.938 -10.938
  966    HO3  NAG 133           HO3      NAG 133   0.011  -9.987  -9.987
  967    HO6  NAG 133           HO6      NAG 133  -1.495  -4.049  -4.049
  968    H1   FUC 134           H1       FUC 134  -8.497  -7.522  -7.522
  969    H2   FUC 134           H2       FUC 134  -9.257  -7.959  -7.959
  970    H3   FUC 134           H3       FUC 134  -6.539  -7.265  -7.265
  971    H4   FUC 134           H4       FUC 134  -7.649  -5.260  -5.260
  972    H5   FUC 134           H5       FUC 134  -7.539  -4.737  -4.737
  973   1H6   FUC 134           H61      FUC 134  -8.917  -3.233  -3.233
  974   2H6   FUC 134           H62      FUC 134 -10.338  -4.174  -4.174
  975   3H6   FUC 134           H63      FUC 134  -9.362  -3.247  -3.247
  976    HO2  FUC 134           HO2      FUC 134  -8.091  -9.865  -9.865
  977    HO3  FUC 134           HO3      FUC 134  -6.887  -7.831  -7.831
  978    HO4  FUC 134           HO4      FUC 134  -9.712  -5.163  -5.163
  979    H1   MAN 135           H1       MAN 135   1.512  -7.892  -7.892
  980    H2   MAN 135           H2       MAN 135   1.514  -5.491  -5.491
  981    H3   MAN 135           H3       MAN 135   3.662  -6.343  -6.343
  982    H4   MAN 135           H4       MAN 135   2.905  -5.524  -5.524
  983    H5   MAN 135           H5       MAN 135   3.152  -8.350  -8.350
  984   1H6   MAN 135           H61      MAN 135   3.595  -7.599  -7.599
  985   2H6   MAN 135           H62      MAN 135   1.831  -7.822  -7.822
  986    HO2  MAN 135           HO2      MAN 135   1.103  -3.912  -3.912
  987    HO3  MAN 135           HO3      MAN 135   3.593  -4.099  -4.099
  988    HO4  MAN 135           HO4      MAN 135   5.152  -6.714  -6.714
  989    HO6  MAN 135           HO6      MAN 135   3.859  -9.705  -9.705
  990    H1   NAG 136           H1       NAG 136   0.272  -6.769  -6.769
  991    H2   NAG 136           H2       NAG 136  -2.684  -6.330  -6.330
  992    H3   NAG 136           H3       NAG 136  -0.830  -8.628  -8.628
  993    H4   NAG 136           H4       NAG 136  -1.878  -6.434  -6.434
  994    H5   NAG 136           H5       NAG 136   0.949  -6.772  -6.772
  995   1H6   NAG 136           H61      NAG 136   1.560  -4.985  -4.985
  996   2H6   NAG 136           H62      NAG 136   0.388  -5.742  -5.742
  997   1H8   NAG 136           H81      NAG 136  -4.716  -9.714  -9.714
  998   2H8   NAG 136           H82      NAG 136  -2.994 -10.190 -10.190
  999   3H8   NAG 136           H83      NAG 136  -3.942  -9.924  -9.924
 1000    HN2  NAG 136           HN2      NAG 136  -1.413  -8.184  -8.184
 1001    HO3  NAG 136           HO3      NAG 136  -2.838  -9.396  -9.396
 1002    H1   NAG 137           H1       NAG 137   0.604  -8.591  -8.591
 1003    H2   NAG 137           H2       NAG 137  -0.264 -10.118 -10.118
 1004    H3   NAG 137           H3       NAG 137   1.623 -11.042 -11.042
 1005    H4   NAG 137           H4       NAG 137   2.319 -10.303 -10.303
 1006    H5   NAG 137           H5       NAG 137   2.972  -8.722  -8.722
 1007   1H6   NAG 137           H61      NAG 137   4.618  -8.669  -8.669
 1008   2H6   NAG 137           H62      NAG 137   3.922  -7.114  -7.114
 1009   1H8   NAG 137           H81      NAG 137  -0.506 -13.789 -13.789
 1010   2H8   NAG 137           H82      NAG 137  -0.250 -12.607 -12.607
 1011   3H8   NAG 137           H83      NAG 137  -1.845 -13.392 -13.392
 1012    HN2  NAG 137           HN2      NAG 137  -1.287 -10.154 -10.154
 1013    HO3  NAG 137           HO3      NAG 137   1.169 -12.180 -12.180
 1014    HO6  NAG 137           HO6      NAG 137   3.751  -7.147  -7.147
 1015    H1   FUC 138           H1       FUC 138  -1.516  -4.526  -4.526
 1016    H2   FUC 138           H2       FUC 138  -1.686  -1.720  -1.720
 1017    H3   FUC 138           H3       FUC 138  -0.343  -1.634  -1.634
 1018    H4   FUC 138           H4       FUC 138   1.527  -0.647  -0.647
 1019    H5   FUC 138           H5       FUC 138   1.675  -3.277  -3.277
 1020   1H6   FUC 138           H61      FUC 138   3.231  -3.105  -3.105
 1021   2H6   FUC 138           H62      FUC 138   1.921  -3.248  -3.248
 1022   3H6   FUC 138           H63      FUC 138   2.466  -1.631  -1.631
 1023    HO2  FUC 138           HO2      FUC 138  -3.191  -3.202  -3.202
 1024    HO3  FUC 138           HO3      FUC 138  -1.469   0.093   0.093
 1025    HO4  FUC 138           HO4      FUC 138   0.115   0.275   0.275
 1026    H1   MAN 139           H1       MAN 139   3.191 -12.387 -12.387
 1027    H2   MAN 139           H2       MAN 139   4.407 -10.594 -10.594
 1028    H3   MAN 139           H3       MAN 139   4.691 -12.819 -12.819
 1029    H4   MAN 139           H4       MAN 139   7.098 -13.147 -13.147
 1030    H5   MAN 139           H5       MAN 139   4.366 -14.514 -14.514
 1031   1H6   MAN 139           H61      MAN 139   6.896 -14.919 -14.919
 1032   2H6   MAN 139           H62      MAN 139   5.427 -14.973 -14.973
 1033    HO2  MAN 139           HO2      MAN 139   6.664 -10.295 -10.295
 1034    HO3  MAN 139           HO3      MAN 139   6.614 -12.411 -12.411
 1035    HO4  MAN 139           HO4      MAN 139   5.721 -14.888 -14.888
 1036    HO6  MAN 139           HO6      MAN 139   4.653 -16.657 -16.657

  Start of MODEL    5
    1   1H    ALA   1           HT2      ALA   1  -7.420  13.629  13.629
    2   2H    ALA   1           HT1      ALA   1  -7.275  13.673  13.673
    3   3H    ALA   1           HT3      ALA   1  -6.047  12.973  12.973
    4    HA   ALA   1           HA       ALA   1  -7.406  11.249  11.249
    5   1HB   ALA   1           HB2      ALA   1  -9.382  12.724  12.724
    6   2HB   ALA   1           HB1      ALA   1  -9.581  12.676  12.676
    7   3HB   ALA   1           HB3      ALA   1  -9.805  11.210  11.210
    8    H    MET   1           HN       MET   1  -6.978   9.379   9.379
    9    HA   MET   1           HA       MET   1  -7.260   9.376   9.376
   10   1HB   MET   1           HB2      MET   1  -4.942   8.464   8.464
   11   2HB   MET   1           HB1      MET   1  -5.081   8.090   8.090
   12   1HG   MET   1           HG2      MET   1  -5.115  10.469  10.469
   13   2HG   MET   1           HG1      MET   1  -5.089  10.892  10.892
   14   1HE   MET   1           HE2      MET   1  -3.224  11.825  11.825
   15   2HE   MET   1           HE1      MET   1  -2.974  12.479  12.479
   16   3HE   MET   1           HE3      MET   1  -1.607  11.832  11.832
   17    H    HIS   2           HN       HIS   2  -7.582   7.218   7.218
   18    HA   HIS   2           HA       HIS   2  -8.757   5.307   5.307
   19   1HB   HIS   2           HB2      HIS   2  -9.227   5.794   5.794
   20   2HB   HIS   2           HB1      HIS   2 -10.051   4.553   4.553
   21    HD1  HIS   2           HD1      HIS   2 -11.129   5.709   5.709
   22    HD2  HIS   2           HD2      HIS   2 -10.736   8.094   8.094
   23    HE1  HIS   2           HE1      HIS   2 -12.696   7.673   7.673
   24    H    VAL   3           HN       VAL   3  -7.827   3.310   3.310
   25    HA   VAL   3           HA       VAL   3  -5.954   2.377   2.377
   26    HB   VAL   3           HB       VAL   3  -5.654   2.226   2.226
   27   1HG1  VAL   3          HG12      VAL   3  -4.728   0.270   0.270
   28   2HG1  VAL   3          HG11      VAL   3  -3.676   1.412   1.412
   29   3HG1  VAL   3          HG13      VAL   3  -3.518   1.179   1.179
   30   1HG2  VAL   3          HG21      VAL   3  -4.173   3.824   3.824
   31   2HG2  VAL   3          HG23      VAL   3  -5.230   4.476   4.476
   32   3HG2  VAL   3          HG22      VAL   3  -3.698   3.723   3.723
   33    H    ALA   4           HN       ALA   4  -6.434   0.300   0.300
   34    HA   ALA   4           HA       ALA   4  -8.333  -1.307  -1.307
   35   1HB   ALA   4           HB1      ALA   4  -7.871  -1.225  -1.225
   36   2HB   ALA   4           HB3      ALA   4  -9.053  -2.247  -2.247
   37   3HB   ALA   4           HB2      ALA   4  -9.228  -0.492  -0.492
   38    H    GLN   5           HN       GLN   5  -7.616  -3.285  -3.285
   39    HA   GLN   5           HA       GLN   5  -5.298  -4.549  -4.549
   40   1HB   GLN   5           HB2      GLN   5  -5.661  -4.142  -4.142
   41   2HB   GLN   5           HB1      GLN   5  -4.322  -4.996  -4.996
   42   1HG   GLN   5           HG2      GLN   5  -3.240  -3.030  -3.030
   43   2HG   GLN   5           HG1      GLN   5  -4.404  -2.540  -2.540
   44   1HE2  GLN   5          HE22      GLN   5  -6.412  -1.121  -1.121
   45   2HE2  GLN   5          HE21      GLN   5  -6.680  -2.521  -2.521
   46    HA   PRO   6           HA       PRO   6  -8.078  -8.045  -8.045
   47   1HB   PRO   6           HB2      PRO   6  -6.407 -10.005 -10.005
   48   2HB   PRO   6           HB1      PRO   6  -7.257  -8.887  -8.887
   49   1HG   PRO   6           HG2      PRO   6  -4.427  -8.865  -8.865
   50   2HG   PRO   6           HG1      PRO   6  -5.117  -8.435  -8.435
   51   1HD   PRO   6           HD2      PRO   6  -4.324  -6.604  -6.604
   52   2HD   PRO   6           HD1      PRO   6  -5.552  -6.288  -6.288
   53    H    ALA   7           HN       ALA   7  -8.411  -9.344  -9.344
   54    HA   ALA   7           HA       ALA   7  -6.442  -9.364  -9.364
   55   1HB   ALA   7           HB2      ALA   7  -9.038  -9.366  -9.366
   56   2HB   ALA   7           HB1      ALA   7  -8.910 -11.099 -11.099
   57   3HB   ALA   7           HB3      ALA   7  -8.199 -10.405 -10.405
   58    H    VAL   8           HN       VAL   8  -7.466 -11.669 -11.669
   59    HA   VAL   8           HA       VAL   8  -5.083 -13.252 -13.252
   60    HB   VAL   8           HB       VAL   8  -7.144 -13.948 -13.948
   61   1HG1  VAL   8          HG11      VAL   8  -8.133 -14.582 -14.582
   62   2HG1  VAL   8          HG13      VAL   8  -8.312 -15.866 -15.866
   63   3HG1  VAL   8          HG12      VAL   8  -9.030 -14.268 -14.268
   64   1HG2  VAL   8          HG23      VAL   8  -5.002 -15.348 -15.348
   65   2HG2  VAL   8          HG22      VAL   8  -6.001 -15.846 -15.846
   66   3HG2  VAL   8          HG21      VAL   8  -6.386 -16.384 -16.384
   67    H    VAL   9           HN       VAL   9  -4.548 -14.733 -14.733
   68    HA   VAL   9           HA       VAL   9  -5.993 -14.452 -14.452
   69    HB   VAL   9           HB       VAL   9  -3.181 -13.728 -13.728
   70   1HG1  VAL   9          HG13      VAL   9  -4.169 -14.756 -14.756
   71   2HG1  VAL   9          HG12      VAL   9  -2.901 -13.530 -13.530
   72   3HG1  VAL   9          HG11      VAL   9  -2.644 -15.099 -15.099
   73   1HG2  VAL   9          HG22      VAL   9  -5.235 -12.150 -12.150
   74   2HG2  VAL   9          HG21      VAL   9  -3.716 -11.677 -11.677
   75   3HG2  VAL   9          HG23      VAL   9  -5.000 -12.380 -12.380
   76    H    LEU  10           HN       LEU  10  -5.623 -16.217 -16.217
   77    HA   LEU  10           HA       LEU  10  -4.486 -18.661 -18.661
   78   1HB   LEU  10           HB2      LEU  10  -6.560 -18.307 -18.307
   79   2HB   LEU  10           HB1      LEU  10  -6.066 -19.852 -19.852
   80    HG   LEU  10           HG       LEU  10  -7.309 -17.571 -17.571
   81   1HD1  LEU  10          HD13      LEU  10  -8.863 -18.666 -18.666
   82   2HD1  LEU  10          HD12      LEU  10  -8.523 -20.216 -20.216
   83   3HD1  LEU  10          HD11      LEU  10  -9.324 -18.936 -18.936
   84   1HD2  LEU  10          HD22      LEU  10  -5.841 -19.912 -19.912
   85   2HD2  LEU  10          HD21      LEU  10  -6.604 -18.691 -18.691
   86   3HD2  LEU  10          HD23      LEU  10  -7.520 -20.104 -20.104
   87    H    ALA  11           HN       ALA  11  -2.584 -19.352 -19.352
   88    HA   ALA  11           HA       ALA  11  -1.470 -18.109 -18.109
   89   1HB   ALA  11           HB1      ALA  11  -0.719 -20.353 -20.353
   90   2HB   ALA  11           HB3      ALA  11   0.263 -19.997 -19.997
   91   3HB   ALA  11           HB2      ALA  11   0.037 -18.768 -18.768
   92    H    SER  12           HN       SER  12  -1.341 -18.918 -18.918
   93    HA   SER  12           HA       SER  12  -3.118 -21.184 -21.184
   94   1HB   SER  12           HB2      SER  12  -1.570 -19.109 -19.109
   95   2HB   SER  12           HB1      SER  12  -2.620 -20.316 -20.316
   96    HG   SER  12           HG       SER  12  -3.345 -18.002 -18.002
   97    H    SER  13           HN       SER  13  -1.943 -22.238 -22.238
   98    HA   SER  13           HA       SER  13  -0.139 -24.203 -24.203
   99   1HB   SER  13           HB2      SER  13  -0.386 -22.887 -22.887
  100   2HB   SER  13           HB1      SER  13   0.339 -24.464 -24.464
  101    HG   SER  13           HG       SER  13  -2.340 -23.639 -23.639
  102    H    ARG  14           HN       ARG  14   2.208 -24.444 -24.444
  103    HA   ARG  14           HA       ARG  14   4.446 -23.700 -23.700
  104   1HB   ARG  14           HB2      ARG  14   3.808 -22.761 -22.761
  105   2HB   ARG  14           HB1      ARG  14   3.274 -21.289 -21.289
  106   1HG   ARG  14           HG2      ARG  14   5.564 -21.091 -21.091
  107   2HG   ARG  14           HG1      ARG  14   5.545 -20.830 -20.830
  108   1HD   ARG  14           HD2      ARG  14   6.396 -23.042 -23.042
  109   2HD   ARG  14           HD1      ARG  14   6.207 -23.497 -23.497
  110    HE   ARG  14           HE       ARG  14   8.143 -22.234 -22.234
  111   1HH1  ARG  14          HH21      ARG  14   6.998 -21.446 -21.446
  112   2HH1  ARG  14          HH22      ARG  14   8.408 -20.524 -20.524
  113   1HH2  ARG  14          HH11      ARG  14   9.945 -21.028 -21.028
  114   2HH2  ARG  14          HH12      ARG  14  10.059 -20.287 -20.287
  115    H    GLY  15           HN       GLY  15   2.155 -22.717 -22.717
  116   1HA   GLY  15           HA2      GLY  15   2.138 -21.486 -21.486
  117   2HA   GLY  15           HA1      GLY  15   3.897 -21.615 -21.615
  118    H    ILE  16           HN       ILE  16   1.636 -19.969 -19.969
  119    HA   ILE  16           HA       ILE  16   3.272 -17.512 -17.512
  120    HB   ILE  16           HB       ILE  16   1.210 -18.244 -18.244
  121   1HG1  ILE  16          HG12      ILE  16   2.970 -19.929 -19.929
  122   2HG1  ILE  16          HG11      ILE  16   3.110 -18.901 -18.901
  123   1HG2  ILE  16          HG23      ILE  16   2.195 -15.822 -15.822
  124   2HG2  ILE  16          HG22      ILE  16   3.515 -16.442 -16.442
  125   3HG2  ILE  16          HG21      ILE  16   1.878 -16.383 -16.383
  126   1HD1  ILE  16          HD11      ILE  16   4.610 -17.696 -17.696
  127   2HD1  ILE  16          HD13      ILE  16   5.015 -19.409 -19.409
  128   3HD1  ILE  16          HD12      ILE  16   5.217 -18.483 -18.483
  129    H    ALA  17           HN       ALA  17   2.369 -16.307 -16.307
  130    HA   ALA  17           HA       ALA  17  -0.607 -16.023 -16.023
  131   1HB   ALA  17           HB2      ALA  17   1.640 -15.486 -15.486
  132   2HB   ALA  17           HB1      ALA  17  -0.050 -15.093 -15.093
  133   3HB   ALA  17           HB3      ALA  17   0.437 -16.773 -16.773
  134    H    SER  18           HN       SER  18  -1.424 -14.164 -14.164
  135    HA   SER  18           HA       SER  18   0.300 -11.710 -11.710
  136   1HB   SER  18           HB2      SER  18   0.165 -12.836 -12.836
  137   2HB   SER  18           HB1      SER  18  -1.587 -12.678 -12.678
  138    HG   SER  18           HG       SER  18  -1.183 -10.367 -10.367
  139    H    PHE  19           HN       PHE  19  -0.696  -9.977  -9.977
  140    HA   PHE  19           HA       PHE  19  -3.666  -9.806  -9.806
  141   1HB   PHE  19           HB2      PHE  19  -3.595  -9.277  -9.277
  142   2HB   PHE  19           HB1      PHE  19  -3.019 -10.899 -10.899
  143    HD1  PHE  19           HD1      PHE  19  -0.486 -11.302 -11.302
  144    HD2  PHE  19           HD2      PHE  19  -2.204  -7.684  -7.684
  145    HE1  PHE  19           HE1      PHE  19   1.677 -10.799 -10.799
  146    HE2  PHE  19           HE2      PHE  19  -0.034  -7.178  -7.178
  147    HZ   PHE  19           HZ       PHE  19   1.904  -8.743  -8.743
  148    H    VAL  20           HN       VAL  20  -4.381  -7.568  -7.568
  149    HA   VAL  20           HA       VAL  20  -2.293  -5.575  -5.575
  150    HB   VAL  20           HB       VAL  20  -5.248  -5.678  -5.678
  151   1HG1  VAL  20          HG13      VAL  20  -4.238  -3.345  -3.345
  152   2HG1  VAL  20          HG12      VAL  20  -3.225  -3.710  -3.710
  153   3HG1  VAL  20          HG11      VAL  20  -4.981  -3.660  -3.660
  154   1HG2  VAL  20          HG22      VAL  20  -3.604  -7.246  -7.246
  155   2HG2  VAL  20          HG21      VAL  20  -4.629  -6.230  -6.230
  156   3HG2  VAL  20          HG23      VAL  20  -2.946  -5.784  -5.784
  157    H    CYS  21           HN       CYS  21  -1.774  -4.295  -4.295
  158    HA   CYS  21           HA       CYS  21  -3.847  -3.630  -3.630
  159   1HB   CYS  21           HB2      CYS  21  -1.605  -4.562  -4.562
  160   2HB   CYS  21           HB1      CYS  21  -0.841  -3.162  -3.162
  161    H    GLU  22           HN       GLU  22  -4.993  -1.910  -1.910
  162    HA   GLU  22           HA       GLU  22  -3.697   0.040   0.040
  163   1HB   GLU  22           HB2      GLU  22  -6.434  -0.009  -0.009
  164   2HB   GLU  22           HB1      GLU  22  -5.930   0.998   0.998
  165   1HG   GLU  22           HG2      GLU  22  -5.447  -0.991  -0.991
  166   2HG   GLU  22           HG1      GLU  22  -5.931  -2.021  -2.021
  167    H    TYR  23           HN       TYR  23  -3.884   2.366   2.366
  168    HA   TYR  23           HA       TYR  23  -3.880   3.234   3.234
  169   1HB   TYR  23           HB2      TYR  23  -1.627   4.143   4.143
  170   2HB   TYR  23           HB1      TYR  23  -1.573   2.447   2.447
  171    HD1  TYR  23           HD2      TYR  23  -1.405   1.805   1.805
  172    HD2  TYR  23           HD1      TYR  23  -1.215   5.927   5.927
  173    HE1  TYR  23           HE2      TYR  23  -0.469   2.469   2.469
  174    HE2  TYR  23           HE1      TYR  23  -0.283   6.592   6.592
  175    HH   TYR  23           HH       TYR  23   0.945   5.535   5.535
  176    H    ALA  24           HN       ALA  24  -3.405   5.751   5.751
  177    HA   ALA  24           HA       ALA  24  -4.688   6.975   6.975
  178   1HB   ALA  24           HB2      ALA  24  -5.476   7.064   7.064
  179   2HB   ALA  24           HB1      ALA  24  -5.865   8.427   8.427
  180   3HB   ALA  24           HB3      ALA  24  -6.499   6.823   6.823
  181    H    SER  25           HN       SER  25  -3.541   8.759   8.759
  182    HA   SER  25           HA       SER  25  -1.881  10.254  10.254
  183   1HB   SER  25           HB2      SER  25   0.007  10.134  10.134
  184   2HB   SER  25           HB1      SER  25  -0.537   8.510   8.510
  185    HG   SER  25           HG       SER  25  -0.263   8.747   8.747
  186    HA   PRO  26           HA       PRO  26  -3.577  13.711  13.711
  187   1HB   PRO  26           HB2      PRO  26  -1.711  15.628  15.628
  188   2HB   PRO  26           HB1      PRO  26  -2.897  15.047  15.047
  189   1HG   PRO  26           HG2      PRO  26  -0.027  14.327  14.327
  190   2HG   PRO  26           HG1      PRO  26  -0.974  14.574  14.574
  191   1HD   PRO  26           HD2      PRO  26  -0.340  12.113  12.113
  192   2HD   PRO  26           HD1      PRO  26  -1.791  12.437  12.437
  193    H    GLY  27           HN       GLY  27  -3.388  14.520  14.520
  194   1HA   GLY  27           HA2      GLY  27  -2.532  14.731  14.731
  195   2HA   GLY  27           HA1      GLY  27  -1.033  15.207  15.207
  196    H    LYS  28           HN       LYS  28   0.351  14.085  14.085
  197    HA   LYS  28           HA       LYS  28   0.214  11.094  11.094
  198   1HB   LYS  28           HB2      LYS  28   0.884  12.871  12.871
  199   2HB   LYS  28           HB1      LYS  28   1.050  11.115  11.115
  200   1HG   LYS  28           HG2      LYS  28  -1.357  10.881  10.881
  201   2HG   LYS  28           HG1      LYS  28  -1.528  12.636  12.636
  202   1HD   LYS  28           HD2      LYS  28  -0.840  12.755  12.755
  203   2HD   LYS  28           HD1      LYS  28  -0.550  11.016  11.016
  204   1HE   LYS  28           HE2      LYS  28  -2.750  11.499  11.499
  205   2HE   LYS  28           HE1      LYS  28  -2.979  10.656  10.656
  206   1HZ   LYS  28           HZ2      LYS  28  -2.861  13.612  13.612
  207   2HZ   LYS  28           HZ1      LYS  28  -4.323  12.752  12.752
  208   3HZ   LYS  28           HZ3      LYS  28  -3.390  12.676  12.676
  209    H    ALA  29           HN       ALA  29   2.272  10.058  10.058
  210    HA   ALA  29           HA       ALA  29   4.676  11.830  11.830
  211   1HB   ALA  29           HB1      ALA  29   3.404  10.019  10.019
  212   2HB   ALA  29           HB3      ALA  29   5.163  10.154  10.154
  213   3HB   ALA  29           HB2      ALA  29   4.169  11.591  11.591
  214    H    THR  30           HN       THR  30   6.625  10.773  10.773
  215    HA   THR  30           HA       THR  30   6.328   8.448   8.448
  216    HB   THR  30           HB       THR  30   8.819   8.776   8.776
  217    HG1  THR  30           HG1      THR  30   9.756  10.362  10.362
  218   1HG2  THR  30          HG22      THR  30   6.798  10.858  10.858
  219   2HG2  THR  30          HG21      THR  30   8.497  11.303  11.303
  220   3HG2  THR  30          HG23      THR  30   7.846   9.964   9.964
  221    H    GLU  31           HN       GLU  31   8.457   9.101   9.101
  222    HA   GLU  31           HA       GLU  31   9.137   6.296   6.296
  223   1HB   GLU  31           HB2      GLU  31   9.682   8.521   8.521
  224   2HB   GLU  31           HB1      GLU  31  10.665   7.112   7.112
  225   1HG   GLU  31           HG2      GLU  31  10.401   8.604   8.604
  226   2HG   GLU  31           HG1      GLU  31  10.879   9.704   9.704
  227    H    VAL  32           HN       VAL  32   6.882   5.468   5.468
  228    HA   VAL  32           HA       VAL  32   5.829   6.194   6.194
  229    HB   VAL  32           HB       VAL  32   4.979   4.221   4.221
  230   1HG1  VAL  32          HG13      VAL  32   3.887   4.901   4.901
  231   2HG1  VAL  32          HG12      VAL  32   2.744   4.546   4.546
  232   3HG1  VAL  32          HG11      VAL  32   3.940   3.341   3.341
  233   1HG2  VAL  32          HG22      VAL  32   4.099   7.019   7.019
  234   2HG2  VAL  32          HG21      VAL  32   4.684   6.439   6.439
  235   3HG2  VAL  32          HG23      VAL  32   3.096   5.944   5.944
  236    H    ARG  33           HN       ARG  33   7.433   5.389   5.389
  237    HA   ARG  33           HA       ARG  33   8.780   2.873   2.873
  238   1HB   ARG  33           HB2      ARG  33   9.599   4.857   4.857
  239   2HB   ARG  33           HB1      ARG  33   8.355   4.524   4.524
  240   1HG   ARG  33           HG2      ARG  33   9.306   2.325   2.325
  241   2HG   ARG  33           HG1      ARG  33  10.496   2.543   2.543
  242   1HD   ARG  33           HD2      ARG  33  11.356   4.564   4.564
  243   2HD   ARG  33           HD1      ARG  33  10.298   4.076   4.076
  244    HE   ARG  33           HE       ARG  33  11.705   2.216   2.216
  245   1HH1  ARG  33          HH21      ARG  33  12.418   3.635   3.635
  246   2HH1  ARG  33          HH22      ARG  33  13.833   2.668   2.668
  247   1HH2  ARG  33          HH11      ARG  33  13.546   0.990   0.990
  248   2HH2  ARG  33          HH12      ARG  33  14.467   1.188   1.188
  249    H    VAL  34           HN       VAL  34   8.004   0.867   0.867
  250    HA   VAL  34           HA       VAL  34   5.817   0.540   0.540
  251    HB   VAL  34           HB       VAL  34   5.092  -1.371  -1.371
  252   1HG1  VAL  34          HG12      VAL  34   5.313   1.319   1.319
  253   2HG1  VAL  34          HG11      VAL  34   4.221   0.027   0.027
  254   3HG1  VAL  34          HG13      VAL  34   4.017   0.796   0.796
  255   1HG2  VAL  34          HG21      VAL  34   7.407  -1.682  -1.682
  256   2HG2  VAL  34          HG23      VAL  34   6.062  -1.748  -1.748
  257   3HG2  VAL  34          HG22      VAL  34   7.045  -0.290  -0.290
  258    H    THR  35           HN       THR  35   6.126  -1.124  -1.124
  259    HA   THR  35           HA       THR  35   8.603  -2.788  -2.788
  260    HB   THR  35           HB       THR  35   7.623  -1.263  -1.263
  261    HG1  THR  35           HG1      THR  35   9.752  -0.848  -0.848
  262   1HG2  THR  35          HG22      THR  35   9.655  -3.372  -3.372
  263   2HG2  THR  35          HG21      THR  35  10.206  -1.979  -1.979
  264   3HG2  THR  35          HG23      THR  35   8.808  -2.906  -2.906
  265    H    VAL  36           HN       VAL  36   8.381  -4.888  -4.888
  266    HA   VAL  36           HA       VAL  36   5.688  -5.639  -5.639
  267    HB   VAL  36           HB       VAL  36   7.764  -7.162  -7.162
  268   1HG1  VAL  36          HG11      VAL  36   5.211  -8.016  -8.016
  269   2HG1  VAL  36          HG13      VAL  36   5.699  -8.786  -8.786
  270   3HG1  VAL  36          HG12      VAL  36   6.753  -8.866  -8.866
  271   1HG2  VAL  36          HG23      VAL  36   5.303  -5.624  -5.624
  272   2HG2  VAL  36          HG22      VAL  36   6.723  -5.937  -5.937
  273   3HG2  VAL  36          HG21      VAL  36   5.473  -7.169  -7.169
  274    H    LEU  37           HN       LEU  37   5.674  -6.517  -6.517
  275    HA   LEU  37           HA       LEU  37   8.377  -7.264  -7.264
  276   1HB   LEU  37           HB2      LEU  37   5.933  -6.087  -6.087
  277   2HB   LEU  37           HB1      LEU  37   7.469  -6.435  -6.435
  278    HG   LEU  37           HG       LEU  37   7.404  -4.638  -4.638
  279   1HD1  LEU  37          HD11      LEU  37   5.747  -4.062  -4.062
  280   2HD1  LEU  37          HD13      LEU  37   7.251  -3.400  -3.400
  281   3HD1  LEU  37          HD12      LEU  37   6.621  -2.817  -2.817
  282   1HD2  LEU  37          HD21      LEU  37   9.256  -5.429  -5.429
  283   2HD2  LEU  37          HD23      LEU  37   9.606  -4.779  -4.779
  284   3HD2  LEU  37          HD22      LEU  37   9.199  -3.686  -3.686
  285    H    ARG  38           HN       ARG  38   8.089  -8.681  -8.681
  286    HA   ARG  38           HA       ARG  38   5.933 -10.727 -10.727
  287   1HB   ARG  38           HB2      ARG  38   8.314 -11.340 -11.340
  288   2HB   ARG  38           HB1      ARG  38   8.753 -11.167 -11.167
  289   1HG   ARG  38           HG2      ARG  38   7.152 -12.903 -12.903
  290   2HG   ARG  38           HG1      ARG  38   6.606 -13.035 -13.035
  291   1HD   ARG  38           HD2      ARG  38   9.440 -13.599 -13.599
  292   2HD   ARG  38           HD1      ARG  38   8.232 -14.830 -14.830
  293    HE   ARG  38           HE       ARG  38   8.292 -13.117 -13.117
  294   1HH1  ARG  38          HH21      ARG  38  10.617 -15.098 -15.098
  295   2HH1  ARG  38          HH22      ARG  38  11.575 -15.365 -15.365
  296   1HH2  ARG  38          HH11      ARG  38   9.561 -13.489 -13.489
  297   2HH2  ARG  38          HH12      ARG  38  10.986 -14.465 -14.465
  298    H    GLN  39           HN       GLN  39   4.569 -10.745 -10.745
  299    HA   GLN  39           HA       GLN  39   5.547  -9.569  -9.569
  300   1HB   GLN  39           HB2      GLN  39   3.461  -8.810  -8.810
  301   2HB   GLN  39           HB1      GLN  39   2.807 -10.432 -10.432
  302   1HG   GLN  39           HG2      GLN  39   2.934 -10.271 -10.271
  303   2HG   GLN  39           HG1      GLN  39   3.692  -8.684  -8.684
  304   1HE2  GLN  39          HE22      GLN  39  -0.285  -9.040  -9.040
  305   2HE2  GLN  39          HE21      GLN  39   0.710 -10.411 -10.411
  306    H    ALA  40           HN       ALA  40   5.431 -10.668 -10.668
  307    HA   ALA  40           HA       ALA  40   4.833 -13.600 -13.600
  308   1HB   ALA  40           HB2      ALA  40   7.335 -12.615 -12.615
  309   2HB   ALA  40           HB1      ALA  40   7.027 -12.539 -12.539
  310   3HB   ALA  40           HB3      ALA  40   6.920 -14.082 -14.082
  311    H    ASP  41           HN       ASP  41   4.539 -14.434 -14.434
  312    HA   ASP  41           HA       ASP  41   2.526 -12.979 -12.979
  313   1HB   ASP  41           HB2      ASP  41   3.046 -15.447 -15.447
  314   2HB   ASP  41           HB1      ASP  41   4.384 -15.059 -15.059
  315    H    SER  42           HN       SER  42   6.031 -12.920 -12.920
  316    HA   SER  42           HA       SER  42   5.781 -11.167 -11.167
  317   1HB   SER  42           HB2      SER  42   7.110 -13.219 -13.219
  318   2HB   SER  42           HB1      SER  42   8.095 -12.732 -12.732
  319    HG   SER  42           HG       SER  42   7.791 -11.227 -11.227
  320    H    GLN  43           HN       GLN  43   7.791 -11.380 -11.380
  321    HA   GLN  43           HA       GLN  43   7.820  -8.381  -8.381
  322   1HB   GLN  43           HB2      GLN  43  10.138 -10.314 -10.314
  323   2HB   GLN  43           HB1      GLN  43  10.255  -8.576  -8.576
  324   1HG   GLN  43           HG2      GLN  43   9.574  -8.124  -8.124
  325   2HG   GLN  43           HG1      GLN  43   9.340  -9.847  -9.847
  326   1HE2  GLN  43          HE22      GLN  43  12.736 -10.409 -10.409
  327   2HE2  GLN  43          HE21      GLN  43  11.143 -10.995 -10.995
  328    H    VAL  44           HN       VAL  44   8.693  -7.557  -7.557
  329    HA   VAL  44           HA       VAL  44   7.861  -9.328  -9.328
  330    HB   VAL  44           HB       VAL  44   7.586  -6.320  -6.320
  331   1HG1  VAL  44          HG11      VAL  44   7.804  -7.622  -7.622
  332   2HG1  VAL  44          HG13      VAL  44   6.072  -7.801  -7.801
  333   3HG1  VAL  44          HG12      VAL  44   6.796  -6.193  -6.193
  334   1HG2  VAL  44          HG22      VAL  44   5.820  -8.624  -8.624
  335   2HG2  VAL  44          HG21      VAL  44   5.841  -7.005  -7.005
  336   3HG2  VAL  44          HG23      VAL  44   5.051  -7.286  -7.286
  337    H    THR  45           HN       THR  45   9.206  -9.188  -9.188
  338    HA   THR  45           HA       THR  45  11.723  -7.575  -7.575
  339    HB   THR  45           HB       THR  45  12.885  -9.522  -9.522
  340    HG1  THR  45           HG1      THR  45  11.757 -11.004 -11.004
  341   1HG2  THR  45          HG21      THR  45  12.441  -9.305  -9.305
  342   2HG2  THR  45          HG23      THR  45  11.153 -10.488 -10.488
  343   3HG2  THR  45          HG22      THR  45  12.825 -10.925 -10.925
  344    H    GLU  46           HN       GLU  46  12.761  -7.028  -7.028
  345    HA   GLU  46           HA       GLU  46  10.813  -6.289  -6.289
  346   1HB   GLU  46           HB2      GLU  46  13.793  -5.959  -5.959
  347   2HB   GLU  46           HB1      GLU  46  12.945  -5.349  -5.349
  348   1HG   GLU  46           HG2      GLU  46  11.574  -3.897  -3.897
  349   2HG   GLU  46           HG1      GLU  46  12.119  -4.655  -4.655
  350    H    VAL  47           HN       VAL  47  10.687  -7.085  -7.085
  351    HA   VAL  47           HA       VAL  47  12.160  -9.644  -9.644
  352    HB   VAL  47           HB       VAL  47   9.395  -8.661  -8.661
  353   1HG1  VAL  47          HG11      VAL  47  10.891 -11.175 -11.175
  354   2HG1  VAL  47          HG13      VAL  47   9.132 -11.070 -11.070
  355   3HG1  VAL  47          HG12      VAL  47  10.107 -10.024 -10.024
  356   1HG2  VAL  47          HG22      VAL  47  10.500 -10.518 -10.518
  357   2HG2  VAL  47          HG21      VAL  47   9.195  -9.340  -9.340
  358   3HG2  VAL  47          HG23      VAL  47   8.917 -10.870 -10.870
  359    H    CYS  48           HN       CYS  48  10.240  -7.502  -7.502
  360    HA   CYS  48           HA       CYS  48  12.702  -6.950  -6.950
  361   1HB   CYS  48           HB2      CYS  48  10.048  -8.032  -8.032
  362   2HB   CYS  48           HB1      CYS  48  11.439  -7.635  -7.635
  363    H    ALA  49           HN       ALA  49  12.587  -4.977  -4.977
  364    HA   ALA  49           HA       ALA  49  10.085  -3.387  -3.387
  365   1HB   ALA  49           HB1      ALA  49  12.446  -3.099  -3.099
  366   2HB   ALA  49           HB3      ALA  49  11.901  -1.592  -1.592
  367   3HB   ALA  49           HB2      ALA  49  10.792  -2.542  -2.542
  368    H    ALA  50           HN       ALA  50  10.035  -1.774  -1.774
  369    HA   ALA  50           HA       ALA  50  12.430  -0.855  -0.855
  370   1HB   ALA  50           HB1      ALA  50  10.629  -3.014  -3.014
  371   2HB   ALA  50           HB3      ALA  50  11.349  -1.874  -1.874
  372   3HB   ALA  50           HB2      ALA  50  12.382  -2.875  -2.875
  373    H    THR  51           HN       THR  51  11.919   1.000   1.000
  374    HA   THR  51           HA       THR  51   9.145   2.051   2.051
  375    HB   THR  51           HB       THR  51  11.557   3.487   3.487
  376    HG1  THR  51           HG1      THR  51  12.191   3.953   3.953
  377   1HG2  THR  51          HG23      THR  51   8.866   4.208   4.208
  378   2HG2  THR  51          HG22      THR  51   9.899   5.040   5.040
  379   3HG2  THR  51          HG21      THR  51  10.176   5.240   5.240
  380    H    TYR  52           HN       TYR  52   7.758   2.100   2.100
  381    HA   TYR  52           HA       TYR  52   8.993   1.392   1.392
  382   1HB   TYR  52           HB2      TYR  52   6.734   0.748   0.748
  383   2HB   TYR  52           HB1      TYR  52   7.146  -0.027  -0.027
  384    HD1  TYR  52           HD2      TYR  52   5.113   2.617   2.617
  385    HD2  TYR  52           HD1      TYR  52   5.989   0.576   0.576
  386    HE1  TYR  52           HE2      TYR  52   3.042   3.575   3.575
  387    HE2  TYR  52           HE1      TYR  52   3.913   1.539   1.539
  388    HH   TYR  52           HH       TYR  52   2.115   4.063   4.063
  389    H    MET  53           HN       MET  53   9.034   2.801   2.801
  390    HA   MET  53           HA       MET  53   8.149   5.570   5.570
  391   1HB   MET  53           HB2      MET  53   9.184   4.117   4.117
  392   2HB   MET  53           HB1      MET  53   9.169   5.860   5.860
  393   1HG   MET  53           HG2      MET  53  10.619   4.186   4.186
  394   2HG   MET  53           HG1      MET  53  11.366   4.403   4.403
  395   1HE   MET  53           HE2      MET  53   9.748   5.640   5.640
  396   2HE   MET  53           HE1      MET  53  11.037   6.619   6.619
  397   3HE   MET  53           HE3      MET  53   9.672   7.400   7.400
  398    H    MET  54           HN       MET  54   6.570   6.464   6.464
  399    HA   MET  54           HA       MET  54   4.199   4.811   4.811
  400   1HB   MET  54           HB2      MET  54   5.024   7.294   7.294
  401   2HB   MET  54           HB1      MET  54   3.378   6.654   6.654
  402   1HG   MET  54           HG2      MET  54   4.119   8.509   8.509
  403   2HG   MET  54           HG1      MET  54   3.094   7.172   7.172
  404   1HE   MET  54           HE3      MET  54   3.529   5.367   5.367
  405   2HE   MET  54           HE2      MET  54   5.064   4.640   4.640
  406   3HE   MET  54           HE1      MET  54   4.247   5.760   5.760
  407    H    GLY  55           HN       GLY  55   4.827   2.860   2.860
  408   1HA   GLY  55           HA2      GLY  55   4.281   2.139   2.139
  409   2HA   GLY  55           HA1      GLY  55   5.961   2.681   2.681
  410    H    ASN  56           HN       ASN  56   7.448   1.065   1.065
  411    HA   ASN  56           HA       ASN  56   6.758  -1.075  -1.075
  412   1HB   ASN  56           HB2      ASN  56   8.076  -1.360  -1.360
  413   2HB   ASN  56           HB1      ASN  56   7.909  -2.656  -2.656
  414   1HD2  ASN  56          HD22      ASN  56   4.190  -2.454  -2.454
  415   2HD2  ASN  56          HD21      ASN  56   5.287  -2.261  -2.261
  416    H    GLU  57           HN       GLU  57   8.374  -1.580  -1.580
  417    HA   GLU  57           HA       GLU  57  11.195  -1.287  -1.287
  418   1HB   GLU  57           HB2      GLU  57  10.521   1.129   1.129
  419   2HB   GLU  57           HB1      GLU  57   9.885   0.923   0.923
  420   1HG   GLU  57           HG2      GLU  57  12.013   0.600   0.600
  421   2HG   GLU  57           HG1      GLU  57  12.725   0.150   0.150
  422    H    LEU  58           HN       LEU  58  12.259  -2.406  -2.406
  423    HA   LEU  58           HA       LEU  58  10.861  -2.790  -2.790
  424   1HB   LEU  58           HB2      LEU  58  11.917  -4.938  -4.938
  425   2HB   LEU  58           HB1      LEU  58  11.335  -5.244  -5.244
  426    HG   LEU  58           HG       LEU  58   9.697  -4.043  -4.043
  427   1HD1  LEU  58          HD13      LEU  58   9.659  -6.788  -6.788
  428   2HD1  LEU  58          HD12      LEU  58   8.464  -6.201  -6.201
  429   3HD1  LEU  58          HD11      LEU  58  10.143  -6.409  -6.409
  430   1HD2  LEU  58          HD22      LEU  58   9.335  -3.960  -3.960
  431   2HD2  LEU  58          HD21      LEU  58   8.231  -3.400  -3.400
  432   3HD2  LEU  58          HD23      LEU  58   8.126  -5.056  -5.056
  433    H    THR  59           HN       THR  59  12.607  -1.412  -1.412
  434    HA   THR  59           HA       THR  59  15.387  -2.312  -2.312
  435    HB   THR  59           HB       THR  59  15.718  -0.245  -0.245
  436    HG1  THR  59           HG1      THR  59  13.893  -0.168  -0.168
  437   1HG2  THR  59          HG22      THR  59  15.529  -0.240  -0.240
  438   2HG2  THR  59          HG21      THR  59  13.829   0.183   0.183
  439   3HG2  THR  59          HG23      THR  59  15.084   1.285   1.285
  440    H    PHE  60           HN       PHE  60  14.725  -4.466  -4.466
  441    HA   PHE  60           HA       PHE  60  14.412  -4.212  -4.212
  442   1HB   PHE  60           HB2      PHE  60  14.526  -6.504  -6.504
  443   2HB   PHE  60           HB1      PHE  60  14.419  -6.763  -6.763
  444    HD1  PHE  60           HD1      PHE  60  12.430  -5.902  -5.902
  445    HD2  PHE  60           HD2      PHE  60  12.603  -5.807  -5.807
  446    HE1  PHE  60           HE1      PHE  60   9.947  -5.580  -5.580
  447    HE2  PHE  60           HE2      PHE  60  10.122  -5.490  -5.490
  448    HZ   PHE  60           HZ       PHE  60   8.799  -5.373  -5.373
  449    H    LEU  61           HN       LEU  61  16.319  -3.718  -3.718
  450    HA   LEU  61           HA       LEU  61  18.962  -4.225  -4.225
  451   1HB   LEU  61           HB2      LEU  61  17.788  -3.761  -3.761
  452   2HB   LEU  61           HB1      LEU  61  19.524  -3.804  -3.804
  453    HG   LEU  61           HG       LEU  61  17.575  -1.938  -1.938
  454   1HD1  LEU  61          HD12      LEU  61  17.951  -1.522  -1.522
  455   2HD1  LEU  61          HD11      LEU  61  19.657  -1.279  -1.279
  456   3HD1  LEU  61          HD13      LEU  61  18.442  -0.197  -0.197
  457   1HD2  LEU  61          HD21      LEU  61  20.559  -2.375  -2.375
  458   2HD2  LEU  61          HD23      LEU  61  19.411  -2.229  -2.229
  459   3HD2  LEU  61          HD22      LEU  61  19.863  -0.804  -0.804
  460    H    ASP  62           HN       ASP  62  16.821  -6.129  -6.129
  461    HA   ASP  62           HA       ASP  62  18.628  -8.475  -8.475
  462   1HB   ASP  62           HB2      ASP  62  18.443  -8.952  -8.952
  463   2HB   ASP  62           HB1      ASP  62  19.137  -7.355  -7.355
  464    H    ASP  63           HN       ASP  63  17.412 -10.531 -10.531
  465    HA   ASP  63           HA       ASP  63  15.567 -11.972 -11.972
  466   1HB   ASP  63           HB2      ASP  63  14.321  -9.436  -9.436
  467   2HB   ASP  63           HB1      ASP  63  13.422 -10.941 -10.941
  468    H    SER  64           HN       SER  64  16.397 -10.898 -10.898
  469    HA   SER  64           HA       SER  64  14.622  -9.378  -9.378
  470   1HB   SER  64           HB2      SER  64  16.871 -10.068 -10.068
  471   2HB   SER  64           HB1      SER  64  16.366 -11.755 -11.755
  472    HG   SER  64           HG       SER  64  16.364 -10.347 -10.347
  473    H    ILE  67           HN       ILE  67  14.215 -12.644 -12.644
  474    HA   ILE  67           HA       ILE  67  12.463 -13.763 -13.763
  475    HB   ILE  67           HB       ILE  67  12.491 -14.000 -14.000
  476   1HG1  ILE  67          HG12      ILE  67  14.665 -14.533 -14.533
  477   2HG1  ILE  67          HG11      ILE  67  13.883 -16.002 -16.002
  478   1HG2  ILE  67          HG22      ILE  67  11.127 -15.593 -15.593
  479   2HG2  ILE  67          HG21      ILE  67  11.601 -16.359 -16.359
  480   3HG2  ILE  67          HG23      ILE  67  10.469 -15.007 -15.007
  481   1HD1  ILE  67          HD11      ILE  67  12.930 -15.806 -15.806
  482   2HD1  ILE  67          HD13      ILE  67  14.574 -15.199 -15.199
  483   3HD1  ILE  67          HD12      ILE  67  14.293 -16.808 -16.808
  484    H    CYS  68           HN       CYS  68  11.896 -11.121 -11.121
  485    HA   CYS  68           HA       CYS  68   8.958 -11.349 -11.349
  486   1HB   CYS  68           HB2      CYS  68  10.714  -9.062  -9.062
  487   2HB   CYS  68           HB1      CYS  68   9.048  -9.387  -9.387
  488    H    THR  69           HN       THR  69   7.652 -10.194 -10.194
  489    HA   THR  69           HA       THR  69   8.941  -8.110  -8.110
  490    HB   THR  69           HB       THR  69   8.721 -10.226 -10.226
  491    HG1  THR  69           HG1      THR  69   8.329  -8.811  -8.811
  492   1HG2  THR  69          HG22      THR  69   5.797 -10.025 -10.025
  493   2HG2  THR  69          HG21      THR  69   6.443 -11.146 -11.146
  494   3HG2  THR  69          HG23      THR  69   6.934 -11.278 -11.278
  495    H    GLY  70           HN       GLY  70   7.797  -6.220  -6.220
  496   1HA   GLY  70           HA2      GLY  70   4.978  -6.322  -6.322
  497   2HA   GLY  70           HA1      GLY  70   6.107  -5.076  -5.076
  498    H    THR  71           HN       THR  71   3.643  -5.693  -5.693
  499    HA   THR  71           HA       THR  71   4.604  -3.771  -3.771
  500    HB   THR  71           HB       THR  71   2.192  -5.552  -5.552
  501    HG1  THR  71           HG1      THR  71   4.610  -5.912  -5.912
  502   1HG2  THR  71          HG22      THR  71   3.182  -3.567  -3.567
  503   2HG2  THR  71          HG21      THR  71   2.753  -5.118  -5.118
  504   3HG2  THR  71          HG23      THR  71   1.555  -4.217  -4.217
  505    H    SER  72           HN       SER  72   3.089  -2.029  -2.029
  506    HA   SER  72           HA       SER  72   0.955  -1.440  -1.440
  507   1HB   SER  72           HB2      SER  72   3.345   0.334   0.334
  508   2HB   SER  72           HB1      SER  72   1.961   0.790   0.790
  509    HG   SER  72           HG       SER  72   3.961  -1.131  -1.131
  510    H    SER  73           HN       SER  73  -0.777  -0.585  -0.585
  511    HA   SER  73           HA       SER  73  -0.354   0.882   0.882
  512   1HB   SER  73           HB2      SER  73  -1.112  -1.479  -1.479
  513   2HB   SER  73           HB1      SER  73  -2.516  -1.140  -1.140
  514    HG   SER  73           HG       SER  73  -2.235  -0.729  -0.729
  515    H    GLY  74           HN       GLY  74  -1.186   2.927   2.927
  516   1HA   GLY  74           HA2      GLY  74  -2.535   4.695   4.695
  517   2HA   GLY  74           HA1      GLY  74  -3.810   3.493   3.493
  518    H    ASN  75           HN       ASN  75  -4.552   3.509   3.509
  519    HA   ASN  75           HA       ASN  75  -2.693   4.221   4.221
  520   1HB   ASN  75           HB2      ASN  75  -5.712   4.046   4.046
  521   2HB   ASN  75           HB1      ASN  75  -4.863   4.537   4.537
  522   1HD2  ASN  75          HD22      ASN  75  -5.626   7.338   7.338
  523   2HD2  ASN  75          HD21      ASN  75  -6.465   5.869   5.869
  524    H    GLN  76           HN       GLN  76  -3.212   1.439   1.439
  525    HA   GLN  76           HA       GLN  76  -3.811  -0.143  -0.143
  526   1HB   GLN  76           HB2      GLN  76  -4.055  -0.807  -0.807
  527   2HB   GLN  76           HB1      GLN  76  -4.518  -1.875  -1.875
  528   1HG   GLN  76           HG2      GLN  76  -6.237  -0.327  -0.327
  529   2HG   GLN  76           HG1      GLN  76  -5.712   0.871   0.871
  530   1HE2  GLN  76          HE22      GLN  76  -7.561  -2.517  -2.517
  531   2HE2  GLN  76          HE21      GLN  76  -6.591  -2.640  -2.640
  532    H    VAL  77           HN       VAL  77  -1.932  -1.169  -1.169
  533    HA   VAL  77           HA       VAL  77   0.271  -1.665  -1.665
  534    HB   VAL  77           HB       VAL  77   1.748  -1.475  -1.475
  535   1HG1  VAL  77          HG11      VAL  77  -0.032   0.556   0.556
  536   2HG1  VAL  77          HG13      VAL  77  -0.060   0.355   0.355
  537   3HG1  VAL  77          HG12      VAL  77   1.464   0.677   0.677
  538   1HG2  VAL  77          HG23      VAL  77  -0.465  -2.448  -2.448
  539   2HG2  VAL  77          HG22      VAL  77   1.245  -2.851  -2.851
  540   3HG2  VAL  77          HG21      VAL  77   0.667  -1.339  -1.339
  541    H    ASN  78           HN       ASN  78   0.520  -3.734  -3.734
  542    HA   ASN  78           HA       ASN  78  -0.786  -5.933  -5.933
  543   1HB   ASN  78           HB2      ASN  78  -1.348  -5.406  -5.406
  544   2HB   ASN  78           HB1      ASN  78   0.296  -5.885  -5.885
  545    HD2  ASN  78          HD22      ASN  78  -2.812  -7.418  -7.418
  546    H    LEU  79           HN       LEU  79   0.659  -6.893  -6.893
  547    HA   LEU  79           HA       LEU  79   3.496  -7.279  -7.279
  548   1HB   LEU  79           HB2      LEU  79   1.964  -7.471  -7.471
  549   2HB   LEU  79           HB1      LEU  79   3.613  -8.075  -8.075
  550    HG   LEU  79           HG       LEU  79   2.830  -5.241  -5.241
  551   1HD1  LEU  79          HD11      LEU  79   3.610  -6.470  -6.470
  552   2HD1  LEU  79          HD13      LEU  79   4.121  -4.825  -4.825
  553   3HD1  LEU  79          HD12      LEU  79   2.405  -5.227  -5.227
  554   1HD2  LEU  79          HD22      LEU  79   5.062  -6.660  -6.660
  555   2HD2  LEU  79          HD21      LEU  79   5.069  -4.917  -4.917
  556   3HD2  LEU  79          HD23      LEU  79   5.564  -6.007  -6.007
  557    H    THR  80           HN       THR  80   4.165  -9.285  -9.285
  558    HA   THR  80           HA       THR  80   2.366 -11.630 -11.630
  559    HB   THR  80           HB       THR  80   4.037 -10.937 -10.937
  560    HG1  THR  80           HG1      THR  80   2.083 -10.505 -10.505
  561   1HG2  THR  80          HG23      THR  80   2.170 -13.255 -13.255
  562   2HG2  THR  80          HG22      THR  80   2.838 -12.879 -12.879
  563   3HG2  THR  80          HG21      THR  80   3.910 -13.349 -13.349
  564    H    ILE  81           HN       ILE  81   3.406 -13.573 -13.573
  565    HA   ILE  81           HA       ILE  81   6.379 -13.424 -13.424
  566    HB   ILE  81           HB       ILE  81   4.177 -14.815 -14.815
  567   1HG1  ILE  81          HG12      ILE  81   6.068 -12.625 -12.625
  568   2HG1  ILE  81          HG11      ILE  81   4.462 -12.295 -12.295
  569   1HG2  ILE  81          HG23      ILE  81   7.179 -14.753 -14.753
  570   2HG2  ILE  81          HG22      ILE  81   5.997 -15.431 -15.431
  571   3HG2  ILE  81          HG21      ILE  81   6.233 -16.170 -16.170
  572   1HD1  ILE  81          HD12      ILE  81   3.675 -14.052 -14.052
  573   2HD1  ILE  81          HD11      ILE  81   5.215 -13.676 -13.676
  574   3HD1  ILE  81          HD13      ILE  81   4.027 -12.400 -12.400
  575    H    GLN  82           HN       GLN  82   7.554 -15.111 -15.111
  576    HA   GLN  82           HA       GLN  82   5.992 -17.416 -17.416
  577   1HB   GLN  82           HB2      GLN  82   8.445 -15.964 -15.964
  578   2HB   GLN  82           HB1      GLN  82   7.835 -17.472 -17.472
  579   1HG   GLN  82           HG2      GLN  82   5.705 -16.416 -16.416
  580   2HG   GLN  82           HG1      GLN  82   6.212 -14.920 -14.920
  581   1HE2  GLN  82          HE22      GLN  82   7.498 -13.775 -13.775
  582   2HE2  GLN  82          HE21      GLN  82   6.559 -13.453 -13.453
  583    H    GLY  83           HN       GLY  83   6.459 -19.221 -19.221
  584   1HA   GLY  83           HA2      GLY  83   8.181 -20.955 -20.955
  585   2HA   GLY  83           HA1      GLY  83   9.227 -19.651 -19.651
  586    H    LEU  84           HN       LEU  84   5.773 -20.112 -20.112
  587    HA   LEU  84           HA       LEU  84   6.331 -19.843 -19.843
  588   1HB   LEU  84           HB2      LEU  84   3.856 -19.982 -19.982
  589   2HB   LEU  84           HB1      LEU  84   3.787 -19.826 -19.826
  590    HG   LEU  84           HG       LEU  84   5.364 -17.929 -17.929
  591   1HD1  LEU  84          HD12      LEU  84   2.478 -17.888 -17.888
  592   2HD1  LEU  84          HD11      LEU  84   3.354 -16.388 -16.388
  593   3HD1  LEU  84          HD13      LEU  84   3.151 -17.569 -17.569
  594   1HD2  LEU  84          HD21      LEU  84   4.699 -18.206 -18.206
  595   2HD2  LEU  84          HD23      LEU  84   6.145 -17.544 -17.544
  596   3HD2  LEU  84          HD22      LEU  84   4.678 -16.571 -16.571
  597    H    ARG  85           HN       ARG  85   6.648 -21.612 -21.612
  598    HA   ARG  85           HA       ARG  85   5.592 -24.257 -24.257
  599   1HB   ARG  85           HB2      ARG  85   7.699 -23.392 -23.392
  600   2HB   ARG  85           HB1      ARG  85   7.266 -25.072 -25.072
  601   1HG   ARG  85           HG2      ARG  85   8.004 -23.267 -23.267
  602   2HG   ARG  85           HG1      ARG  85   9.279 -23.999 -23.999
  603   1HD   ARG  85           HD2      ARG  85   8.994 -25.655 -25.655
  604   2HD   ARG  85           HD1      ARG  85   7.810 -26.204 -26.204
  605    HE   ARG  85           HE       ARG  85   6.659 -24.236 -24.236
  606   1HH1  ARG  85          HH21      ARG  85   7.508 -27.618 -27.618
  607   2HH1  ARG  85          HH22      ARG  85   6.320 -28.115 -28.115
  608   1HH2  ARG  85          HH11      ARG  85   5.138 -24.925 -24.925
  609   2HH2  ARG  85          HH12      ARG  85   4.992 -26.609 -26.609
  610    H    ALA  86           HN       ALA  86   5.100 -25.641 -25.641
  611    HA   ALA  86           HA       ALA  86   2.744 -24.596 -24.596
  612   1HB   ALA  86           HB1      ALA  86   3.623 -27.003 -27.003
  613   2HB   ALA  86           HB3      ALA  86   4.641 -26.651 -26.651
  614   3HB   ALA  86           HB2      ALA  86   2.881 -26.601 -26.601
  615    H    MET  87           HN       MET  87   6.080 -24.832 -24.832
  616    HA   MET  87           HA       MET  87   5.689 -23.715 -23.715
  617   1HB   MET  87           HB2      MET  87   8.026 -23.989 -23.989
  618   2HB   MET  87           HB1      MET  87   8.211 -23.415 -23.415
  619   1HG   MET  87           HG2      MET  87   7.252 -25.500 -25.500
  620   2HG   MET  87           HG1      MET  87   6.961 -26.062 -26.062
  621   1HE   MET  87           HE1      MET  87   8.131 -27.865 -27.865
  622   2HE   MET  87           HE3      MET  87   8.489 -28.340 -28.340
  623   3HE   MET  87           HE2      MET  87   9.760 -28.366 -28.366
  624    H    ASP  88           HN       ASP  88   6.434 -22.235 -22.235
  625    HA   ASP  88           HA       ASP  88   7.139 -19.622 -19.622
  626   1HB   ASP  88           HB2      ASP  88   5.929 -20.597 -20.597
  627   2HB   ASP  88           HB1      ASP  88   6.631 -18.998 -18.998
  628    H    THR  89           HN       THR  89   4.028 -21.173 -21.173
  629    HA   THR  89           HA       THR  89   2.236 -19.112 -19.112
  630    HB   THR  89           HB       THR  89   2.015 -21.272 -21.272
  631    HG1  THR  89           HG1      THR  89   1.635 -21.282 -21.282
  632   1HG2  THR  89          HG23      THR  89   0.244 -19.354 -19.354
  633   2HG2  THR  89          HG22      THR  89  -0.215 -20.337 -20.337
  634   3HG2  THR  89          HG21      THR  89  -0.278 -21.022 -21.022
  635    H    GLY  90           HN       GLY  90   1.532 -17.372 -17.372
  636   1HA   GLY  90           HA2      GLY  90   1.477 -17.043 -17.043
  637   2HA   GLY  90           HA1      GLY  90   3.071 -16.487 -16.487
  638    H    LEU  91           HN       LEU  91   2.350 -14.358 -14.358
  639    HA   LEU  91           HA       LEU  91   0.396 -12.975 -12.975
  640   1HB   LEU  91           HB2      LEU  91  -0.017 -13.102 -13.102
  641   2HB   LEU  91           HB1      LEU  91   1.515 -12.274 -12.274
  642    HG   LEU  91           HG       LEU  91   0.553 -10.447 -10.447
  643   1HD1  LEU  91          HD13      LEU  91  -1.417 -12.099 -12.099
  644   2HD1  LEU  91          HD12      LEU  91  -2.073 -11.473 -11.473
  645   3HD1  LEU  91          HD11      LEU  91  -1.748 -10.377 -10.377
  646   1HD2  LEU  91          HD23      LEU  91   0.938 -10.300 -10.300
  647   2HD2  LEU  91          HD22      LEU  91  -0.387  -9.295  -9.295
  648   3HD2  LEU  91          HD21      LEU  91  -0.733 -10.815 -10.815
  649    H    TYR  92           HN       TYR  92   1.143 -11.440 -11.440
  650    HA   TYR  92           HA       TYR  92   3.877 -10.287 -10.287
  651   1HB   TYR  92           HB2      TYR  92   2.309 -10.955 -10.955
  652   2HB   TYR  92           HB1      TYR  92   3.784  -9.986  -9.986
  653    HD1  TYR  92           HD2      TYR  92   5.956 -10.965 -10.965
  654    HD2  TYR  92           HD1      TYR  92   2.380 -13.352 -13.352
  655    HE1  TYR  92           HE2      TYR  92   7.338 -13.047 -13.047
  656    HE2  TYR  92           HE1      TYR  92   3.760 -15.436 -15.436
  657    HH   TYR  92           HH       TYR  92   7.133 -15.430 -15.430
  658    H    ILE  93           HN       ILE  93   4.032  -8.000  -8.000
  659    HA   ILE  93           HA       ILE  93   1.429  -6.558  -6.558
  660    HB   ILE  93           HB       ILE  93   4.281  -5.891  -5.891
  661   1HG1  ILE  93          HG12      ILE  93   3.104  -5.819  -5.819
  662   2HG1  ILE  93          HG11      ILE  93   1.827  -6.739  -6.739
  663   1HG2  ILE  93          HG21      ILE  93   1.953  -4.152  -4.152
  664   2HG2  ILE  93          HG23      ILE  93   2.614  -4.069  -4.069
  665   3HG2  ILE  93          HG22      ILE  93   3.644  -3.721  -3.721
  666   1HD1  ILE  93          HD13      ILE  93   4.531  -7.769  -7.769
  667   2HD1  ILE  93          HD12      ILE  93   4.066  -7.835  -7.835
  668   3HD1  ILE  93          HD11      ILE  93   3.073  -8.636  -8.636
  669    H    CYS  94           HN       CYS  94   0.879  -4.950  -4.950
  670    HA   CYS  94           HA       CYS  94   2.689  -4.496  -4.496
  671   1HB   CYS  94           HB2      CYS  94   0.630  -3.635  -3.635
  672   2HB   CYS  94           HB1      CYS  94   0.286  -5.199  -5.199
  673    H    LYS  95           HN       LYS  95   3.835  -2.549  -2.549
  674    HA   LYS  95           HA       LYS  95   2.913  -0.404  -0.404
  675   1HB   LYS  95           HB2      LYS  95   4.958  -1.603  -1.603
  676   2HB   LYS  95           HB1      LYS  95   5.689  -1.223  -1.223
  677   1HG   LYS  95           HG2      LYS  95   6.391   0.759   0.759
  678   2HG   LYS  95           HG1      LYS  95   4.726   1.223   1.223
  679   1HD   LYS  95           HD2      LYS  95   4.838   0.101   0.101
  680   2HD   LYS  95           HD1      LYS  95   6.478  -0.451  -0.451
  681   1HE   LYS  95           HE2      LYS  95   5.728   2.490   2.490
  682   2HE   LYS  95           HE1      LYS  95   6.357   1.644   1.644
  683   1HZ   LYS  95           HZ2      LYS  95   8.199   0.839   0.839
  684   2HZ   LYS  95           HZ1      LYS  95   7.664   1.940   1.940
  685   3HZ   LYS  95           HZ3      LYS  95   8.224   2.508   2.508
  686    H    VAL  96           HN       VAL  96   2.813   1.691   1.691
  687    HA   VAL  96           HA       VAL  96   3.766   2.126   2.126
  688    HB   VAL  96           HB       VAL  96   1.101   3.068   3.068
  689   1HG1  VAL  96          HG13      VAL  96   2.496   3.764   3.764
  690   2HG1  VAL  96          HG12      VAL  96   1.451   2.478   2.478
  691   3HG1  VAL  96          HG11      VAL  96   0.747   3.893   3.893
  692   1HG2  VAL  96          HG23      VAL  96   1.763   0.454   0.454
  693   2HG2  VAL  96          HG22      VAL  96   0.905   0.694   0.694
  694   3HG2  VAL  96          HG21      VAL  96   0.134   1.135   1.135
  695    H    GLU  97           HN       GLU  97   5.327   3.739   3.739
  696    HA   GLU  97           HA       GLU  97   4.428   6.088   6.088
  697   1HB   GLU  97           HB2      GLU  97   7.188   4.832   4.832
  698   2HB   GLU  97           HB1      GLU  97   6.671   6.164   6.164
  699   1HG   GLU  97           HG2      GLU  97   5.361   3.423   3.423
  700   2HG   GLU  97           HG1      GLU  97   6.723   3.853   3.853
  701    H    LEU  98           HN       LEU  98   4.653   7.972   7.972
  702    HA   LEU  98           HA       LEU  98   6.067   8.141   8.141
  703   1HB   LEU  98           HB2      LEU  98   4.669  10.004  10.004
  704   2HB   LEU  98           HB1      LEU  98   5.438  10.625  10.625
  705    HG   LEU  98           HG       LEU  98   2.953  10.187  10.187
  706   1HD1  LEU  98          HD11      LEU  98   4.944   8.895   8.895
  707   2HD1  LEU  98          HD13      LEU  98   3.221   8.917   8.917
  708   3HD1  LEU  98          HD12      LEU  98   4.103  10.433  10.433
  709   1HD2  LEU  98          HD22      LEU  98   2.950   8.029   8.029
  710   2HD2  LEU  98          HD21      LEU  98   2.149   7.921   7.921
  711   3HD2  LEU  98          HD23      LEU  98   3.778   7.278   7.278
  712    H    MET  99           HN       MET  99   8.272   7.502   7.502
  713    HA   MET  99           HA       MET  99   9.385   8.935   8.935
  714   1HB   MET  99           HB2      MET  99  10.230   6.874   6.874
  715   2HB   MET  99           HB1      MET  99  11.500   7.706   7.706
  716   1HG   MET  99           HG2      MET  99   9.281   5.963   5.963
  717   2HG   MET  99           HG1      MET  99  11.003   5.907   5.907
  718   1HE   MET  99           HE3      MET  99   8.749   5.516   5.516
  719   2HE   MET  99           HE2      MET  99   9.500   6.104   6.104
  720   3HE   MET  99           HE1      MET  99   8.001   6.832   6.832
  721    H    TYR 100           HN       TYR 100  10.413   8.802   8.802
  722    HA   TYR 100           HA       TYR 100  12.219  11.041  11.041
  723   1HB   TYR 100           HB2      TYR 100  10.991   9.544   9.544
  724   2HB   TYR 100           HB1      TYR 100  12.291  10.715  10.715
  725    HD1  TYR 100           HD1      TYR 100  11.353   7.353   7.353
  726    HD2  TYR 100           HD2      TYR 100  14.551  10.246  10.246
  727    HE1  TYR 100           HE1      TYR 100  13.040   5.586   5.586
  728    HE2  TYR 100           HE2      TYR 100  16.229   8.478   8.478
  729    HH   TYR 100           HH       TYR 100  15.554   5.672   5.672
  730    HA   PRO 101           HA       PRO 101   8.880  13.524  13.524
  731   1HB   PRO 101           HB2      PRO 101   6.285  12.633  12.633
  732   2HB   PRO 101           HB1      PRO 101   7.485  12.222  12.222
  733   1HG   PRO 101           HG2      PRO 101   6.397  10.597  10.597
  734   2HG   PRO 101           HG1      PRO 101   7.035  10.109  10.109
  735   1HD   PRO 101           HD2      PRO 101   8.385   9.924   9.924
  736   2HD   PRO 101           HD1      PRO 101   9.084   9.752   9.752
  737    HA   PRO 102           HA       PRO 102   7.468  14.821  14.821
  738   1HB   PRO 102           HB2      PRO 102   8.214  17.464  17.464
  739   2HB   PRO 102           HB1      PRO 102   9.407  16.211  16.211
  740   1HG   PRO 102           HG2      PRO 102   8.888  17.642  17.642
  741   2HG   PRO 102           HG1      PRO 102  10.366  16.894  16.894
  742   1HD   PRO 102           HD2      PRO 102   8.625  16.007  16.007
  743   2HD   PRO 102           HD1      PRO 102  10.008  15.151  15.151
  744    HA   PRO 103           HA       PRO 103   6.933  16.056  16.056
  745   1HB   PRO 103           HB2      PRO 103   5.599  16.155  16.155
  746   2HB   PRO 103           HB1      PRO 103   6.542  17.499  17.499
  747   1HG   PRO 103           HG2      PRO 103   3.710  17.593  17.593
  748   2HG   PRO 103           HG1      PRO 103   4.708  18.607  18.607
  749   1HD   PRO 103           HD2      PRO 103   3.668  15.960  15.960
  750   2HD   PRO 103           HD1      PRO 103   3.071  17.426  17.426
  751    H    TYR 104           HN       TYR 104   6.664  14.399  14.399
  752    HA   TYR 104           HA       TYR 104   5.474  11.943  11.943
  753   1HB   TYR 104           HB2      TYR 104   7.746  11.762  11.762
  754   2HB   TYR 104           HB1      TYR 104   7.495  12.630  12.630
  755    HD1  TYR 104           HD1      TYR 104   5.886   9.727   9.727
  756    HD2  TYR 104           HD2      TYR 104   7.682  11.273  11.273
  757    HE1  TYR 104           HE1      TYR 104   5.315   7.609   7.609
  758    HE2  TYR 104           HE2      TYR 104   7.124   9.136   9.136
  759    HH   TYR 104           HH       TYR 104   5.480   7.260   7.260
  760    H    TYR 105           HN       TYR 105   3.620  11.272  11.272
  761    HA   TYR 105           HA       TYR 105   2.578  11.298  11.298
  762   1HB   TYR 105           HB2      TYR 105   2.138  13.588  13.588
  763   2HB   TYR 105           HB1      TYR 105   1.179  12.784  12.784
  764    HD1  TYR 105           HD2      TYR 105  -0.787  11.310  11.310
  765    HD2  TYR 105           HD1      TYR 105   1.235  14.053  14.053
  766    HE1  TYR 105           HE2      TYR 105  -2.757  11.244  11.244
  767    HE2  TYR 105           HE1      TYR 105  -0.708  14.000  14.000
  768    HH   TYR 105           HH       TYR 105  -3.608  13.219  13.219
  769    H    LEU 106           HN       LEU 106   2.018   9.125   9.125
  770    HA   LEU 106           HA       LEU 106  -0.164   8.368   8.368
  771   1HB   LEU 106           HB2      LEU 106   2.412   7.991   7.991
  772   2HB   LEU 106           HB1      LEU 106   2.027   6.418   6.418
  773    HG   LEU 106           HG       LEU 106  -0.191   6.573   6.573
  774   1HD1  LEU 106          HD11      LEU 106   1.304   8.970   8.970
  775   2HD1  LEU 106          HD13      LEU 106   0.378   8.054   8.054
  776   3HD1  LEU 106          HD12      LEU 106  -0.430   8.745   8.745
  777   1HD2  LEU 106          HD23      LEU 106   2.566   6.132   6.132
  778   2HD2  LEU 106          HD22      LEU 106   1.249   4.987   4.987
  779   3HD2  LEU 106          HD21      LEU 106   1.228   6.090   6.090
  780    H    GLY 108           HN       GLY 108   0.577   5.375   5.375
  781   1HA   GLY 108           HA2      GLY 108   0.427   5.082   5.082
  782   2HA   GLY 108           HA1      GLY 108  -1.092   4.713   4.713
  783    H    ILE 109           HN       ILE 109  -0.200   2.621   2.621
  784    HA   ILE 109           HA       ILE 109   1.252   0.926   0.926
  785    HB   ILE 109           HB       ILE 109   1.333   1.013   1.013
  786   1HG1  ILE 109          HG12      ILE 109   3.444   1.485   1.485
  787   2HG1  ILE 109          HG11      ILE 109   2.540   2.773   2.773
  788   1HG2  ILE 109          HG21      ILE 109   1.463  -1.306  -1.306
  789   2HG2  ILE 109          HG23      ILE 109   2.760  -0.815  -0.815
  790   3HG2  ILE 109          HG22      ILE 109   3.011  -0.781  -0.781
  791   1HD1  ILE 109          HD13      ILE 109   3.294   1.868   1.868
  792   2HD1  ILE 109          HD12      ILE 109   4.306   0.730   0.730
  793   3HD1  ILE 109          HD11      ILE 109   4.613   2.461   2.461
  794    H    GLY 110           HN       GLY 110   0.559  -1.402  -1.402
  795   1HA   GLY 110           HA2      GLY 110  -2.307  -1.665  -1.665
  796   2HA   GLY 110           HA1      GLY 110  -1.446  -2.739  -2.739
  797    H    ASN 111           HN       ASN 111  -2.984  -3.243  -3.243
  798    HA   ASN 111           HA       ASN 111  -1.212  -3.996  -3.996
  799   1HB   ASN 111           HB2      ASN 111  -3.913  -5.011  -5.011
  800   2HB   ASN 111           HB1      ASN 111  -3.152  -5.572  -5.572
  801    HD2  ASN 111          HD22      ASN 111  -2.441  -2.033  -2.033
  802    H    GLY 112           HN       GLY 112  -2.251  -5.739  -5.739
  803   1HA   GLY 112           HA2      GLY 112  -0.338  -7.236  -7.236
  804   2HA   GLY 112           HA1      GLY 112  -0.417  -7.974  -7.974
  805    H    THR 113           HN       THR 113  -0.750  -9.353  -9.353
  806    HA   THR 113           HA       THR 113  -3.628 -10.212 -10.212
  807    HB   THR 113           HB       THR 113  -1.667 -10.230 -10.230
  808    HG1  THR 113           HG1      THR 113  -2.618  -8.457  -8.457
  809   1HG2  THR 113          HG22      THR 113  -4.477 -11.270 -11.270
  810   2HG2  THR 113          HG21      THR 113  -3.875 -10.781 -10.781
  811   3HG2  THR 113          HG23      THR 113  -3.074 -12.091 -12.091
  812    H    GLN 114           HN       GLN 114  -3.775 -12.348 -12.348
  813    HA   GLN 114           HA       GLN 114  -1.342 -13.925 -13.925
  814   1HB   GLN 114           HB2      GLN 114  -3.508 -13.962 -13.962
  815   2HB   GLN 114           HB1      GLN 114  -4.236 -14.871 -14.871
  816   1HG   GLN 114           HG2      GLN 114  -3.468 -16.555 -16.555
  817   2HG   GLN 114           HG1      GLN 114  -2.190 -16.444 -16.444
  818   1HE2  GLN 114          HE22      GLN 114  -0.064 -16.234 -16.234
  819   2HE2  GLN 114          HE21      GLN 114  -0.656 -17.278 -17.278
  820    H    ILE 115           HN       ILE 115  -0.533 -15.505 -15.505
  821    HA   ILE 115           HA       ILE 115  -2.074 -15.798 -15.798
  822    HB   ILE 115           HB       ILE 115   0.889 -16.057 -16.057
  823   1HG1  ILE 115          HG12      ILE 115  -0.638 -14.095 -14.095
  824   2HG1  ILE 115          HG11      ILE 115  -0.039 -13.747 -13.747
  825   1HG2  ILE 115          HG22      ILE 115  -0.622 -16.530 -16.530
  826   2HG2  ILE 115          HG21      ILE 115   1.121 -16.267 -16.267
  827   3HG2  ILE 115          HG23      ILE 115   0.409 -17.671 -17.671
  828   1HD1  ILE 115          HD11      ILE 115   2.273 -14.484 -14.484
  829   2HD1  ILE 115          HD13      ILE 115   1.533 -14.243 -14.243
  830   3HD1  ILE 115          HD12      ILE 115   1.660 -12.892 -12.892
  831    H    TYR 116           HN       TYR 116  -2.872 -17.840 -17.840
  832    HA   TYR 116           HA       TYR 116  -2.003 -20.109 -20.109
  833   1HB   TYR 116           HB2      TYR 116  -4.532 -19.330 -19.330
  834   2HB   TYR 116           HB1      TYR 116  -4.285 -20.992 -20.992
  835    HD1  TYR 116           HD2      TYR 116  -2.970 -20.805 -20.805
  836    HD2  TYR 116           HD1      TYR 116  -6.059 -18.247 -18.247
  837    HE1  TYR 116           HE2      TYR 116  -3.714 -20.185 -20.185
  838    HE2  TYR 116           HE1      TYR 116  -6.794 -17.641 -17.641
  839    HH   TYR 116           HH       TYR 116  -6.682 -18.586 -18.586
  840    H    VAL 117           HN       VAL 117  -1.333 -22.051 -22.051
  841    HA   VAL 117           HA       VAL 117  -0.880 -21.978 -21.978
  842    HB   VAL 117           HB       VAL 117   0.113 -23.817 -23.817
  843   1HG1  VAL 117          HG11      VAL 117   0.594 -23.768 -23.768
  844   2HG1  VAL 117          HG13      VAL 117   1.737 -24.524 -24.524
  845   3HG1  VAL 117          HG12      VAL 117   0.081 -25.128 -25.128
  846   1HG2  VAL 117          HG21      VAL 117   0.911 -21.323 -21.323
  847   2HG2  VAL 117          HG23      VAL 117   2.108 -22.595 -22.595
  848   3HG2  VAL 117          HG22      VAL 117   1.800 -21.971 -21.971
  849    H    ILE 118           HN       ILE 118  -1.337 -24.067 -24.067
  850    HA   ILE 118           HA       ILE 118  -3.966 -25.165 -25.165
  851    HB   ILE 118           HB       ILE 118  -2.476 -25.014 -25.014
  852   1HG1  ILE 118          HG12      ILE 118  -3.190 -22.822 -22.822
  853   2HG1  ILE 118          HG11      ILE 118  -4.200 -23.320 -23.320
  854   1HG2  ILE 118          HG22      ILE 118  -5.153 -26.166 -26.166
  855   2HG2  ILE 118          HG21      ILE 118  -4.889 -25.513 -25.513
  856   3HG2  ILE 118          HG23      ILE 118  -3.904 -26.855 -26.855
  857   1HD1  ILE 118          HD11      ILE 118  -5.562 -24.350 -24.350
  858   2HD1  ILE 118          HD13      ILE 118  -4.924 -22.844 -22.844
  859   3HD1  ILE 118          HD12      ILE 118  -5.938 -22.818 -22.818
  860    H    ASP 119           HN       ASP 119  -4.128 -27.334 -27.334
  861    HA   ASP 119           HA       ASP 119  -1.729 -28.996 -28.996
  862   1HB   ASP 119           HB2      ASP 119  -3.600 -29.000 -29.000
  863   2HB   ASP 119           HB1      ASP 119  -4.669 -29.643 -29.643
  864    HA   PRO 120           HA       PRO 120  -2.197 -30.702 -30.702
  865   1HB   PRO 120           HB2      PRO 120  -0.754 -33.010 -33.010
  866   2HB   PRO 120           HB1      PRO 120   0.001 -31.413 -31.413
  867   1HG   PRO 120           HG2      PRO 120  -0.492 -33.015 -33.015
  868   2HG   PRO 120           HG1      PRO 120   0.918 -32.042 -32.042
  869   1HD   PRO 120           HD2      PRO 120  -0.974 -31.174 -31.174
  870   2HD   PRO 120           HD1      PRO 120  -0.051 -30.076 -30.076
  871    H    GLU 121           HN       GLU 121  -3.529 -32.268 -32.268
  872    HA   GLU 121           HA       GLU 121  -5.383 -33.716 -33.716
  873   1HB   GLU 121           HB2      GLU 121  -5.277 -33.211 -33.211
  874   2HB   GLU 121           HB1      GLU 121  -6.613 -34.014 -34.014
  875   1HG   GLU 121           HG2      GLU 121  -5.637 -31.213 -31.213
  876   2HG   GLU 121           HG1      GLU 121  -7.043 -31.584 -31.584
  877    HA   PRO 122           HA       PRO 122  -3.000 -37.452 -37.452
  878   1HB   PRO 122           HB2      PRO 122  -4.679 -39.213 -39.213
  879   2HB   PRO 122           HB1      PRO 122  -3.546 -38.160 -38.160
  880   1HG   PRO 122           HG2      PRO 122  -6.471 -37.822 -37.822
  881   2HG   PRO 122           HG1      PRO 122  -5.514 -37.501 -37.501
  882   1HD   PRO 122           HD2      PRO 122  -6.326 -35.540 -35.540
  883   2HD   PRO 122           HD1      PRO 122  -4.818 -35.443 -35.443
  884    H    CYS 123           HN       CYS 123  -6.179 -36.705 -36.705
  885    HA   CYS 123           HA       CYS 123  -5.979 -38.859 -38.859
  886   1HB   CYS 123           HB2      CYS 123  -7.477 -39.496 -39.496
  887   2HB   CYS 123           HB1      CYS 123  -8.457 -38.072 -38.072
  888    HG   CYS 123           HG       CYS 123  -9.346 -39.149 -39.149
  889    HA   PRO 124           HA       PRO 124  -6.923 -35.577 -35.577
  890   1HB   PRO 124           HB2      PRO 124  -8.451 -36.835 -36.835
  891   2HB   PRO 124           HB1      PRO 124  -6.693 -37.044 -37.044
  892   1HG   PRO 124           HG2      PRO 124  -8.887 -38.801 -38.801
  893   2HG   PRO 124           HG1      PRO 124  -7.373 -39.242 -39.242
  894   1HD   PRO 124           HD2      PRO 124  -7.673 -39.452 -39.452
  895   2HD   PRO 124           HD1      PRO 124  -6.118 -39.010 -39.010
  896    H    ASP 125           HN       ASP 125  -9.511 -37.305 -37.305
  897    HA   ASP 125           HA       ASP 125 -11.636 -35.514 -35.514
  898   1HB   ASP 125           HB2      ASP 125 -13.007 -36.891 -36.891
  899   2HB   ASP 125           HB1      ASP 125 -12.022 -37.897 -37.897
  900    H    SER 126           HN       SER 126 -13.102 -34.771 -34.771
  901    HA   SER 126           HA       SER 126 -11.392 -32.812 -32.812
  902   1HB   SER 126           HB2      SER 126 -13.493 -32.155 -32.155
  903   2HB   SER 126           HB1      SER 126 -14.391 -33.288 -33.288
  904    HG   SER 126           HG       SER 126 -12.931 -30.993 -30.993
  905    H    ASP 127           HN       ASP 127 -10.771 -33.075 -33.075
  906    HA   ASP 127           HA       ASP 127 -11.322 -35.490 -35.490
  907   1HB   ASP 127           HB2      ASP 127  -9.302 -33.942 -33.942
  908   2HB   ASP 127           HB1      ASP 127 -10.303 -32.827 -32.827
  909    H    GLN 128           HN       GLN 128 -12.666 -32.207 -32.207
  910    HA   GLN 128           HA       GLN 128 -14.507 -32.996 -32.996
  911   1HB   GLN 128           HB2      GLN 128 -13.798 -30.350 -30.350
  912   2HB   GLN 128           HB1      GLN 128 -14.918 -30.523 -30.523
  913   1HG   GLN 128           HG2      GLN 128 -13.019 -30.147 -30.147
  914   2HG   GLN 128           HG1      GLN 128 -12.812 -31.883 -31.883
  915   1HE2  GLN 128          HE22      GLN 128  -9.657 -30.153 -30.153
  916   2HE2  GLN 128          HE21      GLN 128 -10.541 -30.214 -30.214
  917    H    GLU 129           HN       GLU 129 -16.753 -33.009 -33.009
  918    HA   GLU 129           HA       GLU 129 -18.767 -33.253 -33.253
  919   1HB   GLU 129           HB2      GLU 129 -17.399 -30.979 -30.979
  920   2HB   GLU 129           HB1      GLU 129 -19.107 -31.385 -31.385
  921   1HG   GLU 129           HG2      GLU 129 -17.756 -30.662 -30.662
  922   2HG   GLU 129           HG1      GLU 129 -18.722 -29.551 -29.551
  923    HA   PRO 130           HA       PRO 130 -16.351 -35.305 -35.305
  924   1HB   PRO 130           HB2      PRO 130 -16.380 -37.892 -37.892
  925   2HB   PRO 130           HB1      PRO 130 -15.055 -36.762 -36.762
  926   1HG   PRO 130           HG2      PRO 130 -17.342 -37.581 -37.581
  927   2HG   PRO 130           HG1      PRO 130 -15.644 -37.315 -37.315
  928   1HD   PRO 130           HD2      PRO 130 -17.592 -35.496 -35.496
  929   2HD   PRO 130           HD1      PRO 130 -15.905 -35.041 -35.041
  930    H    LYS 131           HN       LYS 131 -17.430 -36.600 -36.600
  931    HA   LYS 131           HA       LYS 131 -20.369 -36.758 -36.758
  932   1HB   LYS 131           HB2      LYS 131 -18.499 -37.131 -37.131
  933   2HB   LYS 131           HB1      LYS 131 -20.259 -37.136 -37.136
  934   1HG   LYS 131           HG2      LYS 131 -18.651 -34.826 -34.826
  935   2HG   LYS 131           HG1      LYS 131 -19.210 -34.913 -34.913
  936   1HD   LYS 131           HD2      LYS 131 -21.548 -35.108 -35.108
  937   2HD   LYS 131           HD1      LYS 131 -20.973 -34.957 -34.957
  938   1HE   LYS 131           HE2      LYS 131 -21.733 -32.761 -32.761
  939   2HE   LYS 131           HE1      LYS 131 -19.966 -32.726 -32.726
  940   1HZ   LYS 131           HZ3      LYS 131 -21.311 -33.511 -33.511
  941   2HZ   LYS 131           HZ2      LYS 131 -20.935 -31.890 -31.890
  942   3HZ   LYS 131           HZ1      LYS 131 -19.696 -33.045 -33.045
  943    H1   NAG 132           H1       NAG 132  -2.231  -3.548  -3.548
  944    H2   NAG 132           H2       NAG 132  -1.900  -0.551  -0.551
  945    H3   NAG 132           H3       NAG 132  -0.719  -2.149  -2.149
  946    H4   NAG 132           H4       NAG 132  -3.006  -0.145  -0.145
  947    H5   NAG 132           H5       NAG 132  -3.180  -3.151  -3.151
  948   1H6   NAG 132           H61      NAG 132  -5.007  -0.848  -0.848
  949   2H6   NAG 132           H62      NAG 132  -5.679  -2.310  -2.310
  950   1H8   NAG 132           H81      NAG 132   1.683  -2.278  -2.278
  951   2H8   NAG 132           H82      NAG 132   0.480  -1.288  -1.288
  952   3H8   NAG 132           H83      NAG 132   1.964  -0.514  -0.514
  953    HN2  NAG 132           HN2      NAG 132  -0.065  -2.816  -2.816
  954    HO3  NAG 132           HO3      NAG 132   0.516  -0.452  -0.452
  955    H1   NAG 133           H1       NAG 133  -3.530  -0.173  -0.173
  956    H2   NAG 133           H2       NAG 133  -0.495   0.351   0.351
  957    H3   NAG 133           H3       NAG 133  -2.651   1.386   1.386
  958    H4   NAG 133           H4       NAG 133  -1.073   2.985   2.985
  959    H5   NAG 133           H5       NAG 133  -4.045   2.196   2.196
  960   1H6   NAG 133           H61      NAG 133  -3.490   4.368   4.368
  961   2H6   NAG 133           H62      NAG 133  -4.118   3.216   3.216
  962   1H8   NAG 133           H81      NAG 133  -3.645  -2.366  -2.366
  963   2H8   NAG 133           H82      NAG 133  -2.372  -3.320  -3.320
  964   3H8   NAG 133           H83      NAG 133  -3.826  -2.804  -2.804
  965    HN2  NAG 133           HN2      NAG 133  -0.537  -1.373  -1.373
  966    HO3  NAG 133           HO3      NAG 133  -0.697   2.746   2.746
  967    HO6  NAG 133           HO6      NAG 133  -1.357   3.891   3.891
  968    H1   FUC 134           H1       FUC 134  -5.857  -2.772  -2.772
  969    H2   FUC 134           H2       FUC 134  -4.398  -4.653  -4.653
  970    H3   FUC 134           H3       FUC 134  -7.268  -5.600  -5.600
  971    H4   FUC 134           H4       FUC 134  -6.313  -7.574  -7.574
  972    H5   FUC 134           H5       FUC 134  -6.964  -5.523  -5.523
  973   1H6   FUC 134           H61      FUC 134  -4.297  -6.446  -6.446
  974   2H6   FUC 134           H62      FUC 134  -5.832  -6.155  -6.155
  975   3H6   FUC 134           H63      FUC 134  -5.636  -7.630  -7.630
  976    HO2  FUC 134           HO2      FUC 134  -5.493  -2.807  -2.807
  977    HO3  FUC 134           HO3      FUC 134  -4.939  -6.370  -6.370
  978    HO4  FUC 134           HO4      FUC 134  -4.312  -7.574  -7.574
  979    H1   MAN 135           H1       MAN 135  -0.593   4.617   4.617
  980    H2   MAN 135           H2       MAN 135  -2.041   5.643   5.643
  981    H3   MAN 135           H3       MAN 135  -0.243   7.060   7.060
  982    H4   MAN 135           H4       MAN 135  -2.139   8.107   8.107
  983    H5   MAN 135           H5       MAN 135   0.324   6.289   6.289
  984   1H6   MAN 135           H61      MAN 135  -1.103   7.995   7.995
  985   2H6   MAN 135           H62      MAN 135  -1.375   6.295   6.295
  986    HO2  MAN 135           HO2      MAN 135  -3.984   5.528   5.528
  987    HO3  MAN 135           HO3      MAN 135  -2.120   7.938   7.938
  988    HO4  MAN 135           HO4      MAN 135  -0.557   9.551   9.551
  989    HO6  MAN 135           HO6      MAN 135   1.240   7.186   7.186
  990    H1   NAG 136           H1       NAG 136  -0.880  -9.438  -9.438
  991    H2   NAG 136           H2       NAG 136  -3.852  -8.998  -8.998
  992    H3   NAG 136           H3       NAG 136  -2.122 -11.451 -11.451
  993    H4   NAG 136           H4       NAG 136  -3.147  -9.332  -9.332
  994    H5   NAG 136           H5       NAG 136  -0.328  -9.683  -9.683
  995   1H6   NAG 136           H61      NAG 136  -1.451  -8.595  -8.595
  996   2H6   NAG 136           H62      NAG 136  -1.067  -7.253  -7.253
  997   1H8   NAG 136           H81      NAG 136  -5.914 -11.432 -11.432
  998   2H8   NAG 136           H82      NAG 136  -4.584 -12.106 -12.106
  999   3H8   NAG 136           H83      NAG 136  -5.715 -10.919 -10.919
 1000    HN2  NAG 136           HN2      NAG 136  -2.636 -11.096 -11.096
 1001    HO3  NAG 136           HO3      NAG 136  -4.180 -12.088 -12.088
 1002    H1   NAG 137           H1       NAG 137  -0.273 -10.640 -10.640
 1003    H2   NAG 137           H2       NAG 137  -1.507 -13.133 -13.133
 1004    H3   NAG 137           H3       NAG 137   1.464 -12.448 -12.448
 1005    H4   NAG 137           H4       NAG 137  -0.109 -12.550 -12.550
 1006    H5   NAG 137           H5       NAG 137   0.972 -10.085 -10.085
 1007   1H6   NAG 137           H61      NAG 137  -0.181 -10.587 -10.587
 1008   2H6   NAG 137           H62      NAG 137   0.981  -9.362  -9.362
 1009   1H8   NAG 137           H81      NAG 137   1.160 -14.273 -14.273
 1010   2H8   NAG 137           H82      NAG 137  -0.090 -15.430 -15.430
 1011   3H8   NAG 137           H83      NAG 137   1.056 -15.895 -15.895
 1012    HN2  NAG 137           HN2      NAG 137  -0.552 -12.655 -12.655
 1013    HO3  NAG 137           HO3      NAG 137   0.187 -14.523 -14.523
 1014    HO6  NAG 137           HO6      NAG 137  -0.670  -8.122  -8.122
 1015    H1   FUC 138           H1       FUC 138   1.083  -8.303  -8.303
 1016    H2   FUC 138           H2       FUC 138   3.461  -6.907  -6.907
 1017    H3   FUC 138           H3       FUC 138   2.372  -8.122  -8.122
 1018    H4   FUC 138           H4       FUC 138   2.100  -5.579  -5.579
 1019    H5   FUC 138           H5       FUC 138   0.026  -6.343  -6.343
 1020   1H6   FUC 138           H61      FUC 138  -0.488  -4.245  -4.245
 1021   2H6   FUC 138           H62      FUC 138   0.224  -3.901  -3.901
 1022   3H6   FUC 138           H63      FUC 138   1.224  -3.732  -3.732
 1023    HO2  FUC 138           HO2      FUC 138   3.452  -9.214  -9.214
 1024    HO3  FUC 138           HO3      FUC 138   4.645  -8.062  -8.062
 1025    HO4  FUC 138           HO4      FUC 138   3.897  -4.979  -4.979
 1026    H1   MAN 139           H1       MAN 139   0.949 -12.160 -12.160
 1027    H2   MAN 139           H2       MAN 139   2.461 -10.164 -10.164
 1028    H3   MAN 139           H3       MAN 139   2.148 -11.144 -11.144
 1029    H4   MAN 139           H4       MAN 139   4.535 -12.931 -12.931
 1030    H5   MAN 139           H5       MAN 139   1.580 -13.690 -13.690
 1031   1H6   MAN 139           H61      MAN 139   4.032 -15.162 -15.162
 1032   2H6   MAN 139           H62      MAN 139   2.600 -15.765 -15.765
 1033    HO2  MAN 139           HO2      MAN 139   4.322 -10.402 -10.402
 1034    HO3  MAN 139           HO3      MAN 139   3.774  -9.531  -9.531
 1035    HO4  MAN 139           HO4      MAN 139   4.445 -12.861 -12.861
 1036    HO6  MAN 139           HO6      MAN 139   3.131 -15.854 -15.854

  Start of MODEL    6
    1   1H    ALA   1           HT3      ALA   1  -7.792   9.482   9.482
    2   2H    ALA   1           HT2      ALA   1  -8.435  10.880  10.880
    3   3H    ALA   1           HT1      ALA   1  -7.576  10.993  10.993
    4    HA   ALA   1           HA       ALA   1  -5.520  10.459  10.459
    5   1HB   ALA   1           HB2      ALA   1  -6.414  12.771  12.771
    6   2HB   ALA   1           HB1      ALA   1  -7.204  12.385  12.385
    7   3HB   ALA   1           HB3      ALA   1  -5.444  12.395  12.395
    8    H    MET   1           HN       MET   1  -8.240  10.315  10.315
    9    HA   MET   1           HA       MET   1  -6.546   8.769   8.769
   10   1HB   MET   1           HB2      MET   1  -9.294  10.046  10.046
   11   2HB   MET   1           HB1      MET   1  -8.496   9.225   9.225
   12   1HG   MET   1           HG2      MET   1  -6.647  10.819  10.819
   13   2HG   MET   1           HG1      MET   1  -7.351  11.605  11.605
   14   1HE   MET   1           HE1      MET   1  -6.738  13.432  13.432
   15   2HE   MET   1           HE3      MET   1  -8.178  14.422  14.422
   16   3HE   MET   1           HE2      MET   1  -7.197  13.888  13.888
   17    H    HIS   2           HN       HIS   2  -7.890   7.742   7.742
   18    HA   HIS   2           HA       HIS   2  -9.570   5.577   5.577
   19   1HB   HIS   2           HB2      HIS   2  -9.338   6.695   6.695
   20   2HB   HIS   2           HB1      HIS   2 -10.412   5.375   5.375
   21    HD1  HIS   2           HD1      HIS   2 -11.965   6.121   6.121
   22    HD2  HIS   2           HD2      HIS   2 -10.658   9.108   9.108
   23    HE1  HIS   2           HE1      HIS   2 -13.462   8.124   8.124
   24    H    VAL   3           HN       VAL   3  -8.756   3.515   3.515
   25    HA   VAL   3           HA       VAL   3  -6.551   2.870   2.870
   26    HB   VAL   3           HB       VAL   3  -6.686   2.299   2.299
   27   1HG1  VAL   3          HG12      VAL   3  -4.582   1.586   1.586
   28   2HG1  VAL   3          HG11      VAL   3  -4.396   1.379   1.379
   29   3HG1  VAL   3          HG13      VAL   3  -5.615   0.450   0.450
   30   1HG2  VAL   3          HG21      VAL   3  -6.111   4.645   4.645
   31   2HG2  VAL   3          HG23      VAL   3  -4.759   3.806   3.806
   32   3HG2  VAL   3          HG22      VAL   3  -4.785   4.033   4.033
   33    H    ALA   4           HN       ALA   4  -6.905   0.926   0.926
   34    HA   ALA   4           HA       ALA   4  -9.032  -0.883  -0.883
   35   1HB   ALA   4           HB1      ALA   4  -8.203  -0.016  -0.016
   36   2HB   ALA   4           HB3      ALA   4  -9.082  -1.530  -1.530
   37   3HB   ALA   4           HB2      ALA   4  -9.812  -0.003  -0.003
   38    H    GLN   5           HN       GLN   5  -8.361  -2.957  -2.957
   39    HA   GLN   5           HA       GLN   5  -5.874  -3.985  -3.985
   40   1HB   GLN   5           HB2      GLN   5  -6.514  -3.982  -3.982
   41   2HB   GLN   5           HB1      GLN   5  -5.089  -4.717  -4.717
   42   1HG   GLN   5           HG2      GLN   5  -5.819  -1.780  -1.780
   43   2HG   GLN   5           HG1      GLN   5  -4.546  -2.492  -2.492
   44   1HE2  GLN   5          HE22      GLN   5  -3.310  -1.167  -1.167
   45   2HE2  GLN   5          HE21      GLN   5  -4.399  -0.485  -0.485
   46    HA   PRO   6           HA       PRO   6  -8.466  -7.644  -7.644
   47   1HB   PRO   6           HB2      PRO   6  -6.561  -9.441  -9.441
   48   2HB   PRO   6           HB1      PRO   6  -7.264  -8.254  -8.254
   49   1HG   PRO   6           HG2      PRO   6  -4.645  -8.211  -8.211
   50   2HG   PRO   6           HG1      PRO   6  -5.062  -7.671  -7.671
   51   1HD   PRO   6           HD2      PRO   6  -4.717  -5.982  -5.982
   52   2HD   PRO   6           HD1      PRO   6  -5.732  -5.610  -5.610
   53    H    ALA   7           HN       ALA   7  -8.899  -9.416  -9.416
   54    HA   ALA   7           HA       ALA   7  -7.376  -9.476  -9.476
   55   1HB   ALA   7           HB2      ALA   7  -9.829 -10.933 -10.933
   56   2HB   ALA   7           HB1      ALA   7  -9.228 -11.079 -11.079
   57   3HB   ALA   7           HB3      ALA   7  -9.822  -9.526  -9.526
   58    H    VAL   8           HN       VAL   8  -7.776 -11.443 -11.443
   59    HA   VAL   8           HA       VAL   8  -5.470 -13.028 -13.028
   60    HB   VAL   8           HB       VAL   8  -7.659 -13.952 -13.952
   61   1HG1  VAL   8          HG13      VAL   8  -8.155 -14.443 -14.443
   62   2HG1  VAL   8          HG12      VAL   8  -8.592 -15.720 -15.720
   63   3HG1  VAL   8          HG11      VAL   8  -9.302 -14.101 -14.101
   64   1HG2  VAL   8          HG23      VAL   8  -5.705 -15.533 -15.533
   65   2HG2  VAL   8          HG22      VAL   8  -5.714 -15.273 -15.273
   66   3HG2  VAL   8          HG21      VAL   8  -6.917 -16.290 -16.290
   67    H    VAL   9           HN       VAL   9  -4.614 -14.275 -14.275
   68    HA   VAL   9           HA       VAL   9  -5.678 -13.727 -13.727
   69    HB   VAL   9           HB       VAL   9  -3.007 -13.156 -13.156
   70   1HG1  VAL   9          HG11      VAL   9  -3.570 -13.803 -13.803
   71   2HG1  VAL   9          HG13      VAL   9  -2.280 -12.680 -12.680
   72   3HG1  VAL   9          HG12      VAL   9  -2.228 -14.348 -14.348
   73   1HG2  VAL   9          HG21      VAL   9  -5.165 -11.602 -11.602
   74   2HG2  VAL   9          HG23      VAL   9  -3.512 -10.999 -10.999
   75   3HG2  VAL   9          HG22      VAL   9  -4.200 -11.426 -11.426
   76    H    LEU  10           HN       LEU  10  -4.958 -15.341 -15.341
   77    HA   LEU  10           HA       LEU  10  -4.246 -17.946 -17.946
   78   1HB   LEU  10           HB2      LEU  10  -5.726 -17.300 -17.300
   79   2HB   LEU  10           HB1      LEU  10  -5.468 -18.922 -18.922
   80    HG   LEU  10           HG       LEU  10  -6.896 -16.735 -16.735
   81   1HD1  LEU  10          HD13      LEU  10  -8.005 -18.936 -18.936
   82   2HD1  LEU  10          HD12      LEU  10  -8.974 -18.013 -18.013
   83   3HD1  LEU  10          HD11      LEU  10  -8.209 -17.198 -17.198
   84   1HD2  LEU  10          HD21      LEU  10  -5.809 -18.888 -18.888
   85   2HD2  LEU  10          HD23      LEU  10  -7.429 -18.385 -18.385
   86   3HD2  LEU  10          HD22      LEU  10  -7.219 -19.696 -19.696
   87    H    ALA  11           HN       ALA  11  -2.316 -18.861 -18.861
   88    HA   ALA  11           HA       ALA  11  -0.651 -17.521 -17.521
   89   1HB   ALA  11           HB3      ALA  11  -0.262 -19.601 -19.601
   90   2HB   ALA  11           HB2      ALA  11   1.008 -19.262 -19.262
   91   3HB   ALA  11           HB1      ALA  11   0.437 -17.985 -17.985
   92    H    SER  12           HN       SER  12   0.177 -18.578 -18.578
   93    HA   SER  12           HA       SER  12  -1.465 -20.711 -20.711
   94   1HB   SER  12           HB2      SER  12  -0.560 -18.820 -18.820
   95   2HB   SER  12           HB1      SER  12   1.081 -19.327 -19.327
   96    HG   SER  12           HG       SER  12   0.872 -20.470 -20.470
   97    H    SER  13           HN       SER  13  -0.317 -22.664 -22.664
   98    HA   SER  13           HA       SER  13   0.956 -24.268 -24.268
   99   1HB   SER  13           HB2      SER  13  -0.285 -25.059 -25.059
  100   2HB   SER  13           HB1      SER  13   1.038 -24.489 -24.489
  101    HG   SER  13           HG       SER  13   1.157 -26.745 -26.745
  102    H    ARG  14           HN       ARG  14   2.302 -22.296 -22.296
  103    HA   ARG  14           HA       ARG  14   5.029 -23.088 -23.088
  104   1HB   ARG  14           HB2      ARG  14   3.651 -20.459 -20.459
  105   2HB   ARG  14           HB1      ARG  14   5.372 -20.723 -20.723
  106   1HG   ARG  14           HG2      ARG  14   3.988 -22.940 -22.940
  107   2HG   ARG  14           HG1      ARG  14   3.156 -21.475 -21.475
  108   1HD   ARG  14           HD2      ARG  14   5.344 -20.520 -20.520
  109   2HD   ARG  14           HD1      ARG  14   6.125 -22.053 -22.053
  110    HE   ARG  14           HE       ARG  14   4.358 -21.618 -21.618
  111   1HH1  ARG  14          HH21      ARG  14   5.651 -23.969 -23.969
  112   2HH1  ARG  14          HH22      ARG  14   5.418 -25.287 -25.287
  113   1HH2  ARG  14          HH11      ARG  14   4.072 -23.354 -23.354
  114   2HH2  ARG  14          HH12      ARG  14   4.533 -24.946 -24.946
  115    H    GLY  15           HN       GLY  15   3.136 -21.132 -21.132
  116   1HA   GLY  15           HA2      GLY  15   3.835 -20.702 -20.702
  117   2HA   GLY  15           HA1      GLY  15   5.517 -20.846 -20.846
  118    H    ILE  16           HN       ILE  16   3.192 -19.020 -19.020
  119    HA   ILE  16           HA       ILE  16   4.703 -16.531 -16.531
  120    HB   ILE  16           HB       ILE  16   3.053 -17.604 -17.604
  121   1HG1  ILE  16          HG12      ILE  16   5.004 -17.207 -17.207
  122   2HG1  ILE  16          HG11      ILE  16   5.730 -16.194 -16.194
  123   1HG2  ILE  16          HG23      ILE  16   3.518 -14.749 -14.749
  124   2HG2  ILE  16          HG22      ILE  16   3.690 -15.178 -15.178
  125   3HG2  ILE  16          HG21      ILE  16   2.167 -15.480 -15.480
  126   1HD1  ILE  16          HD13      ILE  16   5.161 -19.116 -19.116
  127   2HD1  ILE  16          HD12      ILE  16   6.645 -18.597 -18.597
  128   3HD1  ILE  16          HD11      ILE  16   6.292 -18.046 -18.046
  129    H    ALA  17           HN       ALA  17   3.655 -15.689 -15.689
  130    HA   ALA  17           HA       ALA  17   0.670 -15.471 -15.471
  131   1HB   ALA  17           HB2      ALA  17   1.970 -16.528 -16.528
  132   2HB   ALA  17           HB1      ALA  17   2.568 -14.905 -14.905
  133   3HB   ALA  17           HB3      ALA  17   0.840 -15.244 -15.244
  134    H    SER  18           HN       SER  18  -0.129 -13.500 -13.500
  135    HA   SER  18           HA       SER  18   1.524 -11.073 -11.073
  136   1HB   SER  18           HB2      SER  18   0.993 -10.285 -10.285
  137   2HB   SER  18           HB1      SER  18   1.793 -11.852 -11.852
  138    HG   SER  18           HG       SER  18   0.075 -12.232 -12.232
  139    H    PHE  19           HN       PHE  19   0.319  -9.194  -9.194
  140    HA   PHE  19           HA       PHE  19  -2.614  -9.218  -9.218
  141   1HB   PHE  19           HB2      PHE  19  -2.870  -8.776  -8.776
  142   2HB   PHE  19           HB1      PHE  19  -2.230 -10.374 -10.374
  143    HD1  PHE  19           HD2      PHE  19   0.318 -10.734 -10.734
  144    HD2  PHE  19           HD1      PHE  19  -1.671  -7.243  -7.243
  145    HE1  PHE  19           HE2      PHE  19   2.309 -10.269 -10.269
  146    HE2  PHE  19           HE1      PHE  19   0.321  -6.780  -6.780
  147    HZ   PHE  19           HZ       PHE  19   2.310  -8.299  -8.299
  148    H    VAL  20           HN       VAL  20  -3.490  -7.045  -7.045
  149    HA   VAL  20           HA       VAL  20  -1.392  -4.949  -4.949
  150    HB   VAL  20           HB       VAL  20  -4.231  -5.128  -5.128
  151   1HG1  VAL  20          HG11      VAL  20  -2.086  -3.046  -3.046
  152   2HG1  VAL  20          HG13      VAL  20  -3.664  -3.104  -3.104
  153   3HG1  VAL  20          HG12      VAL  20  -3.555  -2.795  -2.795
  154   1HG2  VAL  20          HG21      VAL  20  -2.526  -6.647  -6.647
  155   2HG2  VAL  20          HG23      VAL  20  -3.226  -5.468  -5.468
  156   3HG2  VAL  20          HG22      VAL  20  -1.611  -5.208  -5.208
  157    H    CYS  21           HN       CYS  21  -1.171  -3.686  -3.686
  158    HA   CYS  21           HA       CYS  21  -3.491  -3.264  -3.264
  159   1HB   CYS  21           HB2      CYS  21  -1.325  -4.095  -4.095
  160   2HB   CYS  21           HB1      CYS  21  -0.518  -2.674  -2.674
  161    H    GLU  22           HN       GLU  22  -4.678  -1.532  -1.532
  162    HA   GLU  22           HA       GLU  22  -3.389   0.697   0.697
  163   1HB   GLU  22           HB2      GLU  22  -5.474  -0.169  -0.169
  164   2HB   GLU  22           HB1      GLU  22  -6.210  -0.005  -0.005
  165   1HG   GLU  22           HG2      GLU  22  -6.320   2.349   2.349
  166   2HG   GLU  22           HG1      GLU  22  -5.137   2.401   2.401
  167    H    TYR  23           HN       TYR  23  -3.175   2.795   2.795
  168    HA   TYR  23           HA       TYR  23  -3.813   3.326   3.326
  169   1HB   TYR  23           HB2      TYR  23  -1.571   4.312   4.312
  170   2HB   TYR  23           HB1      TYR  23  -1.421   2.669   2.669
  171    HD1  TYR  23           HD2      TYR  23  -1.236   6.276   6.276
  172    HD2  TYR  23           HD1      TYR  23  -0.725   2.231   2.231
  173    HE1  TYR  23           HE2      TYR  23  -0.057   7.154   7.154
  174    HE2  TYR  23           HE1      TYR  23   0.456   3.108   3.108
  175    HH   TYR  23           HH       TYR  23   0.499   6.491   6.491
  176    H    ALA  24           HN       ALA  24  -3.369   5.858   5.858
  177    HA   ALA  24           HA       ALA  24  -4.455   7.340   7.340
  178   1HB   ALA  24           HB2      ALA  24  -5.349   7.427   7.427
  179   2HB   ALA  24           HB1      ALA  24  -5.922   8.536   8.536
  180   3HB   ALA  24           HB3      ALA  24  -6.280   6.813   6.813
  181    H    SER  25           HN       SER  25  -3.312   9.218   9.218
  182    HA   SER  25           HA       SER  25  -1.615  10.308  10.308
  183   1HB   SER  25           HB2      SER  25  -0.223   9.122   9.122
  184   2HB   SER  25           HB1      SER  25  -1.007   9.889   9.889
  185    HG   SER  25           HG       SER  25   0.505  11.329  11.329
  186    HA   PRO  26           HA       PRO  26  -3.539  14.176  14.176
  187   1HB   PRO  26           HB2      PRO  26  -1.563  15.899  15.899
  188   2HB   PRO  26           HB1      PRO  26  -2.567  14.985  14.985
  189   1HG   PRO  26           HG2      PRO  26   0.195  14.411  14.411
  190   2HG   PRO  26           HG1      PRO  26  -0.479  14.268  14.268
  191   1HD   PRO  26           HD2      PRO  26  -0.126  12.125  12.125
  192   2HD   PRO  26           HD1      PRO  26  -1.442  12.223  12.223
  193    H    GLY  27           HN       GLY  27  -0.599  13.206  13.206
  194   1HA   GLY  27           HA2      GLY  27  -1.255  14.848  14.848
  195   2HA   GLY  27           HA1      GLY  27   0.252  15.308  15.308
  196    H    LYS  28           HN       LYS  28   1.154  14.626  14.626
  197    HA   LYS  28           HA       LYS  28   1.437  11.652  11.652
  198   1HB   LYS  28           HB2      LYS  28   1.886  13.915  13.915
  199   2HB   LYS  28           HB1      LYS  28   2.033  12.198  12.198
  200   1HG   LYS  28           HG2      LYS  28  -0.497  13.535  13.535
  201   2HG   LYS  28           HG1      LYS  28  -0.175  13.133  13.133
  202   1HD   LYS  28           HD2      LYS  28   0.080  10.739  10.739
  203   2HD   LYS  28           HD1      LYS  28  -0.361  11.175  11.175
  204   1HE   LYS  28           HE2      LYS  28  -2.511  12.169  12.169
  205   2HE   LYS  28           HE1      LYS  28  -2.089  11.348  11.348
  206   1HZ   LYS  28           HZ1      LYS  28  -1.768   9.295   9.295
  207   2HZ   LYS  28           HZ3      LYS  28  -2.489  10.121  10.121
  208   3HZ   LYS  28           HZ2      LYS  28  -3.377   9.825   9.825
  209    H    ALA  29           HN       ALA  29   3.443  10.776  10.776
  210    HA   ALA  29           HA       ALA  29   5.880  12.465  12.465
  211   1HB   ALA  29           HB3      ALA  29   4.805  12.524  12.524
  212   2HB   ALA  29           HB2      ALA  29   5.319  10.842  10.842
  213   3HB   ALA  29           HB1      ALA  29   6.518  12.115  12.115
  214    H    THR  30           HN       THR  30   7.820  11.145  11.145
  215    HA   THR  30           HA       THR  30   7.340   8.507   8.507
  216    HB   THR  30           HB       THR  30   9.734   8.572   8.572
  217    HG1  THR  30           HG1      THR  30   9.787  10.807  10.807
  218   1HG2  THR  30          HG22      THR  30   8.009  10.554  10.554
  219   2HG2  THR  30          HG21      THR  30   9.416  11.441  11.441
  220   3HG2  THR  30          HG23      THR  30   9.614  10.207  10.207
  221    H    GLU  31           HN       GLU  31   8.727   9.803   9.803
  222    HA   GLU  31           HA       GLU  31   9.820   7.269   7.269
  223   1HB   GLU  31           HB2      GLU  31   9.266   9.893   9.893
  224   2HB   GLU  31           HB1      GLU  31  10.298   8.612   8.612
  225   1HG   GLU  31           HG2      GLU  31  10.838   9.719   9.719
  226   2HG   GLU  31           HG1      GLU  31  11.353  10.637  10.637
  227    H    VAL  32           HN       VAL  32   8.145   5.736   5.736
  228    HA   VAL  32           HA       VAL  32   6.096   6.380   6.380
  229    HB   VAL  32           HB       VAL  32   6.108   4.375   4.375
  230   1HG1  VAL  32          HG13      VAL  32   4.454   4.627   4.627
  231   2HG1  VAL  32          HG12      VAL  32   3.528   4.500   4.500
  232   3HG1  VAL  32          HG11      VAL  32   4.684   3.241   3.241
  233   1HG2  VAL  32          HG23      VAL  32   4.957   7.095   7.095
  234   2HG2  VAL  32          HG22      VAL  32   5.565   6.360   6.360
  235   3HG2  VAL  32          HG21      VAL  32   3.965   5.929   5.929
  236    H    ARG  33           HN       ARG  33   7.704   5.857   5.857
  237    HA   ARG  33           HA       ARG  33   9.246   3.465   3.465
  238   1HB   ARG  33           HB2      ARG  33   9.433   5.575   5.575
  239   2HB   ARG  33           HB1      ARG  33   8.064   4.975   4.975
  240   1HG   ARG  33           HG2      ARG  33   9.303   2.949   2.949
  241   2HG   ARG  33           HG1      ARG  33  10.663   3.472   3.472
  242   1HD   ARG  33           HD2      ARG  33  10.971   5.455   5.455
  243   2HD   ARG  33           HD1      ARG  33   9.602   4.938   4.938
  244    HE   ARG  33           HE       ARG  33  12.261   3.705   3.705
  245   1HH1  ARG  33          HH21      ARG  33   8.863   3.222   3.222
  246   2HH1  ARG  33          HH22      ARG  33   9.169   1.937   1.937
  247   1HH2  ARG  33          HH11      ARG  33  12.607   2.034   2.034
  248   2HH2  ARG  33          HH12      ARG  33  11.263   1.268   1.268
  249    H    VAL  34           HN       VAL  34   8.436   1.421   1.421
  250    HA   VAL  34           HA       VAL  34   5.947   0.913   0.913
  251    HB   VAL  34           HB       VAL  34   5.490  -0.848  -0.848
  252   1HG1  VAL  34          HG11      VAL  34   5.778   2.041   2.041
  253   2HG1  VAL  34          HG13      VAL  34   5.274   0.895   0.895
  254   3HG1  VAL  34          HG12      VAL  34   4.313   1.086   1.086
  255   1HG2  VAL  34          HG23      VAL  34   7.841  -1.238  -1.238
  256   2HG2  VAL  34          HG22      VAL  34   6.809  -0.887  -0.887
  257   3HG2  VAL  34          HG21      VAL  34   7.877   0.361   0.361
  258    H    THR  35           HN       THR  35   6.081  -0.652  -0.652
  259    HA   THR  35           HA       THR  35   8.547  -2.367  -2.367
  260    HB   THR  35           HB       THR  35   6.855  -1.291  -1.291
  261    HG1  THR  35           HG1      THR  35   8.719   0.035   0.035
  262   1HG2  THR  35          HG22      THR  35   9.439  -2.869  -2.869
  263   2HG2  THR  35          HG21      THR  35   8.900  -2.019  -2.019
  264   3HG2  THR  35          HG23      THR  35   7.931  -3.335  -3.335
  265    H    VAL  36           HN       VAL  36   8.083  -4.509  -4.509
  266    HA   VAL  36           HA       VAL  36   5.295  -5.433  -5.433
  267    HB   VAL  36           HB       VAL  36   7.685  -6.636  -6.636
  268   1HG1  VAL  36          HG11      VAL  36   4.937  -7.675  -7.675
  269   2HG1  VAL  36          HG13      VAL  36   5.678  -8.088  -8.088
  270   3HG1  VAL  36          HG12      VAL  36   6.473  -8.540  -8.540
  271   1HG2  VAL  36          HG22      VAL  36   5.208  -5.149  -5.149
  272   2HG2  VAL  36          HG21      VAL  36   6.887  -4.836  -4.836
  273   3HG2  VAL  36          HG23      VAL  36   6.050  -6.237  -6.237
  274    H    LEU  37           HN       LEU  37   4.877  -6.712  -6.712
  275    HA   LEU  37           HA       LEU  37   7.302  -7.835  -7.835
  276   1HB   LEU  37           HB2      LEU  37   4.734  -6.658  -6.658
  277   2HB   LEU  37           HB1      LEU  37   6.020  -7.361  -7.361
  278    HG   LEU  37           HG       LEU  37   6.488  -5.060  -5.060
  279   1HD1  LEU  37          HD13      LEU  37   4.810  -4.809  -4.809
  280   2HD1  LEU  37          HD12      LEU  37   6.329  -4.687  -4.687
  281   3HD1  LEU  37          HD11      LEU  37   5.973  -3.542  -3.542
  282   1HD2  LEU  37          HD23      LEU  37   8.032  -6.524  -6.524
  283   2HD2  LEU  37          HD22      LEU  37   8.565  -5.982  -5.982
  284   3HD2  LEU  37          HD21      LEU  37   8.375  -4.816  -4.816
  285    H    ARG  38           HN       ARG  38   6.732  -9.641  -9.641
  286    HA   ARG  38           HA       ARG  38   4.422 -11.282 -11.282
  287   1HB   ARG  38           HB2      ARG  38   6.648 -12.008 -12.008
  288   2HB   ARG  38           HB1      ARG  38   7.213 -12.204 -12.204
  289   1HG   ARG  38           HG2      ARG  38   5.373 -13.841 -13.841
  290   2HG   ARG  38           HG1      ARG  38   4.916 -13.697 -13.697
  291   1HD   ARG  38           HD2      ARG  38   7.164 -14.492 -14.492
  292   2HD   ARG  38           HD1      ARG  38   7.612 -14.656 -14.656
  293    HE   ARG  38           HE       ARG  38   5.120 -16.024 -16.024
  294   1HH1  ARG  38          HH21      ARG  38   8.598 -16.305 -16.305
  295   2HH1  ARG  38          HH22      ARG  38   8.559 -18.034 -18.034
  296   1HH2  ARG  38          HH11      ARG  38   5.117 -18.259 -18.259
  297   2HH2  ARG  38          HH12      ARG  38   6.611 -19.130 -19.130
  298    H    GLN  39           HN       GLN  39   3.061 -11.730 -11.730
  299    HA   GLN  39           HA       GLN  39   4.178 -11.559 -11.559
  300   1HB   GLN  39           HB2      GLN  39   1.465 -11.101 -11.101
  301   2HB   GLN  39           HB1      GLN  39   1.666 -11.259 -11.259
  302   1HG   GLN  39           HG2      GLN  39   3.070  -9.342  -9.342
  303   2HG   GLN  39           HG1      GLN  39   3.307  -9.317  -9.317
  304   1HE2  GLN  39          HE22      GLN  39  -0.576  -8.369  -8.369
  305   2HE2  GLN  39          HE21      GLN  39   0.037  -9.889  -9.889
  306    H    ALA  40           HN       ALA  40   4.188 -13.352 -13.352
  307    HA   ALA  40           HA       ALA  40   2.596 -15.737 -15.737
  308   1HB   ALA  40           HB1      ALA  40   5.318 -15.422 -15.422
  309   2HB   ALA  40           HB3      ALA  40   5.105 -16.136 -16.136
  310   3HB   ALA  40           HB2      ALA  40   4.515 -16.984 -16.984
  311    H    ASP  41           HN       ASP  41   2.072 -17.209 -17.209
  312    HA   ASP  41           HA       ASP  41   0.916 -15.862 -15.862
  313   1HB   ASP  41           HB2      ASP  41   1.728 -18.703 -18.703
  314   2HB   ASP  41           HB1      ASP  41   0.829 -18.241 -18.241
  315    H    SER  42           HN       SER  42   4.005 -17.631 -17.631
  316    HA   SER  42           HA       SER  42   4.752 -17.286 -17.286
  317   1HB   SER  42           HB2      SER  42   6.331 -17.842 -17.842
  318   2HB   SER  42           HB1      SER  42   6.987 -17.990 -17.990
  319    HG   SER  42           HG       SER  42   5.498 -19.597 -19.597
  320    H    GLN  43           HN       GLN  43   5.998 -15.678 -15.678
  321    HA   GLN  43           HA       GLN  43   6.325 -13.147 -13.147
  322   1HB   GLN  43           HB2      GLN  43   8.528 -14.831 -14.831
  323   2HB   GLN  43           HB1      GLN  43   8.734 -13.098 -13.098
  324   1HG   GLN  43           HG2      GLN  43   7.993 -15.094 -15.094
  325   2HG   GLN  43           HG1      GLN  43   9.591 -14.400 -14.400
  326   1HE2  GLN  43          HE22      GLN  43   7.660 -12.377 -12.377
  327   2HE2  GLN  43          HE21      GLN  43   8.001 -14.035 -14.035
  328    H    VAL  44           HN       VAL  44   7.524 -11.559 -11.559
  329    HA   VAL  44           HA       VAL  44   6.368 -11.862 -11.862
  330    HB   VAL  44           HB       VAL  44   6.355  -9.426  -9.426
  331   1HG1  VAL  44          HG12      VAL  44   6.600  -9.024  -9.024
  332   2HG1  VAL  44          HG11      VAL  44   5.006  -9.754  -9.754
  333   3HG1  VAL  44          HG13      VAL  44   5.194  -8.274  -8.274
  334   1HG2  VAL  44          HG23      VAL  44   4.726 -11.323 -11.323
  335   2HG2  VAL  44          HG22      VAL  44   3.989  -9.755  -9.755
  336   3HG2  VAL  44          HG21      VAL  44   3.991 -11.002 -11.002
  337    H    THR  45           HN       THR  45   7.812 -11.262 -11.262
  338    HA   THR  45           HA       THR  45  10.297  -9.785  -9.785
  339    HB   THR  45           HB       THR  45  11.553 -11.410 -11.410
  340    HG1  THR  45           HG1      THR  45  10.532 -12.967 -12.967
  341   1HG2  THR  45          HG22      THR  45  11.144 -11.791 -11.791
  342   2HG2  THR  45          HG21      THR  45   9.801 -12.842 -12.842
  343   3HG2  THR  45          HG23      THR  45  11.447 -13.263 -13.263
  344    H    GLU  46           HN       GLU  46  11.400  -8.765  -8.765
  345    HA   GLU  46           HA       GLU  46   9.517  -7.583  -7.583
  346   1HB   GLU  46           HB2      GLU  46  12.481  -7.343  -7.343
  347   2HB   GLU  46           HB1      GLU  46  11.672  -6.419  -6.419
  348   1HG   GLU  46           HG2      GLU  46  10.280  -5.289  -5.289
  349   2HG   GLU  46           HG1      GLU  46  10.745  -6.390  -6.390
  350    H    VAL  47           HN       VAL  47   9.731  -7.658  -7.658
  351    HA   VAL  47           HA       VAL  47  11.053 -10.150 -10.150
  352    HB   VAL  47           HB       VAL  47   8.479  -8.744  -8.744
  353   1HG1  VAL  47          HG12      VAL  47  10.057 -10.903 -10.903
  354   2HG1  VAL  47          HG11      VAL  47   8.299 -11.060 -11.060
  355   3HG1  VAL  47          HG13      VAL  47   9.048  -9.647  -9.647
  356   1HG2  VAL  47          HG23      VAL  47   9.201 -11.108 -11.108
  357   2HG2  VAL  47          HG22      VAL  47   7.885  -9.952  -9.952
  358   3HG2  VAL  47          HG21      VAL  47   7.753 -11.237 -11.237
  359    H    CYS  48           HN       CYS  48   9.570  -7.807  -7.807
  360    HA   CYS  48           HA       CYS  48  12.318  -6.962  -6.962
  361   1HB   CYS  48           HB2      CYS  48   9.784  -7.634  -7.634
  362   2HB   CYS  48           HB1      CYS  48  11.185  -6.879  -6.879
  363    H    ALA  49           HN       ALA  49  12.598  -4.737  -4.737
  364    HA   ALA  49           HA       ALA  49  10.243  -2.937  -2.937
  365   1HB   ALA  49           HB3      ALA  49  11.467  -3.675  -3.675
  366   2HB   ALA  49           HB2      ALA  49  12.307  -2.173  -2.173
  367   3HB   ALA  49           HB1      ALA  49  10.551  -2.184  -2.184
  368    H    ALA  50           HN       ALA  50  10.635  -1.072  -1.072
  369    HA   ALA  50           HA       ALA  50  13.187   0.238   0.238
  370   1HB   ALA  50           HB2      ALA  50  13.277  -2.024  -2.024
  371   2HB   ALA  50           HB1      ALA  50  12.315  -1.127  -1.127
  372   3HB   ALA  50           HB3      ALA  50  13.920  -0.551  -0.551
  373    H    THR  51           HN       THR  51  12.948   2.182   2.182
  374    HA   THR  51           HA       THR  51  10.181   3.142   3.142
  375    HB   THR  51           HB       THR  51  12.581   4.509   4.509
  376    HG1  THR  51           HG1      THR  51  13.503   4.326   4.326
  377   1HG2  THR  51          HG21      THR  51   9.923   5.243   5.243
  378   2HG2  THR  51          HG23      THR  51  11.249   6.354   6.354
  379   3HG2  THR  51          HG22      THR  51  10.842   5.962   5.962
  380    H    TYR  52           HN       TYR  52   8.855   2.696   2.696
  381    HA   TYR  52           HA       TYR  52   9.938   1.702   1.702
  382   1HB   TYR  52           HB2      TYR  52   7.799   0.973   0.973
  383   2HB   TYR  52           HB1      TYR  52   7.115   2.542   2.542
  384    HD1  TYR  52           HD2      TYR  52   7.164   3.233   3.233
  385    HD2  TYR  52           HD1      TYR  52   7.801  -0.816  -0.816
  386    HE1  TYR  52           HE2      TYR  52   6.637   2.372   2.372
  387    HE2  TYR  52           HE1      TYR  52   7.279  -1.685  -1.685
  388    HH   TYR  52           HH       TYR  52   7.457  -0.244  -0.244
  389    H    MET  53           HN       MET  53  10.873   3.247   3.247
  390    HA   MET  53           HA       MET  53   9.934   6.026   6.026
  391   1HB   MET  53           HB2      MET  53  11.805   4.489   4.489
  392   2HB   MET  53           HB1      MET  53  11.669   6.245   6.245
  393   1HG   MET  53           HG2      MET  53  12.160   5.011   5.011
  394   2HG   MET  53           HG1      MET  53  13.439   4.658   4.658
  395   1HE   MET  53           HE2      MET  53  11.513   7.153   7.153
  396   2HE   MET  53           HE1      MET  53  11.988   8.745   8.745
  397   3HE   MET  53           HE3      MET  53  10.981   7.690   7.690
  398    H    MET  54           HN       MET  54   8.634   6.918   6.918
  399    HA   MET  54           HA       MET  54   6.804   5.089   5.089
  400   1HB   MET  54           HB2      MET  54   6.864   7.744   7.744
  401   2HB   MET  54           HB1      MET  54   7.167   7.804   7.804
  402   1HG   MET  54           HG2      MET  54   4.890   7.714   7.714
  403   2HG   MET  54           HG1      MET  54   5.146   5.983   5.983
  404   1HE   MET  54           HE2      MET  54   5.151   4.759   4.759
  405   2HE   MET  54           HE1      MET  54   6.147   5.847   5.847
  406   3HE   MET  54           HE3      MET  54   4.570   5.320   5.320
  407    H    GLY  55           HN       GLY  55   9.978   6.149   6.149
  408   1HA   GLY  55           HA2      GLY  55   9.525   5.129   5.129
  409   2HA   GLY  55           HA1      GLY  55  10.686   6.399   6.399
  410    H    ASN  56           HN       ASN  56  11.237   4.631   4.631
  411    HA   ASN  56           HA       ASN  56  13.007   2.638   2.638
  412   1HB   ASN  56           HB2      ASN  56  13.598   4.529   4.529
  413   2HB   ASN  56           HB1      ASN  56  14.704   3.277   3.277
  414   1HD2  ASN  56          HD22      ASN  56  14.820   6.783   6.783
  415   2HD2  ASN  56          HD21      ASN  56  14.223   6.522   6.522
  416    H    GLU  57           HN       GLU  57  13.623   0.808   0.808
  417    HA   GLU  57           HA       GLU  57  11.678   0.301   0.301
  418   1HB   GLU  57           HB2      GLU  57  11.245  -0.942  -0.942
  419   2HB   GLU  57           HB1      GLU  57  12.864  -1.634  -1.634
  420   1HG   GLU  57           HG2      GLU  57  12.312  -2.707  -2.707
  421   2HG   GLU  57           HG1      GLU  57  10.719  -1.950  -1.950
  422    H    LEU  58           HN       LEU  58  12.712  -0.029  -0.029
  423    HA   LEU  58           HA       LEU  58  15.634  -0.369  -0.369
  424   1HB   LEU  58           HB2      LEU  58  13.436  -0.098  -0.098
  425   2HB   LEU  58           HB1      LEU  58  15.136  -0.268  -0.268
  426    HG   LEU  58           HG       LEU  58  14.007   1.920   1.920
  427   1HD1  LEU  58          HD12      LEU  58  13.597   1.733   1.733
  428   2HD1  LEU  58          HD11      LEU  58  15.215   2.436   2.436
  429   3HD1  LEU  58          HD13      LEU  58  13.901   3.280   3.280
  430   1HD2  LEU  58          HD22      LEU  58  16.764   1.276   1.276
  431   2HD2  LEU  58          HD21      LEU  58  16.287   1.551   1.551
  432   3HD2  LEU  58          HD23      LEU  58  16.328   2.899   2.899
  433    H    THR  59           HN       THR  59  16.513  -2.017  -2.017
  434    HA   THR  59           HA       THR  59  15.202  -4.655  -4.655
  435    HB   THR  59           HB       THR  59  17.533  -5.430  -5.430
  436    HG1  THR  59           HG1      THR  59  18.336  -2.744  -2.744
  437   1HG2  THR  59          HG21      THR  59  16.643  -4.771  -4.771
  438   2HG2  THR  59          HG23      THR  59  17.347  -3.172  -3.172
  439   3HG2  THR  59          HG22      THR  59  18.392  -4.589  -4.589
  440    H    PHE  60           HN       PHE  60  15.401  -6.148  -6.148
  441    HA   PHE  60           HA       PHE  60  15.250  -4.690  -4.690
  442   1HB   PHE  60           HB2      PHE  60  14.369  -7.443  -7.443
  443   2HB   PHE  60           HB1      PHE  60  14.092  -6.798  -6.798
  444    HD1  PHE  60           HD1      PHE  60  13.357  -4.015  -4.015
  445    HD2  PHE  60           HD2      PHE  60  12.328  -7.434  -7.434
  446    HE1  PHE  60           HE1      PHE  60  11.328  -2.809  -2.809
  447    HE2  PHE  60           HE2      PHE  60  10.291  -6.225  -6.225
  448    HZ   PHE  60           HZ       PHE  60   9.797  -3.918  -3.918
  449    H    LEU  61           HN       LEU  61  16.817  -4.962  -4.962
  450    HA   LEU  61           HA       LEU  61  19.343  -6.097  -6.097
  451   1HB   LEU  61           HB2      LEU  61  18.825  -4.329  -4.329
  452   2HB   LEU  61           HB1      LEU  61  18.045  -5.531  -5.531
  453    HG   LEU  61           HG       LEU  61  20.199  -6.785  -6.785
  454   1HD1  LEU  61          HD13      LEU  61  21.132  -4.421  -4.421
  455   2HD1  LEU  61          HD12      LEU  61  22.248  -5.428  -5.428
  456   3HD1  LEU  61          HD11      LEU  61  21.292  -6.136  -6.136
  457   1HD2  LEU  61          HD23      LEU  61  20.166  -3.881  -3.881
  458   2HD2  LEU  61          HD22      LEU  61  19.736  -5.294  -5.294
  459   3HD2  LEU  61          HD21      LEU  61  21.417  -5.015  -5.015
  460    H    ASP  62           HN       ASP  62  16.712  -7.540  -7.540
  461    HA   ASP  62           HA       ASP  62  18.091 -10.175 -10.175
  462   1HB   ASP  62           HB2      ASP  62  17.831 -10.571 -10.571
  463   2HB   ASP  62           HB1      ASP  62  18.788  -9.124  -9.124
  464    H    ASP  63           HN       ASP  63  16.459 -11.738 -11.738
  465    HA   ASP  63           HA       ASP  63  14.430 -12.929 -12.929
  466   1HB   ASP  63           HB2      ASP  63  13.462 -10.079 -10.079
  467   2HB   ASP  63           HB1      ASP  63  12.415 -11.442 -11.442
  468    H    SER  64           HN       SER  64  15.689 -13.267 -13.267
  469    HA   SER  64           HA       SER  64  15.446 -13.782 -13.782
  470   1HB   SER  64           HB2      SER  64  12.553 -13.568 -13.568
  471   2HB   SER  64           HB1      SER  64  13.070 -14.260 -14.260
  472    HG   SER  64           HG       SER  64  12.784 -15.600 -15.600
  473    H    ILE  67           HN       ILE  67  14.570 -12.880 -12.880
  474    HA   ILE  67           HA       ILE  67  14.673  -9.928  -9.928
  475    HB   ILE  67           HB       ILE  67  14.742 -11.983 -11.983
  476   1HG1  ILE  67          HG12      ILE  67  16.899 -10.243 -10.243
  477   2HG1  ILE  67          HG11      ILE  67  16.659 -11.954 -11.954
  478   1HG2  ILE  67          HG21      ILE  67  15.142  -8.971  -8.971
  479   2HG2  ILE  67          HG23      ILE  67  15.574 -10.048 -10.048
  480   3HG2  ILE  67          HG22      ILE  67  13.887  -9.878  -9.878
  481   1HD1  ILE  67          HD13      ILE  67  16.890 -12.375 -12.375
  482   2HD1  ILE  67          HD12      ILE  67  17.434 -10.705 -10.705
  483   3HD1  ILE  67          HD11      ILE  67  18.361 -11.856 -11.856
  484    H    CYS  68           HN       CYS  68  12.458  -9.637  -9.637
  485    HA   CYS  68           HA       CYS  68  10.103 -10.645 -10.645
  486   1HB   CYS  68           HB2      CYS  68  10.477  -8.163  -8.163
  487   2HB   CYS  68           HB1      CYS  68   8.962  -9.008  -9.008
  488    H    THR  69           HN       THR  69   8.706  -9.497  -9.497
  489    HA   THR  69           HA       THR  69   9.863  -7.048  -7.048
  490    HB   THR  69           HB       THR  69  10.372  -9.098  -9.098
  491    HG1  THR  69           HG1      THR  69  10.043  -7.904  -7.904
  492   1HG2  THR  69          HG21      THR  69   7.839  -9.924  -9.924
  493   2HG2  THR  69          HG23      THR  69   7.646  -9.624  -9.624
  494   3HG2  THR  69          HG22      THR  69   8.875 -10.754 -10.754
  495    H    GLY  70           HN       GLY  70   8.229  -5.577  -5.577
  496   1HA   GLY  70           HA2      GLY  70   5.412  -6.310  -6.310
  497   2HA   GLY  70           HA1      GLY  70   5.902  -5.236  -5.236
  498    H    THR  71           HN       THR  71   4.051  -4.193  -4.193
  499    HA   THR  71           HA       THR  71   5.436  -2.241  -2.241
  500    HB   THR  71           HB       THR  71   2.787  -3.606  -3.606
  501    HG1  THR  71           HG1      THR  71   3.869  -5.017  -5.017
  502   1HG2  THR  71          HG21      THR  71   4.114  -1.395  -1.395
  503   2HG2  THR  71          HG23      THR  71   3.080  -2.529  -2.529
  504   3HG2  THR  71          HG22      THR  71   2.420  -1.581  -1.581
  505    H    SER  72           HN       SER  72   4.098  -0.212  -0.212
  506    HA   SER  72           HA       SER  72   2.127   0.303   0.303
  507   1HB   SER  72           HB2      SER  72   4.382   0.668   0.668
  508   2HB   SER  72           HB1      SER  72   4.733   1.821   1.821
  509    HG   SER  72           HG       SER  72   3.596   3.260   3.260
  510    H    SER  73           HN       SER  73   0.819   0.526   0.526
  511    HA   SER  73           HA       SER  73   1.174   3.247   3.247
  512   1HB   SER  73           HB2      SER  73   0.393   0.614   0.614
  513   2HB   SER  73           HB1      SER  73   0.349   2.171   2.171
  514    HG   SER  73           HG       SER  73   2.330   0.795   0.795
  515    H    GLY  74           HN       GLY  74  -0.764   4.407   4.407
  516   1HA   GLY  74           HA2      GLY  74  -3.040   4.951   4.951
  517   2HA   GLY  74           HA1      GLY  74  -3.387   3.223   3.223
  518    H    ASN  75           HN       ASN  75  -1.314   4.832   4.832
  519    HA   ASN  75           HA       ASN  75  -1.432   4.899   4.899
  520   1HB   ASN  75           HB2      ASN  75  -4.382   4.992   4.992
  521   2HB   ASN  75           HB1      ASN  75  -3.737   5.357   5.357
  522   1HD2  ASN  75          HD22      ASN  75  -1.898   8.273   8.273
  523   2HD2  ASN  75          HD21      ASN  75  -1.443   6.857   6.857
  524    H    GLN  76           HN       GLN  76  -1.617   2.257   2.257
  525    HA   GLN  76           HA       GLN  76  -2.682   0.603   0.603
  526   1HB   GLN  76           HB2      GLN  76  -2.849   0.279   0.279
  527   2HB   GLN  76           HB1      GLN  76  -3.199  -1.041  -1.041
  528   1HG   GLN  76           HG2      GLN  76  -4.968   0.264   0.264
  529   2HG   GLN  76           HG1      GLN  76  -4.584   1.653   1.653
  530   1HE2  GLN  76          HE22      GLN  76  -6.281  -1.616  -1.616
  531   2HE2  GLN  76          HE21      GLN  76  -5.229  -1.868  -1.868
  532    H    VAL  77           HN       VAL  77  -0.994  -0.586  -0.586
  533    HA   VAL  77           HA       VAL  77   1.449  -0.935  -0.935
  534    HB   VAL  77           HB       VAL  77   2.611  -1.043  -1.043
  535   1HG1  VAL  77          HG13      VAL  77   1.056   1.141   1.141
  536   2HG1  VAL  77          HG12      VAL  77   0.700   0.865   0.865
  537   3HG1  VAL  77          HG11      VAL  77   2.366   1.112   1.112
  538   1HG2  VAL  77          HG23      VAL  77   0.031  -1.927  -1.927
  539   2HG2  VAL  77          HG22      VAL  77   1.666  -2.432  -2.432
  540   3HG2  VAL  77          HG21      VAL  77   1.016  -0.919  -0.919
  541    H    ASN  78           HN       ASN  78   1.684  -2.868  -2.868
  542    HA   ASN  78           HA       ASN  78   0.256  -5.248  -5.248
  543   1HB   ASN  78           HB2      ASN  78   0.057  -4.402  -4.402
  544   2HB   ASN  78           HB1      ASN  78   1.750  -4.829  -4.829
  545    HD2  ASN  78          HD22      ASN  78  -0.913  -6.280  -6.280
  546    H    LEU  79           HN       LEU  79   1.566  -6.231  -6.231
  547    HA   LEU  79           HA       LEU  79   4.483  -6.530  -6.530
  548   1HB   LEU  79           HB2      LEU  79   2.614  -7.110  -7.110
  549   2HB   LEU  79           HB1      LEU  79   4.319  -7.555  -7.555
  550    HG   LEU  79           HG       LEU  79   3.292  -4.734  -4.734
  551   1HD1  LEU  79          HD12      LEU  79   4.130  -6.245  -6.245
  552   2HD1  LEU  79          HD11      LEU  79   4.486  -4.521  -4.521
  553   3HD1  LEU  79          HD13      LEU  79   2.818  -5.085  -5.085
  554   1HD2  LEU  79          HD22      LEU  79   6.030  -5.992  -5.992
  555   2HD2  LEU  79          HD21      LEU  79   5.431  -4.907  -4.907
  556   3HD2  LEU  79          HD23      LEU  79   5.774  -4.284  -4.284
  557    H    THR  80           HN       THR  80   5.339  -8.445  -8.445
  558    HA   THR  80           HA       THR  80   3.543 -10.853 -10.853
  559    HB   THR  80           HB       THR  80   5.703  -9.937  -9.937
  560    HG1  THR  80           HG1      THR  80   2.889  -9.945  -9.945
  561   1HG2  THR  80          HG23      THR  80   4.868 -12.474 -12.474
  562   2HG2  THR  80          HG22      THR  80   3.610 -11.911 -11.911
  563   3HG2  THR  80          HG21      THR  80   5.304 -11.830 -11.830
  564    H    ILE  81           HN       ILE  81   4.440 -12.789 -12.789
  565    HA   ILE  81           HA       ILE  81   7.309 -12.737 -12.737
  566    HB   ILE  81           HB       ILE  81   4.860 -14.149 -14.149
  567   1HG1  ILE  81          HG12      ILE  81   6.587 -12.085 -12.085
  568   2HG1  ILE  81          HG11      ILE  81   5.208 -11.617 -11.617
  569   1HG2  ILE  81          HG23      ILE  81   7.007 -15.462 -15.462
  570   2HG2  ILE  81          HG22      ILE  81   7.690 -14.100 -14.100
  571   3HG2  ILE  81          HG21      ILE  81   6.314 -14.984 -14.984
  572   1HD1  ILE  81          HD11      ILE  81   3.985 -13.483 -13.483
  573   2HD1  ILE  81          HD13      ILE  81   5.252 -13.058 -13.058
  574   3HD1  ILE  81          HD12      ILE  81   4.137 -11.821 -11.821
  575    H    GLN  82           HN       GLN  82   8.582 -14.463 -14.463
  576    HA   GLN  82           HA       GLN  82   7.178 -16.682 -16.682
  577   1HB   GLN  82           HB2      GLN  82   9.814 -15.335 -15.335
  578   2HB   GLN  82           HB1      GLN  82   9.111 -16.702 -16.702
  579   1HG   GLN  82           HG2      GLN  82   7.177 -15.369 -15.369
  580   2HG   GLN  82           HG1      GLN  82   7.766 -14.007 -14.007
  581   1HE2  GLN  82          HE22      GLN  82  10.448 -13.284 -13.284
  582   2HE2  GLN  82          HE21      GLN  82  10.148 -13.326 -13.326
  583    H    GLY  83           HN       GLY  83   7.526 -18.546 -18.546
  584   1HA   GLY  83           HA2      GLY  83   9.234 -20.267 -20.267
  585   2HA   GLY  83           HA1      GLY  83  10.123 -18.975 -18.975
  586    H    LEU  84           HN       LEU  84   6.637 -19.092 -19.092
  587    HA   LEU  84           HA       LEU  84   6.847 -19.337 -19.337
  588   1HB   LEU  84           HB2      LEU  84   4.605 -19.026 -19.026
  589   2HB   LEU  84           HB1      LEU  84   4.312 -19.142 -19.142
  590    HG   LEU  84           HG       LEU  84   6.220 -17.133 -17.133
  591   1HD1  LEU  84          HD13      LEU  84   3.252 -17.003 -17.003
  592   2HD1  LEU  84          HD12      LEU  84   4.239 -15.545 -15.545
  593   3HD1  LEU  84          HD11      LEU  84   4.166 -16.458 -16.458
  594   1HD2  LEU  84          HD22      LEU  84   5.175 -17.807 -17.807
  595   2HD2  LEU  84          HD21      LEU  84   6.737 -17.135 -17.135
  596   3HD2  LEU  84          HD23      LEU  84   5.320 -16.090 -16.090
  597    H    ARG  85           HN       ARG  85   6.624 -21.172 -21.172
  598    HA   ARG  85           HA       ARG  85   5.769 -23.672 -23.672
  599   1HB   ARG  85           HB2      ARG  85   7.380 -23.043 -23.043
  600   2HB   ARG  85           HB1      ARG  85   6.905 -24.681 -24.681
  601   1HG   ARG  85           HG2      ARG  85   7.984 -24.348 -24.348
  602   2HG   ARG  85           HG1      ARG  85   8.532 -22.759 -22.759
  603   1HD   ARG  85           HD2      ARG  85  10.358 -24.262 -24.262
  604   2HD   ARG  85           HD1      ARG  85   9.659 -23.958 -23.958
  605    HE   ARG  85           HE       ARG  85   9.347 -26.448 -26.448
  606   1HH1  ARG  85          HH21      ARG  85   8.484 -24.621 -24.621
  607   2HH1  ARG  85          HH22      ARG  85   7.968 -26.029 -26.029
  608   1HH2  ARG  85          HH11      ARG  85   8.654 -28.227 -28.227
  609   2HH2  ARG  85          HH12      ARG  85   8.054 -28.043 -28.043
  610    H    ALA  86           HN       ALA  86   4.719 -25.222 -25.222
  611    HA   ALA  86           HA       ALA  86   2.153 -24.187 -24.187
  612   1HB   ALA  86           HB2      ALA  86   3.009 -26.600 -26.600
  613   2HB   ALA  86           HB1      ALA  86   3.656 -26.427 -26.427
  614   3HB   ALA  86           HB3      ALA  86   1.916 -26.310 -26.310
  615    H    MET  87           HN       MET  87   5.093 -24.687 -24.687
  616    HA   MET  87           HA       MET  87   4.107 -23.805 -23.805
  617   1HB   MET  87           HB2      MET  87   6.825 -23.988 -23.988
  618   2HB   MET  87           HB1      MET  87   6.615 -23.585 -23.585
  619   1HG   MET  87           HG2      MET  87   5.552 -26.092 -26.092
  620   2HG   MET  87           HG1      MET  87   7.018 -26.019 -26.019
  621   1HE   MET  87           HE2      MET  87   3.480 -25.741 -25.741
  622   2HE   MET  87           HE1      MET  87   3.334 -27.218 -27.218
  623   3HE   MET  87           HE3      MET  87   2.667 -25.699 -25.699
  624    H    ASP  88           HN       ASP  88   5.456 -22.047 -22.047
  625    HA   ASP  88           HA       ASP  88   6.033 -19.583 -19.583
  626   1HB   ASP  88           HB2      ASP  88   5.460 -20.320 -20.320
  627   2HB   ASP  88           HB1      ASP  88   5.962 -18.703 -18.703
  628    H    THR  89           HN       THR  89   2.994 -20.956 -20.956
  629    HA   THR  89           HA       THR  89   1.407 -18.750 -18.750
  630    HB   THR  89           HB       THR  89   0.732 -21.109 -21.109
  631    HG1  THR  89           HG1      THR  89   1.197 -22.141 -22.141
  632   1HG2  THR  89          HG21      THR  89  -0.873 -19.042 -19.042
  633   2HG2  THR  89          HG23      THR  89  -1.157 -19.800 -19.800
  634   3HG2  THR  89          HG22      THR  89  -1.506 -20.685 -20.685
  635    H    GLY  90           HN       GLY  90   0.482 -17.133 -17.133
  636   1HA   GLY  90           HA2      GLY  90  -0.032 -17.048 -17.048
  637   2HA   GLY  90           HA1      GLY  90   1.655 -16.559 -16.559
  638    H    LEU  91           HN       LEU  91   0.754 -14.491 -14.491
  639    HA   LEU  91           HA       LEU  91  -0.844 -12.845 -12.845
  640   1HB   LEU  91           HB2      LEU  91  -1.315 -13.003 -13.003
  641   2HB   LEU  91           HB1      LEU  91   0.276 -12.318 -12.318
  642    HG   LEU  91           HG       LEU  91  -0.455 -10.354 -10.354
  643   1HD1  LEU  91          HD11      LEU  91  -3.132 -11.649 -11.649
  644   2HD1  LEU  91          HD13      LEU  91  -2.922 -10.027 -10.027
  645   3HD1  LEU  91          HD12      LEU  91  -2.406 -11.433 -11.433
  646   1HD2  LEU  91          HD22      LEU  91  -0.407 -10.605 -10.605
  647   2HD2  LEU  91          HD21      LEU  91  -1.158  -9.191  -9.191
  648   3HD2  LEU  91          HD23      LEU  91  -2.161 -10.524 -10.524
  649    H    TYR  92           HN       TYR  92  -0.009 -11.294 -11.294
  650    HA   TYR  92           HA       TYR  92   2.808 -10.384 -10.384
  651   1HB   TYR  92           HB2      TYR  92   1.204 -10.917 -10.917
  652   2HB   TYR  92           HB1      TYR  92   2.696  -9.976  -9.976
  653    HD1  TYR  92           HD2      TYR  92   1.229 -13.337 -13.337
  654    HD2  TYR  92           HD1      TYR  92   4.864 -10.993 -10.993
  655    HE1  TYR  92           HE2      TYR  92   2.588 -15.439 -15.439
  656    HE2  TYR  92           HE1      TYR  92   6.223 -13.087 -13.087
  657    HH   TYR  92           HH       TYR  92   5.491 -15.770 -15.770
  658    H    ILE  93           HN       ILE  93   3.035  -8.165  -8.165
  659    HA   ILE  93           HA       ILE  93   0.553  -6.537  -6.537
  660    HB   ILE  93           HB       ILE  93   3.290  -6.107  -6.107
  661   1HG1  ILE  93          HG12      ILE  93   1.807  -6.222  -6.222
  662   2HG1  ILE  93          HG11      ILE  93   0.611  -6.981  -6.981
  663   1HG2  ILE  93          HG21      ILE  93   1.279  -4.167  -4.167
  664   2HG2  ILE  93          HG23      ILE  93   1.268  -4.390  -4.390
  665   3HG2  ILE  93          HG22      ILE  93   2.758  -3.934  -3.934
  666   1HD1  ILE  93          HD12      ILE  93   3.361  -8.061  -8.061
  667   2HD1  ILE  93          HD11      ILE  93   2.537  -8.366  -8.366
  668   3HD1  ILE  93          HD13      ILE  93   1.821  -8.914  -8.914
  669    H    CYS  94           HN       CYS  94   0.309  -4.797  -4.797
  670    HA   CYS  94           HA       CYS  94   2.505  -4.151  -4.151
  671   1HB   CYS  94           HB2      CYS  94   0.682  -3.401  -3.401
  672   2HB   CYS  94           HB1      CYS  94   0.244  -4.993  -4.993
  673    H    LYS  95           HN       LYS  95   3.613  -2.440  -2.440
  674    HA   LYS  95           HA       LYS  95   2.056  -0.359  -0.359
  675   1HB   LYS  95           HB2      LYS  95   4.986  -1.105  -1.105
  676   2HB   LYS  95           HB1      LYS  95   4.317   0.184   0.184
  677   1HG   LYS  95           HG2      LYS  95   2.743  -2.147  -2.147
  678   2HG   LYS  95           HG1      LYS  95   4.435  -2.636  -2.636
  679   1HD   LYS  95           HD2      LYS  95   4.920  -0.903  -0.903
  680   2HD   LYS  95           HD1      LYS  95   3.287  -0.252  -0.252
  681   1HE   LYS  95           HE2      LYS  95   2.354  -2.387  -2.387
  682   2HE   LYS  95           HE1      LYS  95   3.999  -3.001  -3.001
  683   1HZ   LYS  95           HZ2      LYS  95   4.466  -0.957  -0.957
  684   2HZ   LYS  95           HZ1      LYS  95   2.800  -0.624  -0.624
  685   3HZ   LYS  95           HZ3      LYS  95   3.371  -2.031  -2.031
  686    H    VAL  96           HN       VAL  96   2.108   1.781   1.781
  687    HA   VAL  96           HA       VAL  96   3.766   2.348   2.348
  688    HB   VAL  96           HB       VAL  96   0.871   3.159   3.159
  689   1HG1  VAL  96          HG13      VAL  96   2.697   4.149   4.149
  690   2HG1  VAL  96          HG12      VAL  96   2.083   2.794   2.794
  691   3HG1  VAL  96          HG11      VAL  96   0.977   4.040   4.040
  692   1HG2  VAL  96          HG21      VAL  96   2.017   0.689   0.689
  693   2HG2  VAL  96          HG23      VAL  96   0.819   0.754   0.754
  694   3HG2  VAL  96          HG22      VAL  96   0.390   1.290   1.290
  695    H    GLU  97           HN       GLU  97   5.123   3.979   3.979
  696    HA   GLU  97           HA       GLU  97   3.883   6.265   6.265
  697   1HB   GLU  97           HB2      GLU  97   6.587   4.942   4.942
  698   2HB   GLU  97           HB1      GLU  97   6.023   6.367   6.367
  699   1HG   GLU  97           HG2      GLU  97   4.165   5.070   5.070
  700   2HG   GLU  97           HG1      GLU  97   4.630   3.660   3.660
  701    H    LEU  98           HN       LEU  98   4.314   8.232   8.232
  702    HA   LEU  98           HA       LEU  98   6.216   8.462   8.462
  703   1HB   LEU  98           HB2      LEU  98   4.612  10.632  10.632
  704   2HB   LEU  98           HB1      LEU  98   5.175  10.635  10.635
  705    HG   LEU  98           HG       LEU  98   2.925   9.015   9.015
  706   1HD1  LEU  98          HD11      LEU  98   3.210  11.188  11.188
  707   2HD1  LEU  98          HD13      LEU  98   1.870  10.049  10.049
  708   3HD1  LEU  98          HD12      LEU  98   2.049  11.033  11.033
  709   1HD2  LEU  98          HD23      LEU  98   4.370   8.612   8.612
  710   2HD2  LEU  98          HD22      LEU  98   4.077   7.425   7.425
  711   3HD2  LEU  98          HD21      LEU  98   2.734   8.015   8.015
  712    H    MET  99           HN       MET  99   8.031   7.863   7.863
  713    HA   MET  99           HA       MET  99   8.527   9.451   9.451
  714   1HB   MET  99           HB2      MET  99   9.105   7.048   7.048
  715   2HB   MET  99           HB1      MET  99  10.375   7.587   7.587
  716   1HG   MET  99           HG2      MET  99  11.759   8.113   8.113
  717   2HG   MET  99           HG1      MET  99  10.483   8.962   8.962
  718   1HE   MET  99           HE1      MET  99   8.758   7.985   7.985
  719   2HE   MET  99           HE3      MET  99   8.210   6.705   6.705
  720   3HE   MET  99           HE2      MET  99   8.639   6.324   6.324
  721    H    TYR 100           HN       TYR 100  10.028   9.387   9.387
  722    HA   TYR 100           HA       TYR 100  12.097  11.273  11.273
  723   1HB   TYR 100           HB2      TYR 100  10.941  10.222  10.222
  724   2HB   TYR 100           HB1      TYR 100  12.256  11.394  11.394
  725    HD1  TYR 100           HD1      TYR 100  11.233   7.970   7.970
  726    HD2  TYR 100           HD2      TYR 100  14.506  10.770  10.770
  727    HE1  TYR 100           HE1      TYR 100  12.869   6.134   6.134
  728    HE2  TYR 100           HE2      TYR 100  16.144   8.926   8.926
  729    HH   TYR 100           HH       TYR 100  15.756   5.996   5.996
  730    HA   PRO 101           HA       PRO 101   9.361  14.627  14.627
  731   1HB   PRO 101           HB2      PRO 101   6.762  14.130  14.130
  732   2HB   PRO 101           HB1      PRO 101   8.106  13.657  13.657
  733   1HG   PRO 101           HG2      PRO 101   6.519  11.985  11.985
  734   2HG   PRO 101           HG1      PRO 101   7.138  11.600  11.600
  735   1HD   PRO 101           HD2      PRO 101   8.287  10.817  10.817
  736   2HD   PRO 101           HD1      PRO 101   9.123  10.888  10.888
  737    HA   PRO 102           HA       PRO 102   7.568  15.593  15.593
  738   1HB   PRO 102           HB2      PRO 102   8.139  18.280  18.280
  739   2HB   PRO 102           HB1      PRO 102   9.324  16.988  16.988
  740   1HG   PRO 102           HG2      PRO 102   8.898  18.708  18.708
  741   2HG   PRO 102           HG1      PRO 102  10.263  17.678  17.678
  742   1HD   PRO 102           HD2      PRO 102   8.040  17.226  17.226
  743   2HD   PRO 102           HD1      PRO 102   9.602  16.355  16.355
  744    HA   PRO 103           HA       PRO 103   6.723  16.474  16.474
  745   1HB   PRO 103           HB2      PRO 103   5.414  16.875  16.875
  746   2HB   PRO 103           HB1      PRO 103   6.515  18.085  18.085
  747   1HG   PRO 103           HG2      PRO 103   3.862  18.187  18.187
  748   2HG   PRO 103           HG1      PRO 103   4.748  19.118  19.118
  749   1HD   PRO 103           HD2      PRO 103   3.406  16.451  16.451
  750   2HD   PRO 103           HD1      PRO 103   3.113  17.938  17.938
  751    H    TYR 104           HN       TYR 104   5.815  14.391  14.391
  752    HA   TYR 104           HA       TYR 104   5.102  12.166  12.166
  753   1HB   TYR 104           HB2      TYR 104   7.042  12.253  12.253
  754   2HB   TYR 104           HB1      TYR 104   6.076  12.810  12.810
  755    HD1  TYR 104           HD2      TYR 104   4.885  10.265  10.265
  756    HD2  TYR 104           HD1      TYR 104   6.724  10.985  10.985
  757    HE1  TYR 104           HE2      TYR 104   4.427   7.912   7.912
  758    HE2  TYR 104           HE1      TYR 104   6.264   8.606   8.606
  759    HH   TYR 104           HH       TYR 104   5.810   6.443   6.443
  760    H    TYR 105           HN       TYR 105   2.918  11.500  11.500
  761    HA   TYR 105           HA       TYR 105   1.286  11.534  11.534
  762   1HB   TYR 105           HB2      TYR 105   1.057  13.834  13.834
  763   2HB   TYR 105           HB1      TYR 105   0.476  13.081  13.081
  764    HD1  TYR 105           HD1      TYR 105  -1.572  11.776  11.776
  765    HD2  TYR 105           HD2      TYR 105  -0.320  14.023  14.023
  766    HE1  TYR 105           HE1      TYR 105  -3.900  11.665  11.665
  767    HE2  TYR 105           HE2      TYR 105  -2.641  13.922  13.922
  768    HH   TYR 105           HH       TYR 105  -4.764  11.896  11.896
  769    H    LEU 106           HN       LEU 106   0.823   9.394   9.394
  770    HA   LEU 106           HA       LEU 106  -0.790   8.520   8.520
  771   1HB   LEU 106           HB2      LEU 106   1.961   8.362   8.362
  772   2HB   LEU 106           HB1      LEU 106   1.538   6.748   6.748
  773    HG   LEU 106           HG       LEU 106  -0.191   6.598   6.598
  774   1HD1  LEU 106          HD12      LEU 106   0.963   9.303   9.303
  775   2HD1  LEU 106          HD11      LEU 106   0.184   8.309   8.309
  776   3HD1  LEU 106          HD13      LEU 106  -0.731   8.855   8.855
  777   1HD2  LEU 106          HD23      LEU 106   2.718   6.981   6.981
  778   2HD2  LEU 106          HD22      LEU 106   1.745   5.513   5.513
  779   3HD2  LEU 106          HD21      LEU 106   1.628   6.723   6.723
  780    H    GLY 108           HN       GLY 108  -0.103   5.636   5.636
  781   1HA   GLY 108           HA2      GLY 108  -0.849   5.235   5.235
  782   2HA   GLY 108           HA1      GLY 108  -2.116   4.859   4.859
  783    H    ILE 109           HN       ILE 109  -1.565   2.684   2.684
  784    HA   ILE 109           HA       ILE 109   0.434   1.150   1.150
  785    HB   ILE 109           HB       ILE 109  -0.325   1.090   1.090
  786   1HG1  ILE 109          HG12      ILE 109   2.245   1.590   1.590
  787   2HG1  ILE 109          HG11      ILE 109   1.202   2.842   2.842
  788   1HG2  ILE 109          HG23      ILE 109   1.526  -0.752  -0.752
  789   2HG2  ILE 109          HG22      ILE 109   1.328  -0.726  -0.726
  790   3HG2  ILE 109          HG21      ILE 109  -0.014  -1.219  -1.219
  791   1HD1  ILE 109          HD12      ILE 109   1.662   0.961   0.961
  792   2HD1  ILE 109          HD11      ILE 109   3.214   1.318   1.318
  793   3HD1  ILE 109          HD13      ILE 109   2.234   2.624   2.624
  794    H    GLY 110           HN       GLY 110  -0.156  -1.204  -1.204
  795   1HA   GLY 110           HA2      GLY 110  -3.111  -1.632  -1.632
  796   2HA   GLY 110           HA1      GLY 110  -1.905  -2.609  -2.609
  797    H    ASN 111           HN       ASN 111  -4.030  -3.111  -3.111
  798    HA   ASN 111           HA       ASN 111  -2.590  -3.866  -3.866
  799   1HB   ASN 111           HB2      ASN 111  -5.174  -4.737  -4.737
  800   2HB   ASN 111           HB1      ASN 111  -4.624  -5.494  -5.494
  801    HD2  ASN 111          HD22      ASN 111  -4.058  -2.108  -2.108
  802    H    GLY 112           HN       GLY 112  -3.182  -5.644  -5.644
  803   1HA   GLY 112           HA2      GLY 112  -1.177  -7.147  -7.147
  804   2HA   GLY 112           HA1      GLY 112  -1.476  -7.849  -7.849
  805    H    THR 113           HN       THR 113  -1.592  -8.780  -8.780
  806    HA   THR 113           HA       THR 113  -4.351  -9.963  -9.963
  807    HB   THR 113           HB       THR 113  -2.196  -9.680  -9.680
  808    HG1  THR 113           HG1      THR 113  -3.026  -7.803  -7.803
  809   1HG2  THR 113          HG22      THR 113  -4.977 -10.855 -10.855
  810   2HG2  THR 113          HG21      THR 113  -4.194 -10.268 -10.268
  811   3HG2  THR 113          HG23      THR 113  -3.467 -11.595 -11.595
  812    H    GLN 114           HN       GLN 114  -4.477 -12.243 -12.243
  813    HA   GLN 114           HA       GLN 114  -1.933 -13.633 -13.633
  814   1HB   GLN 114           HB2      GLN 114  -3.907 -13.948 -13.948
  815   2HB   GLN 114           HB1      GLN 114  -4.822 -14.569 -14.569
  816   1HG   GLN 114           HG2      GLN 114  -3.724 -16.580 -16.580
  817   2HG   GLN 114           HG1      GLN 114  -2.205 -15.872 -15.872
  818   1HE2  GLN 114          HE22      GLN 114  -2.946 -17.443 -17.443
  819   2HE2  GLN 114          HE21      GLN 114  -1.972 -17.483 -17.483
  820    H    ILE 115           HN       ILE 115  -0.828 -14.621 -14.621
  821    HA   ILE 115           HA       ILE 115  -2.159 -15.072 -15.072
  822    HB   ILE 115           HB       ILE 115   0.639 -15.618 -15.618
  823   1HG1  ILE 115          HG12      ILE 115  -0.309 -13.560 -13.560
  824   2HG1  ILE 115          HG11      ILE 115  -0.190 -13.224 -13.224
  825   1HG2  ILE 115          HG22      ILE 115  -0.417 -15.824 -15.824
  826   2HG2  ILE 115          HG21      ILE 115   1.279 -15.947 -15.947
  827   3HG2  ILE 115          HG23      ILE 115   0.127 -17.172 -17.172
  828   1HD1  ILE 115          HD13      ILE 115   2.255 -14.212 -14.212
  829   2HD1  ILE 115          HD12      ILE 115   1.986 -13.707 -13.707
  830   3HD1  ILE 115          HD11      ILE 115   1.907 -12.520 -12.520
  831    H    TYR 116           HN       TYR 116  -3.228 -16.946 -16.946
  832    HA   TYR 116           HA       TYR 116  -3.021 -19.272 -19.272
  833   1HB   TYR 116           HB2      TYR 116  -4.887 -18.201 -18.201
  834   2HB   TYR 116           HB1      TYR 116  -4.951 -19.918 -19.918
  835    HD1  TYR 116           HD1      TYR 116  -3.995 -18.492 -18.492
  836    HD2  TYR 116           HD2      TYR 116  -7.410 -18.730 -18.730
  837    HE1  TYR 116           HE1      TYR 116  -5.527 -18.070 -18.070
  838    HE2  TYR 116           HE2      TYR 116  -8.933 -18.317 -18.317
  839    HH   TYR 116           HH       TYR 116  -8.025 -17.060 -17.060
  840    H    VAL 117           HN       VAL 117  -2.918 -21.440 -21.440
  841    HA   VAL 117           HA       VAL 117  -1.485 -21.612 -21.612
  842    HB   VAL 117           HB       VAL 117   0.017 -21.988 -21.988
  843   1HG1  VAL 117          HG13      VAL 117  -1.939 -24.195 -24.195
  844   2HG1  VAL 117          HG12      VAL 117  -0.392 -23.906 -23.906
  845   3HG1  VAL 117          HG11      VAL 117  -1.682 -22.708 -22.708
  846   1HG2  VAL 117          HG21      VAL 117  -0.604 -23.986 -23.986
  847   2HG2  VAL 117          HG23      VAL 117   0.964 -23.403 -23.403
  848   3HG2  VAL 117          HG22      VAL 117   0.151 -24.710 -24.710
  849    H    ILE 118           HN       ILE 118  -2.093 -23.379 -23.379
  850    HA   ILE 118           HA       ILE 118  -4.799 -24.398 -24.398
  851    HB   ILE 118           HB       ILE 118  -2.625 -24.541 -24.541
  852   1HG1  ILE 118          HG12      ILE 118  -4.480 -23.429 -23.429
  853   2HG1  ILE 118          HG11      ILE 118  -5.418 -23.363 -23.363
  854   1HG2  ILE 118          HG22      ILE 118  -5.270 -26.039 -26.039
  855   2HG2  ILE 118          HG21      ILE 118  -4.324 -25.724 -25.724
  856   3HG2  ILE 118          HG23      ILE 118  -3.655 -26.726 -26.726
  857   1HD1  ILE 118          HD12      ILE 118  -2.621 -22.263 -22.263
  858   2HD1  ILE 118          HD11      ILE 118  -3.945 -21.301 -21.301
  859   3HD1  ILE 118          HD13      ILE 118  -3.979 -21.811 -21.811
  860    H    ASP 119           HN       ASP 119  -5.310 -26.336 -26.336
  861    HA   ASP 119           HA       ASP 119  -3.194 -28.443 -28.443
  862   1HB   ASP 119           HB2      ASP 119  -3.530 -27.122 -27.122
  863   2HB   ASP 119           HB1      ASP 119  -5.234 -27.571 -27.571
  864    HA   PRO 120           HA       PRO 120  -6.602 -30.682 -30.682
  865   1HB   PRO 120           HB2      PRO 120  -5.459 -33.171 -33.171
  866   2HB   PRO 120           HB1      PRO 120  -5.044 -31.921 -31.921
  867   1HG   PRO 120           HG2      PRO 120  -3.591 -32.734 -32.734
  868   2HG   PRO 120           HG1      PRO 120  -2.952 -32.320 -32.320
  869   1HD   PRO 120           HD2      PRO 120  -2.911 -30.592 -30.592
  870   2HD   PRO 120           HD1      PRO 120  -3.059 -30.059 -30.059
  871    H    GLU 121           HN       GLU 121  -8.266 -32.069 -32.069
  872    HA   GLU 121           HA       GLU 121  -8.020 -32.921 -32.921
  873   1HB   GLU 121           HB2      GLU 121 -10.371 -31.867 -31.867
  874   2HB   GLU 121           HB1      GLU 121 -10.480 -32.430 -32.430
  875   1HG   GLU 121           HG2      GLU 121  -8.898 -30.712 -30.712
  876   2HG   GLU 121           HG1      GLU 121  -8.673 -30.184 -30.184
  877    HA   PRO 122           HA       PRO 122  -8.912 -36.992 -36.992
  878   1HB   PRO 122           HB2      PRO 122 -10.201 -38.051 -38.051
  879   2HB   PRO 122           HB1      PRO 122  -8.446 -37.796 -37.796
  880   1HG   PRO 122           HG2      PRO 122 -10.554 -36.118 -36.118
  881   2HG   PRO 122           HG1      PRO 122  -8.942 -36.548 -36.548
  882   1HD   PRO 122           HD2      PRO 122  -9.487 -34.140 -34.140
  883   2HD   PRO 122           HD1      PRO 122  -7.898 -34.923 -34.923
  884    H    CYS 123           HN       CYS 123 -11.511 -34.999 -34.999
  885    HA   CYS 123           HA       CYS 123 -13.384 -36.271 -36.271
  886   1HB   CYS 123           HB2      CYS 123 -13.651 -37.267 -37.267
  887   2HB   CYS 123           HB1      CYS 123 -13.959 -35.656 -35.656
  888    HG   CYS 123           HG       CYS 123 -15.868 -37.137 -37.137
  889    HA   PRO 124           HA       PRO 124 -14.083 -31.932 -31.932
  890   1HB   PRO 124           HB2      PRO 124 -16.317 -32.144 -32.144
  891   2HB   PRO 124           HB1      PRO 124 -14.679 -32.496 -32.496
  892   1HG   PRO 124           HG2      PRO 124 -16.810 -34.373 -34.373
  893   2HG   PRO 124           HG1      PRO 124 -15.681 -34.515 -34.515
  894   1HD   PRO 124           HD2      PRO 124 -15.333 -35.825 -35.825
  895   2HD   PRO 124           HD1      PRO 124 -13.979 -35.301 -35.301
  896    H    ASP 125           HN       ASP 125 -16.413 -34.054 -34.054
  897    HA   ASP 125           HA       ASP 125 -18.303 -31.899 -31.899
  898   1HB   ASP 125           HB2      ASP 125 -19.491 -33.759 -33.759
  899   2HB   ASP 125           HB1      ASP 125 -19.024 -34.197 -34.197
  900    H    SER 126           HN       SER 126 -19.008 -32.276 -32.276
  901    HA   SER 126           HA       SER 126 -16.507 -31.809 -31.809
  902   1HB   SER 126           HB2      SER 126 -17.885 -30.152 -30.152
  903   2HB   SER 126           HB1      SER 126 -17.799 -29.763 -29.763
  904    HG   SER 126           HG       SER 126 -19.934 -29.645 -29.645
  905    H    ASP 127           HN       ASP 127 -16.546 -32.639 -32.639
  906    HA   ASP 127           HA       ASP 127 -18.904 -34.295 -34.295
  907   1HB   ASP 127           HB2      ASP 127 -17.129 -35.590 -35.590
  908   2HB   ASP 127           HB1      ASP 127 -16.031 -35.259 -35.259
  909    H    GLN 128           HN       GLN 128 -18.858 -34.842 -34.842
  910    HA   GLN 128           HA       GLN 128 -18.135 -32.685 -32.685
  911   1HB   GLN 128           HB2      GLN 128 -18.672 -35.625 -35.625
  912   2HB   GLN 128           HB1      GLN 128 -18.658 -34.371 -34.371
  913   1HG   GLN 128           HG2      GLN 128 -20.476 -34.374 -34.374
  914   2HG   GLN 128           HG1      GLN 128 -20.961 -34.882 -34.882
  915   1HE2  GLN 128          HE22      GLN 128 -21.769 -31.217 -31.217
  916   2HE2  GLN 128          HE21      GLN 128 -22.129 -32.612 -32.612
  917    H    GLU 129           HN       GLU 129 -16.372 -35.577 -35.577
  918    HA   GLU 129           HA       GLU 129 -14.299 -35.445 -35.445
  919   1HB   GLU 129           HB2      GLU 129 -14.915 -37.434 -37.434
  920   2HB   GLU 129           HB1      GLU 129 -14.287 -36.611 -36.611
  921   1HG   GLU 129           HG2      GLU 129 -12.056 -36.496 -36.496
  922   2HG   GLU 129           HG1      GLU 129 -12.672 -37.274 -37.274
  923    HA   PRO 130           HA       PRO 130 -12.061 -32.005 -32.005
  924   1HB   PRO 130           HB2      PRO 130  -9.619 -32.436 -32.436
  925   2HB   PRO 130           HB1      PRO 130 -11.010 -31.777 -31.777
  926   1HG   PRO 130           HG2      PRO 130  -9.948 -34.560 -34.560
  927   2HG   PRO 130           HG1      PRO 130 -10.573 -33.616 -33.616
  928   1HD   PRO 130           HD2      PRO 130 -12.031 -35.524 -35.524
  929   2HD   PRO 130           HD1      PRO 130 -12.763 -34.093 -34.093
  930    H    LYS 131           HN       LYS 131 -10.545 -31.632 -31.632
  931    HA   LYS 131           HA       LYS 131  -9.259 -34.075 -34.075
  932   1HB   LYS 131           HB2      LYS 131 -10.767 -31.807 -31.807
  933   2HB   LYS 131           HB1      LYS 131  -9.907 -33.079 -33.079
  934   1HG   LYS 131           HG2      LYS 131 -11.330 -34.783 -34.783
  935   2HG   LYS 131           HG1      LYS 131 -12.188 -33.518 -33.518
  936   1HD   LYS 131           HD2      LYS 131 -12.958 -32.531 -32.531
  937   2HD   LYS 131           HD1      LYS 131 -12.043 -33.727 -33.727
  938   1HE   LYS 131           HE2      LYS 131 -13.413 -35.540 -35.540
  939   2HE   LYS 131           HE1      LYS 131 -14.293 -34.385 -34.385
  940   1HZ   LYS 131           HZ2      LYS 131 -14.116 -34.272 -34.272
  941   2HZ   LYS 131           HZ1      LYS 131 -15.471 -34.800 -34.800
  942   3HZ   LYS 131           HZ3      LYS 131 -14.967 -33.184 -33.184
  943    H1   NAG 132           H1       NAG 132  -4.079  -4.927  -4.927
  944    H2   NAG 132           H2       NAG 132  -2.991  -2.407  -2.407
  945    H3   NAG 132           H3       NAG 132  -2.276  -5.367  -5.367
  946    H4   NAG 132           H4       NAG 132  -3.955  -3.546  -3.546
  947    H5   NAG 132           H5       NAG 132  -4.913  -5.886  -5.886
  948   1H6   NAG 132           H61      NAG 132  -5.994  -4.865  -4.865
  949   2H6   NAG 132           H62      NAG 132  -6.864  -4.002  -4.002
  950   1H8   NAG 132           H81      NAG 132  -1.259  -2.062  -2.062
  951   2H8   NAG 132           H82      NAG 132  -0.127  -0.924  -0.924
  952   3H8   NAG 132           H83      NAG 132   0.415  -2.576  -2.576
  953    HN2  NAG 132           HN2      NAG 132  -1.630  -4.262  -4.262
  954    HO3  NAG 132           HO3      NAG 132  -0.869  -4.545  -4.545
  955    H1   NAG 133           H1       NAG 133  -4.212  -4.566  -4.566
  956    H2   NAG 133           H2       NAG 133  -2.121  -6.808  -6.808
  957    H3   NAG 133           H3       NAG 133  -3.526  -5.411  -5.411
  958    H4   NAG 133           H4       NAG 133  -0.580  -5.181  -5.181
  959    H5   NAG 133           H5       NAG 133  -2.797  -3.064  -3.064
  960   1H6   NAG 133           H61      NAG 133   0.081  -3.124  -3.124
  961   2H6   NAG 133           H62      NAG 133  -0.540  -2.193  -2.193
  962   1H8   NAG 133           H81      NAG 133  -5.821  -9.432  -9.432
  963   2H8   NAG 133           H82      NAG 133  -6.514  -7.788  -7.788
  964   3H8   NAG 133           H83      NAG 133  -6.220  -8.633  -8.633
  965    HN2  NAG 133           HN2      NAG 133  -4.606  -7.249  -7.249
  966    HO3  NAG 133           HO3      NAG 133  -2.883  -7.308  -7.308
  967    HO6  NAG 133           HO6      NAG 133  -0.431  -1.267  -1.267
  968    H1   FUC 134           H1       FUC 134  -6.888  -7.073  -7.073
  969    H2   FUC 134           H2       FUC 134  -9.464  -7.177  -7.177
  970    H3   FUC 134           H3       FUC 134  -8.744  -8.873  -8.873
  971    H4   FUC 134           H4       FUC 134 -10.466  -7.444  -7.444
  972    H5   FUC 134           H5       FUC 134  -8.050  -6.468  -6.468
  973   1H6   FUC 134           H61      FUC 134 -10.189  -5.170  -5.170
  974   2H6   FUC 134           H62      FUC 134  -9.871  -4.183  -4.183
  975   3H6   FUC 134           H63      FUC 134  -8.606  -4.355  -4.355
  976    HO2  FUC 134           HO2      FUC 134  -8.816  -9.358  -9.358
  977    HO3  FUC 134           HO3      FUC 134 -10.202  -9.954  -9.954
  978    HO4  FUC 134           HO4      FUC 134 -10.681  -6.108  -6.108
  979    H1   MAN 135           H1       MAN 135   0.172  -5.479  -5.479
  980    H2   MAN 135           H2       MAN 135   1.145  -3.330  -3.330
  981    H3   MAN 135           H3       MAN 135   2.595  -4.629  -4.629
  982    H4   MAN 135           H4       MAN 135   1.368  -3.155  -3.155
  983    H5   MAN 135           H5       MAN 135   1.012  -6.092  -6.092
  984   1H6   MAN 135           H61      MAN 135  -0.783  -5.981  -5.981
  985   2H6   MAN 135           H62      MAN 135   0.896  -5.986  -5.986
  986    HO2  MAN 135           HO2      MAN 135   0.066  -2.266  -2.266
  987    HO3  MAN 135           HO3      MAN 135   2.571  -1.881  -1.881
  988    HO4  MAN 135           HO4      MAN 135   2.991  -4.001  -4.001
  989    HO6  MAN 135           HO6      MAN 135   0.445  -4.148  -4.148
  990    H1   NAG 136           H1       NAG 136   1.315  -8.225  -8.225
  991    H2   NAG 136           H2       NAG 136  -1.519  -8.341  -8.341
  992    H3   NAG 136           H3       NAG 136   0.693 -10.493 -10.493
  993    H4   NAG 136           H4       NAG 136  -0.221  -8.739  -8.739
  994    H5   NAG 136           H5       NAG 136   2.339  -8.546  -8.546
  995   1H6   NAG 136           H61      NAG 136   3.053  -7.119  -7.119
  996   2H6   NAG 136           H62      NAG 136   1.990  -8.048  -8.048
  997   1H8   NAG 136           H81      NAG 136  -3.696  -9.711  -9.711
  998   2H8   NAG 136           H82      NAG 136  -3.107  -8.262  -8.262
  999   3H8   NAG 136           H83      NAG 136  -4.205  -9.410  -9.410
 1000    HN2  NAG 136           HN2      NAG 136  -0.447  -9.438  -9.438
 1001    HO3  NAG 136           HO3      NAG 136  -1.841 -10.281 -10.281
 1002    H1   NAG 137           H1       NAG 137   2.888  -9.632  -9.632
 1003    H2   NAG 137           H2       NAG 137   2.153 -12.488 -12.488
 1004    H3   NAG 137           H3       NAG 137   4.919 -11.413 -11.413
 1005    H4   NAG 137           H4       NAG 137   4.042 -12.312 -12.312
 1006    H5   NAG 137           H5       NAG 137   4.599  -9.456  -9.456
 1007   1H6   NAG 137           H61      NAG 137   3.793  -8.782  -8.782
 1008   2H6   NAG 137           H62      NAG 137   3.582 -10.478 -10.478
 1009   1H8   NAG 137           H81      NAG 137   3.987  -9.681  -9.681
 1010   2H8   NAG 137           H82      NAG 137   2.731  -9.881  -9.881
 1011   3H8   NAG 137           H83      NAG 137   4.452 -10.190 -10.190
 1012    HN2  NAG 137           HN2      NAG 137   1.733 -12.404 -12.404
 1013    HO3  NAG 137           HO3      NAG 137   4.167 -13.914 -13.914
 1014    HO6  NAG 137           HO6      NAG 137   5.588 -10.104 -10.104
 1015    H1   FUC 138           H1       FUC 138   0.577  -6.813  -6.813
 1016    H2   FUC 138           H2       FUC 138   0.409  -4.008  -4.008
 1017    H3   FUC 138           H3       FUC 138   0.677  -3.889  -3.889
 1018    H4   FUC 138           H4       FUC 138   2.874  -2.642  -2.642
 1019    H5   FUC 138           H5       FUC 138   3.270  -5.238  -5.238
 1020   1H6   FUC 138           H61      FUC 138   5.249  -5.063  -5.063
 1021   2H6   FUC 138           H62      FUC 138   4.476  -4.844  -4.844
 1022   3H6   FUC 138           H63      FUC 138   4.774  -3.425  -3.425
 1023    HO2  FUC 138           HO2      FUC 138  -1.493  -5.449  -5.449
 1024    HO3  FUC 138           HO3      FUC 138   0.274  -2.037  -2.037
 1025    HO4  FUC 138           HO4      FUC 138   3.258  -2.161  -2.161
 1026    H1   MAN 139           H1       MAN 139   5.704 -13.684 -13.684
 1027    H2   MAN 139           H2       MAN 139   6.611 -12.829 -12.829
 1028    H3   MAN 139           H3       MAN 139   7.279 -15.086 -15.086
 1029    H4   MAN 139           H4       MAN 139   9.693 -13.904 -13.904
 1030    H5   MAN 139           H5       MAN 139   7.208 -15.277 -15.277
 1031   1H6   MAN 139           H61      MAN 139   8.126 -14.638 -14.638
 1032   2H6   MAN 139           H62      MAN 139   9.246 -15.701 -15.701
 1033    HO2  MAN 139           HO2      MAN 139   8.052 -11.281 -11.281
 1034    HO3  MAN 139           HO3      MAN 139   8.333 -14.067 -14.067
 1035    HO4  MAN 139           HO4      MAN 139  10.339 -15.865 -15.865
 1036    HO6  MAN 139           HO6      MAN 139   9.433 -12.842 -12.842

  Start of MODEL    7
    1   1H    ALA   1           HT2      ALA   1 -14.081   2.486   2.486
    2   2H    ALA   1           HT1      ALA   1 -12.999   1.176   1.176
    3   3H    ALA   1           HT3      ALA   1 -14.643   0.911   0.911
    4    HA   ALA   1           HA       ALA   1 -14.491   2.054   2.054
    5   1HB   ALA   1           HB3      ALA   1 -12.404  -0.026  -0.026
    6   2HB   ALA   1           HB2      ALA   1 -12.699   0.483   0.483
    7   3HB   ALA   1           HB1      ALA   1 -13.988  -0.281  -0.281
    8    H    MET   1           HN       MET   1 -11.221   1.786   1.786
    9    HA   MET   1           HA       MET   1 -10.504   4.371   4.371
   10   1HB   MET   1           HB2      MET   1  -8.867   1.882   1.882
   11   2HB   MET   1           HB1      MET   1  -8.208   3.364   3.364
   12   1HG   MET   1           HG2      MET   1 -10.454   1.737   1.737
   13   2HG   MET   1           HG1      MET   1  -8.768   1.668   1.668
   14   1HE   MET   1           HE2      MET   1  -7.466   3.329   3.329
   15   2HE   MET   1           HE1      MET   1  -7.702   4.656   4.656
   16   3HE   MET   1           HE3      MET   1  -7.952   4.913   4.913
   17    H    HIS   2           HN       HIS   2  -8.059   4.775   4.775
   18    HA   HIS   2           HA       HIS   2  -8.963   5.392   5.392
   19   1HB   HIS   2           HB2      HIS   2  -6.594   6.294   6.294
   20   2HB   HIS   2           HB1      HIS   2  -6.982   6.915   6.915
   21    HD1  HIS   2           HD1      HIS   2  -8.149   6.986   6.986
   22    HD2  HIS   2           HD2      HIS   2  -9.237   8.655   8.655
   23    HE1  HIS   2           HE1      HIS   2  -9.849   8.791   8.791
   24    H    VAL   3           HN       VAL   3  -7.976   2.703   2.703
   25    HA   VAL   3           HA       VAL   3  -6.150   2.165   2.165
   26    HB   VAL   3           HB       VAL   3  -5.531   1.513   1.513
   27   1HG1  VAL   3          HG11      VAL   3  -4.804  -0.196  -0.196
   28   2HG1  VAL   3          HG13      VAL   3  -3.831   1.062   1.062
   29   3HG1  VAL   3          HG12      VAL   3  -3.472   0.548   0.548
   30   1HG2  VAL   3          HG21      VAL   3  -4.353   3.507   3.507
   31   2HG2  VAL   3          HG23      VAL   3  -5.075   3.843   3.843
   32   3HG2  VAL   3          HG22      VAL   3  -3.523   3.011   3.011
   33    H    ALA   4           HN       ALA   4  -6.763   0.207   0.207
   34    HA   ALA   4           HA       ALA   4  -8.609  -1.539  -1.539
   35   1HB   ALA   4           HB3      ALA   4  -9.070  -0.306  -0.306
   36   2HB   ALA   4           HB2      ALA   4  -8.339  -1.789  -1.789
   37   3HB   ALA   4           HB1      ALA   4  -9.783  -1.870  -1.870
   38    H    GLN   5           HN       GLN   5  -7.976  -3.598  -3.598
   39    HA   GLN   5           HA       GLN   5  -5.720  -4.798  -4.798
   40   1HB   GLN   5           HB2      GLN   5  -6.020  -4.682  -4.682
   41   2HB   GLN   5           HB1      GLN   5  -4.717  -5.480  -5.480
   42   1HG   GLN   5           HG2      GLN   5  -3.600  -3.531  -3.531
   43   2HG   GLN   5           HG1      GLN   5  -4.719  -2.928  -2.928
   44   1HE2  GLN   5          HE22      GLN   5  -6.757  -1.723  -1.723
   45   2HE2  GLN   5          HE21      GLN   5  -7.024  -3.085  -3.085
   46    HA   PRO   6           HA       PRO   6  -8.533  -8.289  -8.289
   47   1HB   PRO   6           HB2      PRO   6  -6.793 -10.243 -10.243
   48   2HB   PRO   6           HB1      PRO   6  -7.532  -9.091  -9.091
   49   1HG   PRO   6           HG2      PRO   6  -4.809  -9.069  -9.069
   50   2HG   PRO   6           HG1      PRO   6  -5.312  -8.673  -8.673
   51   1HD   PRO   6           HD2      PRO   6  -4.744  -6.788  -6.788
   52   2HD   PRO   6           HD1      PRO   6  -5.934  -6.537  -6.537
   53    H    ALA   7           HN       ALA   7  -9.056  -9.547  -9.547
   54    HA   ALA   7           HA       ALA   7  -7.319  -9.622  -9.622
   55   1HB   ALA   7           HB3      ALA   7  -9.867  -9.683  -9.683
   56   2HB   ALA   7           HB2      ALA   7  -9.731 -11.362 -11.362
   57   3HB   ALA   7           HB1      ALA   7  -9.143 -10.883 -10.883
   58    H    VAL   8           HN       VAL   8  -8.003 -11.938 -11.938
   59    HA   VAL   8           HA       VAL   8  -5.613 -13.405 -13.405
   60    HB   VAL   8           HB       VAL   8  -7.759 -14.233 -14.233
   61   1HG1  VAL   8          HG11      VAL   8  -8.417 -14.907 -14.907
   62   2HG1  VAL   8          HG13      VAL   8  -8.668 -16.191 -16.191
   63   3HG1  VAL   8          HG12      VAL   8  -9.484 -14.623 -14.623
   64   1HG2  VAL   8          HG23      VAL   8  -5.449 -15.512 -15.512
   65   2HG2  VAL   8          HG22      VAL   8  -6.508 -16.028 -16.028
   66   3HG2  VAL   8          HG21      VAL   8  -6.759 -16.624 -16.624
   67    H    VAL   9           HN       VAL   9  -4.809 -14.796 -14.796
   68    HA   VAL   9           HA       VAL   9  -5.997 -14.565 -14.565
   69    HB   VAL   9           HB       VAL   9  -3.317 -13.717 -13.717
   70   1HG1  VAL   9          HG11      VAL   9  -3.961 -14.587 -14.587
   71   2HG1  VAL   9          HG13      VAL   9  -2.614 -13.513 -13.513
   72   3HG1  VAL   9          HG12      VAL   9  -2.643 -15.158 -15.158
   73   1HG2  VAL   9          HG22      VAL   9  -5.476 -12.291 -12.291
   74   2HG2  VAL   9          HG21      VAL   9  -3.883 -11.675 -11.675
   75   3HG2  VAL   9          HG23      VAL   9  -4.894 -12.408 -12.408
   76    H    LEU  10           HN       LEU  10  -5.324 -16.274 -16.274
   77    HA   LEU  10           HA       LEU  10  -4.243 -18.688 -18.688
   78   1HB   LEU  10           HB2      LEU  10  -6.147 -18.460 -18.460
   79   2HB   LEU  10           HB1      LEU  10  -5.686 -19.955 -19.955
   80    HG   LEU  10           HG       LEU  10  -7.144 -17.635 -17.635
   81   1HD1  LEU  10          HD12      LEU  10  -8.104 -20.355 -20.355
   82   2HD1  LEU  10          HD11      LEU  10  -9.053 -19.249 -19.249
   83   3HD1  LEU  10          HD13      LEU  10  -8.591 -18.788 -18.788
   84   1HD2  LEU  10          HD21      LEU  10  -5.776 -20.010 -20.010
   85   2HD2  LEU  10          HD23      LEU  10  -6.361 -18.583 -18.583
   86   3HD2  LEU  10          HD22      LEU  10  -7.461 -19.917 -19.917
   87    H    ALA  11           HN       ALA  11  -2.382 -19.562 -19.562
   88    HA   ALA  11           HA       ALA  11  -1.175 -18.234 -18.234
   89   1HB   ALA  11           HB3      ALA  11  -0.033 -18.792 -18.792
   90   2HB   ALA  11           HB2      ALA  11  -0.119 -20.489 -20.489
   91   3HB   ALA  11           HB1      ALA  11   0.819 -19.349 -19.349
   92    H    SER  12           HN       SER  12  -1.119 -19.109 -19.109
   93    HA   SER  12           HA       SER  12  -2.650 -21.384 -21.384
   94   1HB   SER  12           HB2      SER  12  -1.950 -19.475 -19.475
   95   2HB   SER  12           HB1      SER  12  -0.289 -20.055 -20.055
   96    HG   SER  12           HG       SER  12  -0.854 -21.237 -21.237
   97    H    SER  13           HN       SER  13  -1.593 -23.282 -23.282
   98    HA   SER  13           HA       SER  13  -0.085 -24.932 -24.932
   99   1HB   SER  13           HB2      SER  13  -1.540 -25.672 -25.672
  100   2HB   SER  13           HB1      SER  13  -0.348 -25.049 -25.049
  101    HG   SER  13           HG       SER  13  -0.041 -27.132 -27.132
  102    H    ARG  14           HN       ARG  14   0.933 -22.809 -22.809
  103    HA   ARG  14           HA       ARG  14   3.638 -23.558 -23.558
  104   1HB   ARG  14           HB2      ARG  14   2.380 -21.910 -21.910
  105   2HB   ARG  14           HB1      ARG  14   2.375 -20.796 -20.796
  106   1HG   ARG  14           HG2      ARG  14   4.299 -19.976 -19.976
  107   2HG   ARG  14           HG1      ARG  14   5.058 -21.437 -21.437
  108   1HD   ARG  14           HD2      ARG  14   5.497 -22.148 -22.148
  109   2HD   ARG  14           HD1      ARG  14   3.786 -22.013 -22.013
  110    HE   ARG  14           HE       ARG  14   5.851 -19.986 -19.986
  111   1HH1  ARG  14          HH21      ARG  14   2.427 -20.581 -20.581
  112   2HH1  ARG  14          HH22      ARG  14   1.977 -19.155 -19.155
  113   1HH2  ARG  14          HH11      ARG  14   5.220 -18.151 -18.151
  114   2HH2  ARG  14          HH12      ARG  14   3.537 -17.793 -17.793
  115    H    GLY  15           HN       GLY  15   2.093 -21.883 -21.883
  116   1HA   GLY  15           HA2      GLY  15   3.075 -21.713 -21.713
  117   2HA   GLY  15           HA1      GLY  15   4.676 -21.858 -21.858
  118    H    ILE  16           HN       ILE  16   2.309 -19.742 -19.742
  119    HA   ILE  16           HA       ILE  16   3.881 -17.419 -17.419
  120    HB   ILE  16           HB       ILE  16   2.539 -18.147 -18.147
  121   1HG1  ILE  16          HG12      ILE  16   4.719 -17.330 -17.330
  122   2HG1  ILE  16          HG11      ILE  16   5.219 -16.983 -16.983
  123   1HG2  ILE  16          HG22      ILE  16   2.933 -15.390 -15.390
  124   2HG2  ILE  16          HG21      ILE  16   3.271 -15.656 -15.656
  125   3HG2  ILE  16          HG23      ILE  16   1.665 -15.996 -15.996
  126   1HD1  ILE  16          HD13      ILE  16   4.269 -19.745 -19.745
  127   2HD1  ILE  16          HD12      ILE  16   5.850 -19.266 -19.266
  128   3HD1  ILE  16          HD11      ILE  16   5.532 -19.183 -19.183
  129    H    ALA  17           HN       ALA  17   2.820 -16.420 -16.420
  130    HA   ALA  17           HA       ALA  17  -0.163 -16.287 -16.287
  131   1HB   ALA  17           HB2      ALA  17   2.033 -15.824 -15.824
  132   2HB   ALA  17           HB1      ALA  17   0.393 -15.240 -15.240
  133   3HB   ALA  17           HB3      ALA  17   0.691 -16.964 -16.964
  134    H    SER  18           HN       SER  18  -0.993 -14.481 -14.481
  135    HA   SER  18           HA       SER  18   0.651 -11.976 -11.976
  136   1HB   SER  18           HB2      SER  18   0.504 -13.027 -13.027
  137   2HB   SER  18           HB1      SER  18  -1.254 -13.024 -13.024
  138    HG   SER  18           HG       SER  18   0.481 -11.013 -11.013
  139    H    PHE  19           HN       PHE  19  -0.298 -10.261 -10.261
  140    HA   PHE  19           HA       PHE  19  -3.264 -10.091 -10.091
  141   1HB   PHE  19           HB2      PHE  19  -3.078  -9.497  -9.497
  142   2HB   PHE  19           HB1      PHE  19  -2.463 -11.110 -11.110
  143    HD1  PHE  19           HD2      PHE  19  -0.008 -11.560 -11.560
  144    HD2  PHE  19           HD1      PHE  19  -1.617  -7.707  -7.707
  145    HE1  PHE  19           HE2      PHE  19   2.199 -10.938 -10.938
  146    HE2  PHE  19           HE1      PHE  19   0.588  -7.086  -7.086
  147    HZ   PHE  19           HZ       PHE  19   2.496  -8.704  -8.704
  148    H    VAL  20           HN       VAL  20  -3.935  -7.831  -7.831
  149    HA   VAL  20           HA       VAL  20  -1.846  -5.835  -5.835
  150    HB   VAL  20           HB       VAL  20  -4.710  -6.047  -6.047
  151   1HG1  VAL  20          HG11      VAL  20  -3.486  -3.730  -3.730
  152   2HG1  VAL  20          HG13      VAL  20  -2.609  -4.281  -4.281
  153   3HG1  VAL  20          HG12      VAL  20  -4.364  -4.118  -4.118
  154   1HG2  VAL  20          HG21      VAL  20  -2.102  -6.999  -6.999
  155   2HG2  VAL  20          HG23      VAL  20  -3.717  -7.674  -7.674
  156   3HG2  VAL  20          HG22      VAL  20  -3.211  -6.273  -6.273
  157    H    CYS  21           HN       CYS  21  -1.747  -4.105  -4.105
  158    HA   CYS  21           HA       CYS  21  -3.990  -3.634  -3.634
  159   1HB   CYS  21           HB2      CYS  21  -1.684  -4.376  -4.376
  160   2HB   CYS  21           HB1      CYS  21  -1.056  -2.858  -2.858
  161    H    GLU  22           HN       GLU  22  -5.200  -1.922  -1.922
  162    HA   GLU  22           HA       GLU  22  -3.930   0.076   0.076
  163   1HB   GLU  22           HB2      GLU  22  -6.157   0.776   0.776
  164   2HB   GLU  22           HB1      GLU  22  -6.259  -0.968  -0.968
  165   1HG   GLU  22           HG2      GLU  22  -6.888  -0.594  -0.594
  166   2HG   GLU  22           HG1      GLU  22  -6.889   1.140   1.140
  167    H    TYR  23           HN       TYR  23  -3.777   2.339   2.339
  168    HA   TYR  23           HA       TYR  23  -4.101   3.073   3.073
  169   1HB   TYR  23           HB2      TYR  23  -1.857   3.943   3.943
  170   2HB   TYR  23           HB1      TYR  23  -1.745   2.354   2.354
  171    HD1  TYR  23           HD1      TYR  23  -1.828   6.025   6.025
  172    HD2  TYR  23           HD2      TYR  23  -0.976   2.077   2.077
  173    HE1  TYR  23           HE1      TYR  23  -0.744   7.052   7.052
  174    HE2  TYR  23           HE2      TYR  23   0.097   3.103   3.103
  175    HH   TYR  23           HH       TYR  23  -0.334   5.841   5.841
  176    H    ALA  24           HN       ALA  24  -3.986   5.553   5.553
  177    HA   ALA  24           HA       ALA  24  -5.084   6.855   6.855
  178   1HB   ALA  24           HB3      ALA  24  -6.142   6.780   6.780
  179   2HB   ALA  24           HB2      ALA  24  -6.665   8.003   8.003
  180   3HB   ALA  24           HB1      ALA  24  -6.967   6.295   6.295
  181    H    SER  25           HN       SER  25  -4.224   8.851   8.851
  182    HA   SER  25           HA       SER  25  -2.891  10.327  10.327
  183   1HB   SER  25           HB2      SER  25  -1.154   9.063   9.063
  184   2HB   SER  25           HB1      SER  25  -1.725   9.548   9.548
  185    HG   SER  25           HG       SER  25  -0.339  11.111  11.111
  186    HA   PRO  26           HA       PRO  26  -4.941  13.787  13.787
  187   1HB   PRO  26           HB2      PRO  26  -3.248  15.808  15.808
  188   2HB   PRO  26           HB1      PRO  26  -4.362  15.001  15.001
  189   1HG   PRO  26           HG2      PRO  26  -1.445  14.532  14.532
  190   2HG   PRO  26           HG1      PRO  26  -2.360  14.616  14.616
  191   1HD   PRO  26           HD2      PRO  26  -1.625  12.261  12.261
  192   2HD   PRO  26           HD1      PRO  26  -3.143  12.455  12.455
  193    H    GLY  27           HN       GLY  27  -1.632  13.000  13.000
  194   1HA   GLY  27           HA2      GLY  27  -1.994  14.328  14.328
  195   2HA   GLY  27           HA1      GLY  27  -0.520  14.647  14.647
  196    H    LYS  28           HN       LYS  28  -0.333  13.478  13.478
  197    HA   LYS  28           HA       LYS  28   0.250  10.596  10.596
  198   1HB   LYS  28           HB2      LYS  28  -0.354  12.095  12.095
  199   2HB   LYS  28           HB1      LYS  28   0.029  10.375  10.375
  200   1HG   LYS  28           HG2      LYS  28  -1.909  10.050  10.050
  201   2HG   LYS  28           HG1      LYS  28  -2.320  11.754  11.754
  202   1HD   LYS  28           HD2      LYS  28  -2.631  11.430  11.430
  203   2HD   LYS  28           HD1      LYS  28  -2.131   9.744   9.744
  204   1HE   LYS  28           HE2      LYS  28  -4.065   9.246   9.246
  205   2HE   LYS  28           HE1      LYS  28  -4.550  10.953  10.953
  206   1HZ   LYS  28           HZ1      LYS  28  -4.657  10.832  10.832
  207   2HZ   LYS  28           HZ3      LYS  28  -4.255   9.185   9.185
  208   3HZ   LYS  28           HZ2      LYS  28  -5.725   9.720   9.720
  209    H    ALA  29           HN       ALA  29   2.358   9.939   9.939
  210    HA   ALA  29           HA       ALA  29   4.351  11.735  11.735
  211   1HB   ALA  29           HB1      ALA  29   4.160  11.806  11.806
  212   2HB   ALA  29           HB3      ALA  29   4.860  10.187  10.187
  213   3HB   ALA  29           HB2      ALA  29   5.767  11.556  11.556
  214    H    THR  30           HN       THR  30   6.363  10.499  10.499
  215    HA   THR  30           HA       THR  30   5.683   7.887   7.887
  216    HB   THR  30           HB       THR  30   7.869   8.042   8.042
  217    HG1  THR  30           HG1      THR  30   9.480   9.148   9.148
  218   1HG2  THR  30          HG23      THR  30   6.076  10.149  10.149
  219   2HG2  THR  30          HG22      THR  30   7.639  10.917  10.917
  220   3HG2  THR  30          HG21      THR  30   7.435   9.817   9.817
  221    H    GLU  31           HN       GLU  31   7.756   9.115   9.115
  222    HA   GLU  31           HA       GLU  31   8.976   6.542   6.542
  223   1HB   GLU  31           HB2      GLU  31   8.850   9.095   9.095
  224   2HB   GLU  31           HB1      GLU  31  10.013   7.799   7.799
  225   1HG   GLU  31           HG2      GLU  31   9.895   8.852   8.852
  226   2HG   GLU  31           HG1      GLU  31  10.445  10.014  10.014
  227    H    VAL  32           HN       VAL  32   7.307   5.071   5.071
  228    HA   VAL  32           HA       VAL  32   5.882   5.629   5.629
  229    HB   VAL  32           HB       VAL  32   5.315   3.717   3.717
  230   1HG1  VAL  32          HG12      VAL  32   4.136   4.008   4.008
  231   2HG1  VAL  32          HG11      VAL  32   3.043   3.654   3.654
  232   3HG1  VAL  32          HG13      VAL  32   4.371   2.553   2.553
  233   1HG2  VAL  32          HG21      VAL  32   4.332   6.417   6.417
  234   2HG2  VAL  32          HG23      VAL  32   4.556   5.741   5.741
  235   3HG2  VAL  32          HG22      VAL  32   3.146   5.288   5.288
  236    H    ARG  33           HN       ARG  33   7.366   4.867   4.867
  237    HA   ARG  33           HA       ARG  33   8.961   2.452   2.452
  238   1HB   ARG  33           HB2      ARG  33   9.672   4.540   4.540
  239   2HB   ARG  33           HB1      ARG  33   8.552   4.053   4.053
  240   1HG   ARG  33           HG2      ARG  33   9.745   1.876   1.876
  241   2HG   ARG  33           HG1      ARG  33  10.899   2.432   2.432
  242   1HD   ARG  33           HD2      ARG  33  11.503   4.345   4.345
  243   2HD   ARG  33           HD1      ARG  33  10.418   3.678   3.678
  244    HE   ARG  33           HE       ARG  33  12.249   1.661   1.661
  245   1HH1  ARG  33          HH21      ARG  33  11.981   4.369   4.369
  246   2HH1  ARG  33          HH22      ARG  33  13.241   3.785   3.785
  247   1HH2  ARG  33          HH11      ARG  33  13.871   0.945   0.945
  248   2HH2  ARG  33          HH12      ARG  33  14.302   1.867   1.867
  249    H    VAL  34           HN       VAL  34   7.760   0.567   0.567
  250    HA   VAL  34           HA       VAL  34   5.757   0.277   0.277
  251    HB   VAL  34           HB       VAL  34   4.863  -1.543  -1.543
  252   1HG1  VAL  34          HG11      VAL  34   5.361   1.124   1.124
  253   2HG1  VAL  34          HG13      VAL  34   4.208  -0.072  -0.072
  254   3HG1  VAL  34          HG12      VAL  34   3.973   0.671   0.671
  255   1HG2  VAL  34          HG22      VAL  34   7.130  -2.122  -2.122
  256   2HG2  VAL  34          HG21      VAL  34   5.814  -2.027  -2.027
  257   3HG2  VAL  34          HG23      VAL  34   6.963  -0.699  -0.699
  258    H    THR  35           HN       THR  35   5.927  -1.379  -1.379
  259    HA   THR  35           HA       THR  35   8.277  -3.216  -3.216
  260    HB   THR  35           HB       THR  35   7.323  -1.670  -1.670
  261    HG1  THR  35           HG1      THR  35   8.943  -0.352  -0.352
  262   1HG2  THR  35          HG23      THR  35   9.498  -3.724  -3.724
  263   2HG2  THR  35          HG22      THR  35   9.553  -2.572  -2.572
  264   3HG2  THR  35          HG21      THR  35   8.222  -3.722  -3.722
  265    H    VAL  36           HN       VAL  36   8.019  -5.209  -5.209
  266    HA   VAL  36           HA       VAL  36   5.197  -5.895  -5.895
  267    HB   VAL  36           HB       VAL  36   7.298  -7.503  -7.503
  268   1HG1  VAL  36          HG12      VAL  36   5.907  -8.892  -8.892
  269   2HG1  VAL  36          HG11      VAL  36   4.459  -8.269  -8.269
  270   3HG1  VAL  36          HG13      VAL  36   5.604  -9.257  -9.257
  271   1HG2  VAL  36          HG22      VAL  36   5.904  -5.614  -5.614
  272   2HG2  VAL  36          HG21      VAL  36   5.981  -7.192  -7.192
  273   3HG2  VAL  36          HG23      VAL  36   4.555  -6.737  -6.737
  274    H    LEU  37           HN       LEU  37   5.078  -6.921  -6.921
  275    HA   LEU  37           HA       LEU  37   7.690  -7.753  -7.753
  276   1HB   LEU  37           HB2      LEU  37   5.367  -6.213  -6.213
  277   2HB   LEU  37           HB1      LEU  37   6.774  -6.756  -6.756
  278    HG   LEU  37           HG       LEU  37   7.262  -5.126  -5.126
  279   1HD1  LEU  37          HD13      LEU  37   5.355  -4.210  -4.210
  280   2HD1  LEU  37          HD12      LEU  37   6.827  -3.563  -3.563
  281   3HD1  LEU  37          HD11      LEU  37   6.421  -3.163  -3.163
  282   1HD2  LEU  37          HD23      LEU  37   8.779  -6.164  -6.164
  283   2HD2  LEU  37          HD22      LEU  37   9.301  -4.910  -4.910
  284   3HD2  LEU  37          HD21      LEU  37   8.600  -4.460  -4.460
  285    H    ARG  38           HN       ARG  38   7.446  -9.292  -9.292
  286    HA   ARG  38           HA       ARG  38   4.950 -10.955 -10.955
  287   1HB   ARG  38           HB2      ARG  38   7.849 -11.597 -11.597
  288   2HB   ARG  38           HB1      ARG  38   6.540 -12.762 -12.762
  289   1HG   ARG  38           HG2      ARG  38   5.977 -12.567 -12.567
  290   2HG   ARG  38           HG1      ARG  38   7.252 -11.369 -11.369
  291   1HD   ARG  38           HD2      ARG  38   8.836 -13.201 -13.201
  292   2HD   ARG  38           HD1      ARG  38   7.524 -14.321 -14.321
  293    HE   ARG  38           HE       ARG  38   8.089 -12.496 -12.496
  294   1HH1  ARG  38          HH21      ARG  38   9.184 -15.426 -15.426
  295   2HH1  ARG  38          HH22      ARG  38   9.933 -16.031 -16.031
  296   1HH2  ARG  38          HH11      ARG  38   9.070 -13.317 -13.317
  297   2HH2  ARG  38          HH12      ARG  38   9.871 -14.852 -14.852
  298    H    GLN  39           HN       GLN  39   3.673 -10.487 -10.487
  299    HA   GLN  39           HA       GLN  39   5.013  -9.622  -9.622
  300   1HB   GLN  39           HB2      GLN  39   2.165  -9.713  -9.713
  301   2HB   GLN  39           HB1      GLN  39   2.562  -9.254  -9.254
  302   1HG   GLN  39           HG2      GLN  39   4.101  -7.498  -7.498
  303   2HG   GLN  39           HG1      GLN  39   3.457  -7.892  -7.892
  304   1HE2  GLN  39          HE22      GLN  39   0.051  -6.869  -6.869
  305   2HE2  GLN  39          HE21      GLN  39   0.689  -8.390  -8.390
  306    H    ALA  40           HN       ALA  40   5.260 -10.906 -10.906
  307    HA   ALA  40           HA       ALA  40   3.725 -13.475 -13.475
  308   1HB   ALA  40           HB1      ALA  40   6.394 -13.179 -13.179
  309   2HB   ALA  40           HB3      ALA  40   6.467 -13.436 -13.436
  310   3HB   ALA  40           HB2      ALA  40   5.694 -14.636 -14.636
  311    H    ASP  41           HN       ASP  41   3.506 -14.252 -14.252
  312    HA   ASP  41           HA       ASP  41   2.787 -12.236 -12.236
  313   1HB   ASP  41           HB2      ASP  41   3.472 -15.148 -15.148
  314   2HB   ASP  41           HB1      ASP  41   2.856 -14.224 -14.224
  315    H    SER  42           HN       SER  42   5.779 -14.131 -14.131
  316    HA   SER  42           HA       SER  42   7.035 -13.030 -13.030
  317   1HB   SER  42           HB2      SER  42   8.995 -14.217 -14.217
  318   2HB   SER  42           HB1      SER  42   7.557 -15.224 -15.224
  319    HG   SER  42           HG       SER  42   9.199 -14.362 -14.362
  320    H    GLN  43           HN       GLN  43   7.723 -12.521 -12.521
  321    HA   GLN  43           HA       GLN  43   8.332  -9.666  -9.666
  322   1HB   GLN  43           HB2      GLN  43  10.334 -11.767 -11.767
  323   2HB   GLN  43           HB1      GLN  43  10.612 -10.043 -10.043
  324   1HG   GLN  43           HG2      GLN  43  10.195  -9.740  -9.740
  325   2HG   GLN  43           HG1      GLN  43  10.232 -11.498 -11.498
  326   1HE2  GLN  43          HE22      GLN  43  13.700 -10.045 -10.045
  327   2HE2  GLN  43          HE21      GLN  43  12.198  -9.676  -9.676
  328    H    VAL  44           HN       VAL  44   9.018  -8.587  -8.587
  329    HA   VAL  44           HA       VAL  44   7.621  -9.854  -9.854
  330    HB   VAL  44           HB       VAL  44   7.820  -6.939  -6.939
  331   1HG1  VAL  44          HG12      VAL  44   7.660  -7.605  -7.605
  332   2HG1  VAL  44          HG11      VAL  44   5.991  -8.016  -8.016
  333   3HG1  VAL  44          HG13      VAL  44   6.573  -6.368  -6.368
  334   1HG2  VAL  44          HG23      VAL  44   6.138  -8.954  -8.954
  335   2HG2  VAL  44          HG22      VAL  44   5.885  -7.218  -7.218
  336   3HG2  VAL  44          HG21      VAL  44   5.143  -8.099  -8.099
  337    H    THR  45           HN       THR  45   8.792  -9.746  -9.746
  338    HA   THR  45           HA       THR  45  11.468  -8.375  -8.375
  339    HB   THR  45           HB       THR  45  12.331 -10.339 -10.339
  340    HG1  THR  45           HG1      THR  45  10.682 -11.183 -11.183
  341   1HG2  THR  45          HG23      THR  45  12.291 -10.284 -10.284
  342   2HG2  THR  45          HG22      THR  45  10.781 -11.194 -11.194
  343   3HG2  THR  45          HG21      THR  45  12.267 -11.912 -11.912
  344    H    GLU  46           HN       GLU  46  12.353  -7.781  -7.781
  345    HA   GLU  46           HA       GLU  46  10.330  -6.720  -6.720
  346   1HB   GLU  46           HB2      GLU  46  13.349  -6.704  -6.704
  347   2HB   GLU  46           HB1      GLU  46  12.459  -5.914  -5.914
  348   1HG   GLU  46           HG2      GLU  46  11.322  -4.463  -4.463
  349   2HG   GLU  46           HG1      GLU  46  11.978  -5.348  -5.348
  350    H    VAL  47           HN       VAL  47  10.426  -7.130  -7.130
  351    HA   VAL  47           HA       VAL  47  11.397  -9.895  -9.895
  352    HB   VAL  47           HB       VAL  47   8.801  -8.562  -8.562
  353   1HG1  VAL  47          HG11      VAL  47  10.100 -11.176 -11.176
  354   2HG1  VAL  47          HG13      VAL  47   8.344 -11.127 -11.127
  355   3HG1  VAL  47          HG12      VAL  47   9.143 -10.134 -10.134
  356   1HG2  VAL  47          HG23      VAL  47   8.931  -9.126  -9.126
  357   2HG2  VAL  47          HG22      VAL  47   7.687 -10.021 -10.021
  358   3HG2  VAL  47          HG21      VAL  47   9.211 -10.806 -10.806
  359    H    CYS  48           HN       CYS  48   9.876  -7.134  -7.134
  360    HA   CYS  48           HA       CYS  48  12.271  -6.881  -6.881
  361   1HB   CYS  48           HB2      CYS  48   9.468  -7.490  -7.490
  362   2HB   CYS  48           HB1      CYS  48  10.909  -7.304  -7.304
  363    H    ALA  49           HN       ALA  49  12.326  -4.790  -4.790
  364    HA   ALA  49           HA       ALA  49  10.063  -2.944  -2.944
  365   1HB   ALA  49           HB2      ALA  49  12.168  -3.161  -3.161
  366   2HB   ALA  49           HB1      ALA  49  11.860  -1.511  -1.511
  367   3HB   ALA  49           HB3      ALA  49  10.547  -2.478  -2.478
  368    H    ALA  50           HN       ALA  50  10.272  -1.275  -1.275
  369    HA   ALA  50           HA       ALA  50  12.825  -0.118  -0.118
  370   1HB   ALA  50           HB2      ALA  50  12.683  -2.440  -2.440
  371   2HB   ALA  50           HB1      ALA  50  11.383  -1.766  -1.766
  372   3HB   ALA  50           HB3      ALA  50  13.005  -1.080  -1.080
  373    H    THR  51           HN       THR  51  12.464   1.830   1.830
  374    HA   THR  51           HA       THR  51   9.608   2.685   2.685
  375    HB   THR  51           HB       THR  51  12.027   4.382   4.382
  376    HG1  THR  51           HG1      THR  51  12.533   3.459   3.459
  377   1HG2  THR  51          HG22      THR  51   9.312   4.891   4.891
  378   2HG2  THR  51          HG21      THR  51  10.568   6.114   6.114
  379   3HG2  THR  51          HG23      THR  51   9.846   5.372   5.372
  380    H    TYR  52           HN       TYR  52   8.651   2.266   2.266
  381    HA   TYR  52           HA       TYR  52  10.363   2.302   2.302
  382   1HB   TYR  52           HB2      TYR  52   8.546   0.888   0.888
  383   2HB   TYR  52           HB1      TYR  52   9.235   0.183   0.183
  384    HD1  TYR  52           HD1      TYR  52   6.334   2.020   2.020
  385    HD2  TYR  52           HD2      TYR  52   7.914  -0.032  -0.032
  386    HE1  TYR  52           HE1      TYR  52   4.057   2.017   2.017
  387    HE2  TYR  52           HE2      TYR  52   5.635  -0.034  -0.034
  388    HH   TYR  52           HH       TYR  52   3.259   0.107   0.107
  389    H    MET  53           HN       MET  53   9.756   3.529   3.529
  390    HA   MET  53           HA       MET  53   8.070   5.853   5.853
  391   1HB   MET  53           HB2      MET  53   9.238   4.651   4.651
  392   2HB   MET  53           HB1      MET  53   8.594   6.283   6.283
  393   1HG   MET  53           HG2      MET  53  11.224   5.661   5.661
  394   2HG   MET  53           HG1      MET  53  10.451   7.055   7.055
  395   1HE   MET  53           HE2      MET  53   9.353   7.045   7.045
  396   2HE   MET  53           HE1      MET  53  10.512   6.544   6.544
  397   3HE   MET  53           HE3      MET  53  11.032   7.575   7.575
  398    H    MET  54           HN       MET  54   5.980   6.176   6.176
  399    HA   MET  54           HA       MET  54   4.313   3.813   3.813
  400   1HB   MET  54           HB2      MET  54   4.013   6.583   6.583
  401   2HB   MET  54           HB1      MET  54   2.706   5.399   5.399
  402   1HG   MET  54           HG2      MET  54   4.164   6.674   6.674
  403   2HG   MET  54           HG1      MET  54   2.445   6.771   6.771
  404   1HE   MET  54           HE3      MET  54   5.250   5.351   5.351
  405   2HE   MET  54           HE2      MET  54   4.704   4.112   4.112
  406   3HE   MET  54           HE1      MET  54   5.206   3.658   3.658
  407    H    GLY  55           HN       GLY  55   4.042   2.311   2.311
  408   1HA   GLY  55           HA2      GLY  55   3.880   1.461   1.461
  409   2HA   GLY  55           HA1      GLY  55   4.572   2.967   2.967
  410    H    ASN  56           HN       ASN  56   6.060   1.125   1.125
  411    HA   ASN  56           HA       ASN  56   8.082  -0.020  -0.020
  412   1HB   ASN  56           HB2      ASN  56   8.520   2.444   2.444
  413   2HB   ASN  56           HB1      ASN  56   9.073   1.546   1.546
  414   1HD2  ASN  56          HD22      ASN  56  11.425   1.698   1.698
  415   2HD2  ASN  56          HD21      ASN  56  10.003   2.615   2.615
  416    H    GLU  57           HN       GLU  57   9.791  -1.227  -1.227
  417    HA   GLU  57           HA       GLU  57   8.565  -2.424  -2.424
  418   1HB   GLU  57           HB2      GLU  57   9.708  -3.845  -3.845
  419   2HB   GLU  57           HB1      GLU  57   9.237  -4.655  -4.655
  420   1HG   GLU  57           HG2      GLU  57   7.367  -2.976  -2.976
  421   2HG   GLU  57           HG1      GLU  57   7.457  -4.736  -4.736
  422    H    LEU  58           HN       LEU  58  10.155  -3.217  -3.217
  423    HA   LEU  58           HA       LEU  58  13.018  -2.716  -2.716
  424   1HB   LEU  58           HB2      LEU  58  11.461  -1.810  -1.810
  425   2HB   LEU  58           HB1      LEU  58  13.223  -1.786  -1.786
  426    HG   LEU  58           HG       LEU  58  11.390  -0.379  -0.379
  427   1HD1  LEU  58          HD13      LEU  58  13.053   0.641   0.641
  428   2HD1  LEU  58          HD12      LEU  58  12.252   1.669   1.669
  429   3HD1  LEU  58          HD11      LEU  58  11.293   0.653   0.653
  430   1HD2  LEU  58          HD21      LEU  58  14.388  -0.593  -0.593
  431   2HD2  LEU  58          HD23      LEU  58  13.425  -0.849  -0.849
  432   3HD2  LEU  58          HD22      LEU  58  13.655   0.783   0.783
  433    H    THR  59           HN       THR  59  14.419  -3.566  -3.566
  434    HA   THR  59           HA       THR  59  13.493  -6.319  -6.319
  435    HB   THR  59           HB       THR  59  15.926  -6.747  -6.747
  436    HG1  THR  59           HG1      THR  59  17.339  -5.154  -5.154
  437   1HG2  THR  59          HG21      THR  59  14.456  -6.755  -6.755
  438   2HG2  THR  59          HG23      THR  59  15.238  -5.222  -5.222
  439   3HG2  THR  59          HG22      THR  59  16.202  -6.691  -6.691
  440    H    PHE  60           HN       PHE  60  14.236  -7.135  -7.135
  441    HA   PHE  60           HA       PHE  60  14.499  -4.957  -4.957
  442   1HB   PHE  60           HB2      PHE  60  13.426  -7.792  -7.792
  443   2HB   PHE  60           HB1      PHE  60  13.475  -6.695  -6.695
  444    HD1  PHE  60           HD2      PHE  60  12.636  -4.133  -4.133
  445    HD2  PHE  60           HD1      PHE  60  11.252  -8.006  -8.006
  446    HE1  PHE  60           HE2      PHE  60  10.484  -3.099  -3.099
  447    HE2  PHE  60           HE1      PHE  60   9.099  -6.974  -6.974
  448    HZ   PHE  60           HZ       PHE  60   8.717  -4.522  -4.522
  449    H    LEU  61           HN       LEU  61  16.493  -4.830  -4.830
  450    HA   LEU  61           HA       LEU  61  18.623  -6.692  -6.692
  451   1HB   LEU  61           HB2      LEU  61  18.246  -4.403  -4.403
  452   2HB   LEU  61           HB1      LEU  61  19.785  -5.240  -5.240
  453    HG   LEU  61           HG       LEU  61  18.244  -3.906  -3.906
  454   1HD1  LEU  61          HD13      LEU  61  19.233  -2.368  -2.368
  455   2HD1  LEU  61          HD12      LEU  61  20.816  -2.984  -2.984
  456   3HD1  LEU  61          HD11      LEU  61  19.825  -2.110  -2.110
  457   1HD2  LEU  61          HD22      LEU  61  20.916  -5.310  -5.310
  458   2HD2  LEU  61          HD21      LEU  61  19.592  -5.642  -5.642
  459   3HD2  LEU  61          HD23      LEU  61  20.557  -4.177  -4.177
  460    H    ASP  62           HN       ASP  62  16.512  -6.267  -6.267
  461    HA   ASP  62           HA       ASP  62  17.982  -7.995  -7.995
  462   1HB   ASP  62           HB2      ASP  62  15.960  -7.836  -7.836
  463   2HB   ASP  62           HB1      ASP  62  16.346  -6.269  -6.269
  464    H    ASP  63           HN       ASP  63  15.641  -9.678  -9.678
  465    HA   ASP  63           HA       ASP  63  16.269 -12.097 -12.097
  466   1HB   ASP  63           HB2      ASP  63  13.666 -10.988 -10.988
  467   2HB   ASP  63           HB1      ASP  63  13.871 -12.703 -12.703
  468    H    SER  64           HN       SER  64  14.554  -9.657  -9.657
  469    HA   SER  64           HA       SER  64  13.613  -9.532  -9.532
  470   1HB   SER  64           HB2      SER  64  15.339 -12.003 -12.003
  471   2HB   SER  64           HB1      SER  64  14.744 -10.989 -10.989
  472    HG   SER  64           HG       SER  64  16.742 -10.227 -10.227
  473    H    ILE  67           HN       ILE  67  13.305 -12.390 -12.390
  474    HA   ILE  67           HA       ILE  67  11.521 -13.876 -13.876
  475    HB   ILE  67           HB       ILE  67  11.461 -13.560 -13.560
  476   1HG1  ILE  67          HG12      ILE  67  12.750 -15.632 -15.632
  477   2HG1  ILE  67          HG11      ILE  67  13.614 -14.297 -14.297
  478   1HG2  ILE  67          HG23      ILE  67   9.912 -15.246 -15.246
  479   2HG2  ILE  67          HG22      ILE  67  10.590 -16.086 -16.086
  480   3HG2  ILE  67          HG21      ILE  67   9.498 -14.723 -14.723
  481   1HD1  ILE  67          HD12      ILE  67  12.552 -15.214 -15.214
  482   2HD1  ILE  67          HD11      ILE  67  12.347 -16.696 -16.696
  483   3HD1  ILE  67          HD13      ILE  67  13.959 -16.030 -16.030
  484    H    CYS  68           HN       CYS  68  11.065 -10.820 -10.820
  485    HA   CYS  68           HA       CYS  68   8.078 -10.968 -10.968
  486   1HB   CYS  68           HB2      CYS  68   9.785  -8.686  -8.686
  487   2HB   CYS  68           HB1      CYS  68   8.061  -8.931  -8.931
  488    H    THR  69           HN       THR  69   7.024  -9.370  -9.370
  489    HA   THR  69           HA       THR  69   8.843  -8.127  -8.127
  490    HB   THR  69           HB       THR  69   7.510 -10.076 -10.076
  491    HG1  THR  69           HG1      THR  69   7.615  -8.912  -8.912
  492   1HG2  THR  69          HG22      THR  69   5.136  -8.336  -8.336
  493   2HG2  THR  69          HG21      THR  69   5.056  -9.866  -9.866
  494   3HG2  THR  69          HG23      THR  69   5.598  -9.836  -9.836
  495    H    GLY  70           HN       GLY  70   8.461  -5.949  -5.949
  496   1HA   GLY  70           HA2      GLY  70   6.451  -4.602  -4.602
  497   2HA   GLY  70           HA1      GLY  70   7.838  -3.816  -3.816
  498    H    THR  71           HN       THR  71   4.530  -4.805  -4.805
  499    HA   THR  71           HA       THR  71   4.528  -3.461  -3.461
  500    HB   THR  71           HB       THR  71   2.673  -5.616  -5.616
  501    HG1  THR  71           HG1      THR  71   3.993  -7.064  -7.064
  502   1HG2  THR  71          HG21      THR  71   1.949  -4.173  -4.173
  503   2HG2  THR  71          HG23      THR  71   3.396  -4.662  -4.662
  504   3HG2  THR  71          HG22      THR  71   2.164  -5.857  -5.857
  505    H    SER  72           HN       SER  72   2.570  -2.232  -2.232
  506    HA   SER  72           HA       SER  72   0.676  -1.814  -1.814
  507   1HB   SER  72           HB2      SER  72   1.282   0.556   0.556
  508   2HB   SER  72           HB1      SER  72   2.684  -0.465  -0.465
  509    HG   SER  72           HG       SER  72   3.459   0.008   0.008
  510    H    SER  73           HN       SER  73  -1.117  -0.412  -0.412
  511    HA   SER  73           HA       SER  73  -1.343   0.230   0.230
  512   1HB   SER  73           HB2      SER  73  -2.304  -2.028  -2.028
  513   2HB   SER  73           HB1      SER  73  -3.366  -1.292  -1.292
  514    HG   SER  73           HG       SER  73  -3.474  -1.258  -1.258
  515    H    GLY  74           HN       GLY  74  -1.579   2.462   2.462
  516   1HA   GLY  74           HA2      GLY  74  -2.541   4.518   4.518
  517   2HA   GLY  74           HA1      GLY  74  -3.965   3.597   3.597
  518    H    ASN  75           HN       ASN  75  -4.438   3.982   3.982
  519    HA   ASN  75           HA       ASN  75  -2.273   4.711   4.711
  520   1HB   ASN  75           HB2      ASN  75  -5.303   4.650   4.650
  521   2HB   ASN  75           HB1      ASN  75  -4.252   5.243   5.243
  522   1HD2  ASN  75          HD22      ASN  75  -5.276   7.798   7.798
  523   2HD2  ASN  75          HD21      ASN  75  -6.135   6.390   6.390
  524    H    GLN  76           HN       GLN  76  -3.307   1.830   1.830
  525    HA   GLN  76           HA       GLN  76  -3.474   0.520   0.520
  526   1HB   GLN  76           HB2      GLN  76  -5.395   0.315   0.315
  527   2HB   GLN  76           HB1      GLN  76  -4.328  -0.308  -0.308
  528   1HG   GLN  76           HG2      GLN  76  -3.802  -2.223  -2.223
  529   2HG   GLN  76           HG1      GLN  76  -4.685  -1.604  -1.604
  530   1HE2  GLN  76          HE22      GLN  76  -7.868  -2.560  -2.560
  531   2HE2  GLN  76          HE21      GLN  76  -7.036  -1.675  -1.675
  532    H    VAL  77           HN       VAL  77  -1.797  -0.963  -0.963
  533    HA   VAL  77           HA       VAL  77   0.245  -1.417  -1.417
  534    HB   VAL  77           HB       VAL  77   1.809  -1.506  -1.506
  535   1HG1  VAL  77          HG12      VAL  77   0.477   0.753   0.753
  536   2HG1  VAL  77          HG11      VAL  77   0.265   0.774   0.774
  537   3HG1  VAL  77          HG13      VAL  77   1.888   0.734   0.734
  538   1HG2  VAL  77          HG22      VAL  77  -0.528  -2.100  -2.100
  539   2HG2  VAL  77          HG21      VAL  77   1.171  -2.375  -2.375
  540   3HG2  VAL  77          HG23      VAL  77   0.423  -0.812  -0.812
  541    H    ASN  78           HN       ASN  78   0.941  -3.528  -3.528
  542    HA   ASN  78           HA       ASN  78  -0.550  -5.725  -5.725
  543   1HB   ASN  78           HB2      ASN  78  -0.953  -5.282  -5.282
  544   2HB   ASN  78           HB1      ASN  78   0.745  -5.646  -5.646
  545    HD2  ASN  78          HD22      ASN  78  -1.883  -7.491  -7.491
  546    H    LEU  79           HN       LEU  79   0.743  -6.844  -6.844
  547    HA   LEU  79           HA       LEU  79   3.673  -7.111  -7.111
  548   1HB   LEU  79           HB2      LEU  79   2.059  -7.169  -7.169
  549   2HB   LEU  79           HB1      LEU  79   3.779  -7.543  -7.543
  550    HG   LEU  79           HG       LEU  79   2.542  -4.923  -4.923
  551   1HD1  LEU  79          HD11      LEU  79   2.991  -5.807  -5.807
  552   2HD1  LEU  79          HD13      LEU  79   4.387  -4.794  -4.794
  553   3HD1  LEU  79          HD12      LEU  79   2.759  -4.140  -4.140
  554   1HD2  LEU  79          HD23      LEU  79   5.282  -6.108  -6.108
  555   2HD2  LEU  79          HD22      LEU  79   4.505  -5.003  -5.003
  556   3HD2  LEU  79          HD21      LEU  79   5.152  -4.392  -4.392
  557    H    THR  80           HN       THR  80   4.371  -9.203  -9.203
  558    HA   THR  80           HA       THR  80   2.610 -11.483 -11.483
  559    HB   THR  80           HB       THR  80   4.067 -11.091 -11.091
  560    HG1  THR  80           HG1      THR  80   2.346 -10.018 -10.018
  561   1HG2  THR  80          HG21      THR  80   2.278 -13.270 -13.270
  562   2HG2  THR  80          HG23      THR  80   2.608 -13.069 -13.069
  563   3HG2  THR  80          HG22      THR  80   3.927 -13.426 -13.426
  564    H    ILE  81           HN       ILE  81   3.734 -13.480 -13.480
  565    HA   ILE  81           HA       ILE  81   6.701 -13.215 -13.215
  566    HB   ILE  81           HB       ILE  81   4.544 -14.761 -14.761
  567   1HG1  ILE  81          HG12      ILE  81   6.326 -12.548 -12.548
  568   2HG1  ILE  81          HG11      ILE  81   4.734 -12.237 -12.237
  569   1HG2  ILE  81          HG23      ILE  81   6.702 -15.998 -15.998
  570   2HG2  ILE  81          HG22      ILE  81   7.516 -14.579 -14.579
  571   3HG2  ILE  81          HG21      ILE  81   6.316 -15.441 -15.441
  572   1HD1  ILE  81          HD13      ILE  81   3.786 -13.906 -13.906
  573   2HD1  ILE  81          HD12      ILE  81   5.371 -13.932 -13.932
  574   3HD1  ILE  81          HD11      ILE  81   4.437 -12.437 -12.437
  575    H    GLN  82           HN       GLN  82   7.971 -14.896 -14.896
  576    HA   GLN  82           HA       GLN  82   6.489 -17.204 -17.204
  577   1HB   GLN  82           HB2      GLN  82   8.999 -15.763 -15.763
  578   2HB   GLN  82           HB1      GLN  82   8.400 -17.271 -17.271
  579   1HG   GLN  82           HG2      GLN  82   6.626 -16.266 -16.266
  580   2HG   GLN  82           HG1      GLN  82   6.471 -15.010 -15.010
  581   1HE2  GLN  82          HE22      GLN  82   7.983 -13.614 -13.614
  582   2HE2  GLN  82          HE21      GLN  82   6.599 -14.556 -14.556
  583    H    GLY  83           HN       GLY  83   6.986 -19.054 -19.054
  584   1HA   GLY  83           HA2      GLY  83   8.624 -20.750 -20.750
  585   2HA   GLY  83           HA1      GLY  83   9.716 -19.441 -19.441
  586    H    LEU  84           HN       LEU  84   6.328 -20.299 -20.299
  587    HA   LEU  84           HA       LEU  84   6.562 -19.290 -19.290
  588   1HB   LEU  84           HB2      LEU  84   4.442 -20.761 -20.761
  589   2HB   LEU  84           HB1      LEU  84   4.195 -20.193 -20.193
  590    HG   LEU  84           HG       LEU  84   5.027 -18.414 -18.414
  591   1HD1  LEU  84          HD12      LEU  84   2.487 -19.544 -19.544
  592   2HD1  LEU  84          HD11      LEU  84   2.402 -17.878 -17.878
  593   3HD1  LEU  84          HD13      LEU  84   2.858 -18.219 -18.219
  594   1HD2  LEU  84          HD21      LEU  84   4.315 -17.964 -17.964
  595   2HD2  LEU  84          HD23      LEU  84   5.753 -17.429 -17.429
  596   3HD2  LEU  84          HD22      LEU  84   4.195 -16.665 -16.665
  597    H    ARG  85           HN       ARG  85   7.232 -20.428 -20.428
  598    HA   ARG  85           HA       ARG  85   7.374 -23.405 -23.405
  599   1HB   ARG  85           HB2      ARG  85   8.771 -21.275 -21.275
  600   2HB   ARG  85           HB1      ARG  85   8.973 -23.004 -23.004
  601   1HG   ARG  85           HG2      ARG  85   9.666 -23.301 -23.301
  602   2HG   ARG  85           HG1      ARG  85   9.562 -21.553 -21.553
  603   1HD   ARG  85           HD2      ARG  85  11.804 -21.745 -21.745
  604   2HD   ARG  85           HD1      ARG  85  11.119 -21.576 -21.576
  605    HE   ARG  85           HE       ARG  85  11.029 -24.333 -24.333
  606   1HH1  ARG  85          HH21      ARG  85  13.321 -21.852 -21.852
  607   2HH1  ARG  85          HH22      ARG  85  14.437 -22.991 -22.991
  608   1HH2  ARG  85          HH11      ARG  85  12.501 -25.768 -25.768
  609   2HH2  ARG  85          HH12      ARG  85  13.981 -25.184 -25.184
  610    H    ALA  86           HN       ALA  86   6.940 -24.443 -24.443
  611    HA   ALA  86           HA       ALA  86   4.302 -23.836 -23.836
  612   1HB   ALA  86           HB2      ALA  86   6.662 -25.400 -25.400
  613   2HB   ALA  86           HB1      ALA  86   5.190 -25.269 -25.269
  614   3HB   ALA  86           HB3      ALA  86   5.134 -26.008 -26.008
  615    H    MET  87           HN       MET  87   7.497 -22.945 -22.945
  616    HA   MET  87           HA       MET  87   6.612 -21.577 -21.577
  617   1HB   MET  87           HB2      MET  87   8.912 -22.407 -22.407
  618   2HB   MET  87           HB1      MET  87   9.072 -21.163 -21.163
  619   1HG   MET  87           HG2      MET  87   8.673 -19.424 -19.424
  620   2HG   MET  87           HG1      MET  87   8.630 -20.695 -20.695
  621   1HE   MET  87           HE1      MET  87  10.127 -22.525 -22.525
  622   2HE   MET  87           HE3      MET  87  11.826 -22.539 -22.539
  623   3HE   MET  87           HE2      MET  87  11.361 -21.844 -21.844
  624    H    ASP  88           HN       ASP  88   7.176 -20.515 -20.515
  625    HA   ASP  88           HA       ASP  88   6.993 -17.699 -17.699
  626   1HB   ASP  88           HB2      ASP  88   6.254 -19.555 -19.555
  627   2HB   ASP  88           HB1      ASP  88   6.278 -17.802 -17.802
  628    H    THR  89           HN       THR  89   4.414 -20.131 -20.131
  629    HA   THR  89           HA       THR  89   2.197 -18.542 -18.542
  630    HB   THR  89           HB       THR  89   2.318 -20.821 -20.821
  631    HG1  THR  89           HG1      THR  89   2.250 -20.792 -20.792
  632   1HG2  THR  89          HG21      THR  89   0.172 -19.409 -19.409
  633   2HG2  THR  89          HG23      THR  89   0.160 -20.314 -20.314
  634   3HG2  THR  89          HG22      THR  89   0.065 -21.169 -21.169
  635    H    GLY  90           HN       GLY  90   1.075 -17.054 -17.054
  636   1HA   GLY  90           HA2      GLY  90   0.559 -16.881 -16.881
  637   2HA   GLY  90           HA1      GLY  90   2.176 -16.199 -16.199
  638    H    LEU  91           HN       LEU  91   1.635 -14.062 -14.062
  639    HA   LEU  91           HA       LEU  91  -0.391 -12.722 -12.722
  640   1HB   LEU  91           HB2      LEU  91  -0.642 -12.758 -12.758
  641   2HB   LEU  91           HB1      LEU  91   0.913 -11.942 -11.942
  642    HG   LEU  91           HG       LEU  91  -0.030 -10.082 -10.082
  643   1HD1  LEU  91          HD13      LEU  91  -2.342 -11.950 -11.950
  644   2HD1  LEU  91          HD12      LEU  91  -2.716 -10.235 -10.235
  645   3HD1  LEU  91          HD11      LEU  91  -1.898 -10.799 -10.799
  646   1HD2  LEU  91          HD23      LEU  91   0.043 -10.234 -10.234
  647   2HD2  LEU  91          HD22      LEU  91  -0.998  -9.009  -9.009
  648   3HD2  LEU  91          HD21      LEU  91  -1.698 -10.507 -10.507
  649    H    TYR  92           HN       TYR  92   0.421 -11.425 -11.425
  650    HA   TYR  92           HA       TYR  92   3.191 -10.323 -10.323
  651   1HB   TYR  92           HB2      TYR  92   1.451 -11.109 -11.109
  652   2HB   TYR  92           HB1      TYR  92   2.886 -10.106 -10.106
  653    HD1  TYR  92           HD1      TYR  92   1.692 -13.410 -13.410
  654    HD2  TYR  92           HD2      TYR  92   5.082 -11.036 -11.036
  655    HE1  TYR  92           HE1      TYR  92   3.146 -15.445 -15.445
  656    HE2  TYR  92           HE2      TYR  92   6.536 -13.067 -13.067
  657    HH   TYR  92           HH       TYR  92   5.956 -15.698 -15.698
  658    H    ILE  93           HN       ILE  93   3.143  -8.184  -8.184
  659    HA   ILE  93           HA       ILE  93   0.775  -6.504  -6.504
  660    HB   ILE  93           HB       ILE  93   3.597  -5.827  -5.827
  661   1HG1  ILE  93          HG12      ILE  93   2.685  -7.637  -7.637
  662   2HG1  ILE  93          HG11      ILE  93   2.951  -6.156  -6.156
  663   1HG2  ILE  93          HG23      ILE  93   1.010  -4.361  -4.361
  664   2HG2  ILE  93          HG22      ILE  93   2.285  -4.068  -4.068
  665   3HG2  ILE  93          HG21      ILE  93   2.583  -3.762  -3.762
  666   1HD1  ILE  93          HD13      ILE  93   0.348  -6.221  -6.221
  667   2HD1  ILE  93          HD12      ILE  93   0.597  -7.613  -7.613
  668   3HD1  ILE  93          HD11      ILE  93   0.784  -5.973  -5.973
  669    H    CYS  94           HN       CYS  94   0.318  -5.063  -5.063
  670    HA   CYS  94           HA       CYS  94   2.231  -4.721  -4.721
  671   1HB   CYS  94           HB2      CYS  94   0.350  -3.684  -3.684
  672   2HB   CYS  94           HB1      CYS  94  -0.305  -5.062  -5.062
  673    H    LYS  95           HN       LYS  95   3.140  -2.583  -2.583
  674    HA   LYS  95           HA       LYS  95   2.737  -0.485  -0.485
  675   1HB   LYS  95           HB2      LYS  95   4.545  -2.051  -2.051
  676   2HB   LYS  95           HB1      LYS  95   5.397  -1.707  -1.707
  677   1HG   LYS  95           HG2      LYS  95   6.300   0.145   0.145
  678   2HG   LYS  95           HG1      LYS  95   4.692   0.795   0.795
  679   1HD   LYS  95           HD2      LYS  95   4.597  -0.536  -0.536
  680   2HD   LYS  95           HD1      LYS  95   6.243  -1.097  -1.097
  681   1HE   LYS  95           HE2      LYS  95   7.029   1.278   1.278
  682   2HE   LYS  95           HE1      LYS  95   5.383   1.786   1.786
  683   1HZ   LYS  95           HZ2      LYS  95   5.523   0.129   0.129
  684   2HZ   LYS  95           HZ1      LYS  95   7.185  -0.007  -0.007
  685   3HZ   LYS  95           HZ3      LYS  95   6.539   1.480   1.480
  686    H    VAL  96           HN       VAL  96   2.606   1.397   1.397
  687    HA   VAL  96           HA       VAL  96   4.045   1.706   1.706
  688    HB   VAL  96           HB       VAL  96   1.812   1.048   1.048
  689   1HG1  VAL  96          HG13      VAL  96   0.962   3.066   3.066
  690   2HG1  VAL  96          HG12      VAL  96  -0.151   2.247   2.247
  691   3HG1  VAL  96          HG11      VAL  96   0.798   1.304   1.304
  692   1HG2  VAL  96          HG21      VAL  96   2.792   3.450   3.450
  693   2HG2  VAL  96          HG23      VAL  96   1.334   2.676   2.676
  694   3HG2  VAL  96          HG22      VAL  96   1.211   3.916   3.916
  695    H    GLU  97           HN       GLU  97   5.477   3.322   3.322
  696    HA   GLU  97           HA       GLU  97   4.556   5.735   5.735
  697   1HB   GLU  97           HB2      GLU  97   7.135   4.157   4.157
  698   2HB   GLU  97           HB1      GLU  97   6.890   5.683   5.683
  699   1HG   GLU  97           HG2      GLU  97   5.354   3.089   3.089
  700   2HG   GLU  97           HG1      GLU  97   6.433   3.869   3.869
  701    H    LEU  98           HN       LEU  98   4.981   7.648   7.648
  702    HA   LEU  98           HA       LEU  98   6.551   7.734   7.734
  703   1HB   LEU  98           HB2      LEU  98   4.989   9.676   9.676
  704   2HB   LEU  98           HB1      LEU  98   5.894  10.237  10.237
  705    HG   LEU  98           HG       LEU  98   3.387   9.765   9.765
  706   1HD1  LEU  98          HD13      LEU  98   5.594   8.764   8.764
  707   2HD1  LEU  98          HD12      LEU  98   3.916   8.544   8.544
  708   3HD1  LEU  98          HD11      LEU  98   4.546  10.167  10.167
  709   1HD2  LEU  98          HD21      LEU  98   3.518   7.491   7.491
  710   2HD2  LEU  98          HD23      LEU  98   2.633   7.543   7.543
  711   3HD2  LEU  98          HD22      LEU  98   4.278   6.904   6.904
  712    H    MET  99           HN       MET  99   8.578   7.015   7.015
  713    HA   MET  99           HA       MET  99   9.632   8.442   8.442
  714   1HB   MET  99           HB2      MET  99  10.009   6.050   6.050
  715   2HB   MET  99           HB1      MET  99  10.976   6.550   6.550
  716   1HG   MET  99           HG2      MET  99  12.363   6.040   6.040
  717   2HG   MET  99           HG1      MET  99  12.564   7.691   7.691
  718   1HE   MET  99           HE2      MET  99  10.328   5.481   5.481
  719   2HE   MET  99           HE1      MET  99  11.186   5.621   5.621
  720   3HE   MET  99           HE3      MET  99   9.606   6.387   6.387
  721    H    TYR 100           HN       TYR 100  10.632   8.297   8.297
  722    HA   TYR 100           HA       TYR 100  12.785  10.186  10.186
  723   1HB   TYR 100           HB2      TYR 100  11.305   8.985   8.985
  724   2HB   TYR 100           HB1      TYR 100  12.614  10.143  10.143
  725    HD1  TYR 100           HD1      TYR 100  11.749   6.814   6.814
  726    HD2  TYR 100           HD2      TYR 100  14.920   9.526   9.526
  727    HE1  TYR 100           HE1      TYR 100  13.453   5.026   5.026
  728    HE2  TYR 100           HE2      TYR 100  16.611   7.736   7.736
  729    HH   TYR 100           HH       TYR 100  16.244   5.274   5.274
  730    HA   PRO 101           HA       PRO 101   9.926  13.462  13.462
  731   1HB   PRO 101           HB2      PRO 101   7.244  13.047  13.047
  732   2HB   PRO 101           HB1      PRO 101   8.362  12.572  12.572
  733   1HG   PRO 101           HG2      PRO 101   6.947  10.912  10.912
  734   2HG   PRO 101           HG1      PRO 101   7.613  10.480  10.480
  735   1HD   PRO 101           HD2      PRO 101   8.731   9.950   9.950
  736   2HD   PRO 101           HD1      PRO 101   9.475   9.635   9.635
  737    HA   PRO 102           HA       PRO 102   8.816  14.458  14.458
  738   1HB   PRO 102           HB2      PRO 102   9.738  17.098  17.098
  739   2HB   PRO 102           HB1      PRO 102  10.817  15.716  15.716
  740   1HG   PRO 102           HG2      PRO 102  10.347  17.350  17.350
  741   2HG   PRO 102           HG1      PRO 102  11.843  16.535  16.535
  742   1HD   PRO 102           HD2      PRO 102  10.127  15.652  15.652
  743   2HD   PRO 102           HD1      PRO 102  11.313  14.630  14.630
  744    HA   PRO 103           HA       PRO 103   8.166  15.731  15.731
  745   1HB   PRO 103           HB2      PRO 103   6.970  15.767  15.767
  746   2HB   PRO 103           HB1      PRO 103   8.054  16.991  16.991
  747   1HG   PRO 103           HG2      PRO 103   5.441  17.355  17.355
  748   2HG   PRO 103           HG1      PRO 103   6.412  18.305  18.305
  749   1HD   PRO 103           HD2      PRO 103   4.771  15.847  15.847
  750   2HD   PRO 103           HD1      PRO 103   4.635  17.539  17.539
  751    H    TYR 104           HN       TYR 104   7.688  13.996  13.996
  752    HA   TYR 104           HA       TYR 104   6.613  11.646  11.646
  753   1HB   TYR 104           HB2      TYR 104   8.856  11.556  11.556
  754   2HB   TYR 104           HB1      TYR 104   8.243  11.989  11.989
  755    HD1  TYR 104           HD1      TYR 104   6.349   9.723   9.723
  756    HD2  TYR 104           HD2      TYR 104   9.059  10.022  10.022
  757    HE1  TYR 104           HE1      TYR 104   5.886   7.340   7.340
  758    HE2  TYR 104           HE2      TYR 104   8.615   7.637   7.637
  759    HH   TYR 104           HH       TYR 104   7.857   5.594   5.594
  760    H    TYR 105           HN       TYR 105   4.656  10.843  10.843
  761    HA   TYR 105           HA       TYR 105   3.562  10.674  10.674
  762   1HB   TYR 105           HB2      TYR 105   1.569  12.093  12.093
  763   2HB   TYR 105           HB1      TYR 105   3.066  13.005  13.005
  764    HD1  TYR 105           HD1      TYR 105   4.240  13.670  13.670
  765    HD2  TYR 105           HD2      TYR 105   0.181  12.216  12.216
  766    HE1  TYR 105           HE1      TYR 105   3.766  14.654  14.654
  767    HE2  TYR 105           HE2      TYR 105  -0.300  13.189  13.189
  768    HH   TYR 105           HH       TYR 105   1.575  13.716  13.716
  769    H    LEU 106           HN       LEU 106   2.781   8.593   8.593
  770    HA   LEU 106           HA       LEU 106   0.656   8.114   8.114
  771   1HB   LEU 106           HB2      LEU 106   3.329   7.463   7.463
  772   2HB   LEU 106           HB1      LEU 106   2.565   5.939   5.939
  773    HG   LEU 106           HG       LEU 106   2.382   6.362   6.362
  774   1HD1  LEU 106          HD12      LEU 106  -0.247   6.606   6.606
  775   2HD1  LEU 106          HD11      LEU 106  -0.119   6.279   6.279
  776   3HD1  LEU 106          HD13      LEU 106   0.529   5.126   5.126
  777   1HD2  LEU 106          HD21      LEU 106   2.433   8.896   8.896
  778   2HD2  LEU 106          HD23      LEU 106   1.317   8.296   8.296
  779   3HD2  LEU 106          HD22      LEU 106   0.708   8.794   8.794
  780    H    GLY 108           HN       GLY 108   0.940   5.123   5.123
  781   1HA   GLY 108           HA2      GLY 108   0.494   4.803   4.803
  782   2HA   GLY 108           HA1      GLY 108  -0.925   4.602   4.602
  783    H    ILE 109           HN       ILE 109  -0.047   2.562   2.562
  784    HA   ILE 109           HA       ILE 109   1.074   0.582   0.582
  785    HB   ILE 109           HB       ILE 109   1.326   0.912   0.912
  786   1HG1  ILE 109          HG12      ILE 109   3.814   0.797   0.797
  787   2HG1  ILE 109          HG11      ILE 109   3.188   1.153   1.153
  788   1HG2  ILE 109          HG21      ILE 109   1.055  -1.471  -1.471
  789   2HG2  ILE 109          HG23      ILE 109   2.384  -1.322  -1.322
  790   3HG2  ILE 109          HG22      ILE 109   2.683  -1.128  -1.128
  791   1HD1  ILE 109          HD12      ILE 109   2.089   2.888   2.888
  792   2HD1  ILE 109          HD11      ILE 109   3.834   3.043   3.043
  793   3HD1  ILE 109          HD13      ILE 109   2.754   3.304   3.304
  794    H    GLY 110           HN       GLY 110  -0.017  -1.491  -1.491
  795   1HA   GLY 110           HA2      GLY 110  -2.786  -1.413  -1.413
  796   2HA   GLY 110           HA1      GLY 110  -2.125  -2.642  -2.642
  797    H    ASN 111           HN       ASN 111  -3.446  -3.880  -3.880
  798    HA   ASN 111           HA       ASN 111  -1.560  -4.379  -4.379
  799   1HB   ASN 111           HB2      ASN 111  -4.542  -4.679  -4.679
  800   2HB   ASN 111           HB1      ASN 111  -3.672  -5.438  -5.438
  801    HD2  ASN 111          HD22      ASN 111  -4.443  -2.872  -2.872
  802    H    GLY 112           HN       GLY 112  -1.567  -5.603  -5.603
  803   1HA   GLY 112           HA2      GLY 112  -0.670  -7.641  -7.641
  804   2HA   GLY 112           HA1      GLY 112  -0.862  -8.253  -8.253
  805    H    THR 113           HN       THR 113  -1.346  -9.427  -9.427
  806    HA   THR 113           HA       THR 113  -4.255 -10.181 -10.181
  807    HB   THR 113           HB       THR 113  -2.246 -10.263 -10.263
  808    HG1  THR 113           HG1      THR 113  -2.968  -8.215  -8.215
  809   1HG2  THR 113          HG21      THR 113  -5.093 -11.249 -11.249
  810   2HG2  THR 113          HG23      THR 113  -4.355 -10.878 -10.878
  811   3HG2  THR 113          HG22      THR 113  -3.667 -12.149 -12.149
  812    H    GLN 114           HN       GLN 114  -4.453 -12.358 -12.358
  813    HA   GLN 114           HA       GLN 114  -2.081 -13.931 -13.931
  814   1HB   GLN 114           HB2      GLN 114  -4.444 -13.989 -13.989
  815   2HB   GLN 114           HB1      GLN 114  -4.905 -14.992 -14.992
  816   1HG   GLN 114           HG2      GLN 114  -4.252 -16.547 -16.547
  817   2HG   GLN 114           HG1      GLN 114  -2.847 -16.420 -16.420
  818   1HE2  GLN 114          HE22      GLN 114  -1.046 -15.919 -15.919
  819   2HE2  GLN 114          HE21      GLN 114  -1.407 -17.023 -17.023
  820    H    ILE 115           HN       ILE 115  -1.076 -15.454 -15.454
  821    HA   ILE 115           HA       ILE 115  -2.371 -15.775 -15.775
  822    HB   ILE 115           HB       ILE 115   0.548 -15.746 -15.746
  823   1HG1  ILE 115          HG12      ILE 115  -1.013 -14.050 -14.050
  824   2HG1  ILE 115          HG11      ILE 115  -0.588 -13.554 -13.554
  825   1HG2  ILE 115          HG22      ILE 115  -0.617 -16.400 -16.400
  826   2HG2  ILE 115          HG21      ILE 115   1.094 -16.129 -16.129
  827   3HG2  ILE 115          HG23      ILE 115   0.265 -17.512 -17.512
  828   1HD1  ILE 115          HD11      ILE 115   1.857 -14.223 -14.223
  829   2HD1  ILE 115          HD13      ILE 115   1.168 -13.899 -13.899
  830   3HD1  ILE 115          HD12      ILE 115   1.190 -12.630 -12.630
  831    H    TYR 116           HN       TYR 116  -3.068 -17.835 -17.835
  832    HA   TYR 116           HA       TYR 116  -2.044 -20.114 -20.114
  833   1HB   TYR 116           HB2      TYR 116  -4.601 -19.581 -19.581
  834   2HB   TYR 116           HB1      TYR 116  -4.216 -21.156 -21.156
  835    HD1  TYR 116           HD1      TYR 116  -3.062 -20.615 -20.615
  836    HD2  TYR 116           HD2      TYR 116  -6.320 -18.572 -18.572
  837    HE1  TYR 116           HE1      TYR 116  -4.013 -19.916 -19.916
  838    HE2  TYR 116           HE2      TYR 116  -7.244 -17.873 -17.873
  839    HH   TYR 116           HH       TYR 116  -6.327 -17.512 -17.512
  840    H    VAL 117           HN       VAL 117  -1.739 -22.189 -22.189
  841    HA   VAL 117           HA       VAL 117  -0.949 -21.703 -21.703
  842    HB   VAL 117           HB       VAL 117  -0.211 -23.905 -23.905
  843   1HG1  VAL 117          HG13      VAL 117   0.478 -23.388 -23.388
  844   2HG1  VAL 117          HG12      VAL 117   1.549 -24.335 -24.335
  845   3HG1  VAL 117          HG11      VAL 117  -0.104 -24.880 -24.880
  846   1HG2  VAL 117          HG21      VAL 117   0.776 -21.673 -21.673
  847   2HG2  VAL 117          HG23      VAL 117   2.003 -22.829 -22.829
  848   3HG2  VAL 117          HG22      VAL 117   1.407 -21.608 -21.608
  849    H    ILE 118           HN       ILE 118  -1.398 -23.532 -23.532
  850    HA   ILE 118           HA       ILE 118  -4.047 -24.798 -24.798
  851    HB   ILE 118           HB       ILE 118  -2.665 -23.722 -23.722
  852   1HG1  ILE 118          HG12      ILE 118  -3.561 -22.009 -22.009
  853   2HG1  ILE 118          HG11      ILE 118  -4.497 -22.063 -22.063
  854   1HG2  ILE 118          HG21      ILE 118  -5.157 -25.364 -25.364
  855   2HG2  ILE 118          HG23      ILE 118  -5.116 -24.103 -24.103
  856   3HG2  ILE 118          HG22      ILE 118  -3.931 -25.410 -25.410
  857   1HD1  ILE 118          HD13      ILE 118  -5.745 -23.918 -23.918
  858   2HD1  ILE 118          HD12      ILE 118  -5.348 -22.576 -22.576
  859   3HD1  ILE 118          HD11      ILE 118  -6.326 -22.295 -22.295
  860    H    ASP 119           HN       ASP 119  -4.212 -27.015 -27.015
  861    HA   ASP 119           HA       ASP 119  -1.733 -28.458 -28.458
  862   1HB   ASP 119           HB2      ASP 119  -2.734 -28.893 -28.893
  863   2HB   ASP 119           HB1      ASP 119  -4.226 -29.398 -29.398
  864    HA   PRO 120           HA       PRO 120  -4.221 -29.077 -29.077
  865   1HB   PRO 120           HB2      PRO 120  -2.323 -30.437 -30.437
  866   2HB   PRO 120           HB1      PRO 120  -2.332 -28.670 -28.670
  867   1HG   PRO 120           HG2      PRO 120  -0.713 -30.697 -30.697
  868   2HG   PRO 120           HG1      PRO 120  -0.233 -29.114 -29.114
  869   1HD   PRO 120           HD2      PRO 120  -0.784 -29.539 -29.539
  870   2HD   PRO 120           HD1      PRO 120  -1.078 -27.982 -27.982
  871    H    GLU 121           HN       GLU 121  -5.531 -30.802 -30.802
  872    HA   GLU 121           HA       GLU 121  -4.795 -33.524 -33.524
  873   1HB   GLU 121           HB2      GLU 121  -7.449 -32.053 -32.053
  874   2HB   GLU 121           HB1      GLU 121  -7.232 -33.738 -33.738
  875   1HG   GLU 121           HG2      GLU 121  -5.655 -33.085 -33.085
  876   2HG   GLU 121           HG1      GLU 121  -5.756 -31.399 -31.399
  877    HA   PRO 122           HA       PRO 122  -5.673 -34.637 -34.637
  878   1HB   PRO 122           HB2      PRO 122  -6.069 -37.329 -37.329
  879   2HB   PRO 122           HB1      PRO 122  -4.463 -36.573 -36.573
  880   1HG   PRO 122           HG2      PRO 122  -6.182 -37.445 -37.445
  881   2HG   PRO 122           HG1      PRO 122  -4.430 -37.596 -37.596
  882   1HD   PRO 122           HD2      PRO 122  -5.563 -35.688 -35.688
  883   2HD   PRO 122           HD1      PRO 122  -4.024 -35.447 -35.447
  884    H    CYS 123           HN       CYS 123  -7.924 -34.984 -34.984
  885    HA   CYS 123           HA       CYS 123 -10.144 -35.405 -35.405
  886   1HB   CYS 123           HB2      CYS 123  -9.647 -37.377 -37.377
  887   2HB   CYS 123           HB1      CYS 123  -9.917 -36.377 -36.377
  888    HG   CYS 123           HG       CYS 123 -12.402 -36.350 -36.350
  889    HA   PRO 124           HA       PRO 124 -11.648 -31.582 -31.582
  890   1HB   PRO 124           HB2      PRO 124 -14.299 -31.796 -31.796
  891   2HB   PRO 124           HB1      PRO 124 -13.037 -31.419 -31.419
  892   1HG   PRO 124           HG2      PRO 124 -14.377 -34.017 -34.017
  893   2HG   PRO 124           HG1      PRO 124 -13.922 -33.303 -33.303
  894   1HD   PRO 124           HD2      PRO 124 -12.474 -35.255 -35.255
  895   2HD   PRO 124           HD1      PRO 124 -11.744 -34.015 -34.015
  896    H    ASP 125           HN       ASP 125 -13.139 -30.803 -30.803
  897    HA   ASP 125           HA       ASP 125 -13.408 -32.751 -32.751
  898   1HB   ASP 125           HB2      ASP 125 -14.077 -30.744 -30.744
  899   2HB   ASP 125           HB1      ASP 125 -12.642 -30.413 -30.413
  900    H    SER 126           HN       SER 126 -15.669 -32.237 -32.237
  901    HA   SER 126           HA       SER 126 -17.720 -33.660 -33.660
  902   1HB   SER 126           HB2      SER 126 -19.072 -32.992 -32.992
  903   2HB   SER 126           HB1      SER 126 -17.442 -33.413 -33.413
  904    HG   SER 126           HG       SER 126 -17.097 -31.397 -31.397
  905    H    ASP 127           HN       ASP 127 -17.044 -30.197 -30.197
  906    HA   ASP 127           HA       ASP 127 -19.625 -29.430 -29.430
  907   1HB   ASP 127           HB2      ASP 127 -18.267 -28.117 -28.117
  908   2HB   ASP 127           HB1      ASP 127 -17.085 -27.824 -27.824
  909    H    GLN 128           HN       GLN 128 -19.977 -29.619 -29.619
  910    HA   GLN 128           HA       GLN 128 -17.633 -29.358 -29.358
  911   1HB   GLN 128           HB2      GLN 128 -20.167 -31.024 -31.024
  912   2HB   GLN 128           HB1      GLN 128 -18.960 -30.924 -30.924
  913   1HG   GLN 128           HG2      GLN 128 -17.247 -31.829 -31.829
  914   2HG   GLN 128           HG1      GLN 128 -18.390 -31.847 -31.847
  915   1HE2  GLN 128          HE22      GLN 128 -18.267 -35.239 -35.239
  916   2HE2  GLN 128          HE21      GLN 128 -17.050 -34.223 -34.223
  917    H    GLU 129           HN       GLU 129 -17.904 -27.968 -27.968
  918    HA   GLU 129           HA       GLU 129 -18.811 -26.165 -26.165
  919   1HB   GLU 129           HB2      GLU 129 -21.252 -27.896 -27.896
  920   2HB   GLU 129           HB1      GLU 129 -21.185 -26.603 -26.603
  921   1HG   GLU 129           HG2      GLU 129 -19.325 -28.998 -28.998
  922   2HG   GLU 129           HG1      GLU 129 -20.734 -28.846 -28.846
  923    HA   PRO 130           HA       PRO 130 -20.776 -24.462 -24.462
  924   1HB   PRO 130           HB2      PRO 130 -18.663 -22.983 -22.983
  925   2HB   PRO 130           HB1      PRO 130 -18.953 -24.665 -24.665
  926   1HG   PRO 130           HG2      PRO 130 -17.055 -23.586 -23.586
  927   2HG   PRO 130           HG1      PRO 130 -16.827 -24.887 -24.887
  928   1HD   PRO 130           HD2      PRO 130 -17.346 -25.348 -25.348
  929   2HD   PRO 130           HD1      PRO 130 -17.859 -26.451 -26.451
  930    H    LYS 131           HN       LYS 131 -21.578 -22.299 -22.299
  931    HA   LYS 131           HA       LYS 131 -20.415 -20.233 -20.233
  932   1HB   LYS 131           HB2      LYS 131 -21.778 -21.721 -21.721
  933   2HB   LYS 131           HB1      LYS 131 -23.183 -21.396 -21.396
  934   1HG   LYS 131           HG2      LYS 131 -23.337 -19.887 -19.887
  935   2HG   LYS 131           HG1      LYS 131 -22.801 -18.923 -18.923
  936   1HD   LYS 131           HD2      LYS 131 -20.465 -19.125 -19.125
  937   2HD   LYS 131           HD1      LYS 131 -20.990 -20.102 -20.102
  938   1HE   LYS 131           HE2      LYS 131 -22.295 -18.229 -18.229
  939   2HE   LYS 131           HE1      LYS 131 -21.877 -17.242 -17.242
  940   1HZ   LYS 131           HZ1      LYS 131 -19.530 -17.551 -17.551
  941   2HZ   LYS 131           HZ3      LYS 131 -19.947 -18.444 -18.444
  942   3HZ   LYS 131           HZ2      LYS 131 -20.351 -16.796 -16.796
  943    H1   NAG 132           H1       NAG 132  -2.479  -4.922  -4.922
  944    H2   NAG 132           H2       NAG 132  -1.847  -2.182  -2.182
  945    H3   NAG 132           H3       NAG 132  -0.028  -4.664  -4.664
  946    H4   NAG 132           H4       NAG 132  -1.278  -3.650  -3.650
  947    H5   NAG 132           H5       NAG 132  -2.044  -6.149  -6.149
  948   1H6   NAG 132           H61      NAG 132  -2.465  -6.620  -6.620
  949   2H6   NAG 132           H62      NAG 132  -2.864  -4.940  -4.940
  950   1H8   NAG 132           H81      NAG 132   2.128  -2.033  -2.033
  951   2H8   NAG 132           H82      NAG 132   1.128  -2.928  -2.928
  952   3H8   NAG 132           H83      NAG 132   1.355  -1.158  -1.158
  953    HN2  NAG 132           HN2      NAG 132  -1.216  -3.056  -3.056
  954    HO3  NAG 132           HO3      NAG 132   1.318  -2.997  -2.997
  955    H1   NAG 133           H1       NAG 133   0.078  -4.132  -4.132
  956    H2   NAG 133           H2       NAG 133   1.802  -6.649  -6.649
  957    H3   NAG 133           H3       NAG 133   1.710  -4.817  -4.817
  958    H4   NAG 133           H4       NAG 133   3.952  -5.119  -5.119
  959    H5   NAG 133           H5       NAG 133   2.057  -2.738  -2.738
  960   1H6   NAG 133           H61      NAG 133   4.336  -3.269  -3.269
  961   2H6   NAG 133           H62      NAG 133   4.220  -2.013  -2.013
  962   1H8   NAG 133           H81      NAG 133  -2.164  -6.388  -6.388
  963   2H8   NAG 133           H82      NAG 133  -2.087  -7.618  -7.618
  964   3H8   NAG 133           H83      NAG 133  -0.903  -7.656  -7.656
  965    HN2  NAG 133           HN2      NAG 133   0.034  -7.610  -7.610
  966    HO3  NAG 133           HO3      NAG 133   3.654  -6.173  -6.173
  967    HO6  NAG 133           HO6      NAG 133   2.251  -1.315  -1.315
  968    H1   FUC 134           H1       FUC 134  -5.280  -6.273  -6.273
  969    H2   FUC 134           H2       FUC 134  -3.665  -7.168  -7.168
  970    H3   FUC 134           H3       FUC 134  -6.090  -8.951  -8.951
  971    H4   FUC 134           H4       FUC 134  -4.373 -10.827 -10.827
  972    H5   FUC 134           H5       FUC 134  -5.176  -9.734  -9.734
  973   1H6   FUC 134           H61      FUC 134  -3.549 -10.597 -10.597
  974   2H6   FUC 134           H62      FUC 134  -3.104 -11.408 -11.408
  975   3H6   FUC 134           H63      FUC 134  -2.222  -9.940  -9.940
  976    HO2  FUC 134           HO2      FUC 134  -5.073  -5.693  -5.693
  977    HO3  FUC 134           HO3      FUC 134  -5.642  -8.716  -8.716
  978    HO4  FUC 134           HO4      FUC 134  -2.291 -10.419 -10.419
  979    H1   MAN 135           H1       MAN 135   5.533  -5.266  -5.266
  980    H2   MAN 135           H2       MAN 135   5.900  -3.387  -3.387
  981    H3   MAN 135           H3       MAN 135   7.913  -4.542  -4.542
  982    H4   MAN 135           H4       MAN 135   8.126  -2.561  -2.561
  983    H5   MAN 135           H5       MAN 135   7.421  -5.554  -5.554
  984   1H6   MAN 135           H61      MAN 135   7.692  -3.414  -3.414
  985   2H6   MAN 135           H62      MAN 135   6.834  -4.951  -4.951
  986    HO2  MAN 135           HO2      MAN 135   6.373  -1.785  -1.785
  987    HO3  MAN 135           HO3      MAN 135   9.094  -2.986  -2.986
  988    HO4  MAN 135           HO4      MAN 135   9.603  -4.865  -4.865
  989    HO6  MAN 135           HO6      MAN 135   9.592  -4.478  -4.478
  990    H1   NAG 136           H1       NAG 136   0.483  -9.227  -9.227
  991    H2   NAG 136           H2       NAG 136  -2.134  -9.318  -9.318
  992    H3   NAG 136           H3       NAG 136   0.092 -11.436 -11.436
  993    H4   NAG 136           H4       NAG 136  -0.503  -9.596  -9.596
  994    H5   NAG 136           H5       NAG 136   1.803  -9.435  -9.435
  995   1H6   NAG 136           H61      NAG 136   2.563  -7.690  -7.690
  996   2H6   NAG 136           H62      NAG 136   2.106  -8.910  -8.910
  997   1H8   NAG 136           H81      NAG 136  -4.085 -11.863 -11.863
  998   2H8   NAG 136           H82      NAG 136  -3.409 -10.239 -10.239
  999   3H8   NAG 136           H83      NAG 136  -4.912 -10.410 -10.410
 1000    HN2  NAG 136           HN2      NAG 136  -1.342 -10.662 -10.662
 1001    HO3  NAG 136           HO3      NAG 136  -1.979 -12.249 -12.249
 1002    H1   NAG 137           H1       NAG 137   2.372 -10.871 -10.871
 1003    H2   NAG 137           H2       NAG 137   1.717 -13.425 -13.425
 1004    H3   NAG 137           H3       NAG 137   3.979 -12.939 -12.939
 1005    H4   NAG 137           H4       NAG 137   4.191 -13.350 -13.350
 1006    H5   NAG 137           H5       NAG 137   4.640 -10.764 -10.764
 1007   1H6   NAG 137           H61      NAG 137   4.371 -10.051 -10.051
 1008   2H6   NAG 137           H62      NAG 137   5.153 -11.633 -11.633
 1009   1H8   NAG 137           H81      NAG 137   1.019 -16.113 -16.113
 1010   2H8   NAG 137           H82      NAG 137   0.975 -14.734 -14.734
 1011   3H8   NAG 137           H83      NAG 137  -0.551 -15.434 -15.434
 1012    HN2  NAG 137           HN2      NAG 137   1.558 -12.774 -12.774
 1013    HO3  NAG 137           HO3      NAG 137   4.330 -15.029 -15.029
 1014    HO6  NAG 137           HO6      NAG 137   6.191  -9.278  -9.278
 1015    H1   FUC 138           H1       FUC 138   0.045  -8.374  -8.374
 1016    H2   FUC 138           H2       FUC 138  -0.250  -6.048  -6.048
 1017    H3   FUC 138           H3       FUC 138   0.263  -4.918  -4.918
 1018    H4   FUC 138           H4       FUC 138   2.363  -4.048  -4.048
 1019    H5   FUC 138           H5       FUC 138   2.820  -6.418  -6.418
 1020   1H6   FUC 138           H61      FUC 138   3.730  -6.829  -6.829
 1021   2H6   FUC 138           H62      FUC 138   4.647  -6.843  -6.843
 1022   3H6   FUC 138           H63      FUC 138   4.263  -5.286  -5.286
 1023    HO2  FUC 138           HO2      FUC 138  -1.959  -7.284  -7.284
 1024    HO3  FUC 138           HO3      FUC 138  -1.301  -3.995  -3.995
 1025    HO4  FUC 138           HO4      FUC 138   1.448  -3.865  -3.865
 1026    H1   MAN 139           H1       MAN 139   5.720 -15.056 -15.056
 1027    H2   MAN 139           H2       MAN 139   5.596 -13.792 -13.792
 1028    H3   MAN 139           H3       MAN 139   6.614 -15.986 -15.986
 1029    H4   MAN 139           H4       MAN 139   9.300 -14.653 -14.653
 1030    H5   MAN 139           H5       MAN 139   7.655 -16.521 -16.521
 1031   1H6   MAN 139           H61      MAN 139   9.337 -15.815 -15.815
 1032   2H6   MAN 139           H62      MAN 139   9.957 -16.869 -16.869
 1033    HO2  MAN 139           HO2      MAN 139   7.058 -12.284 -12.284
 1034    HO3  MAN 139           HO3      MAN 139   8.175 -14.034 -14.034
 1035    HO4  MAN 139           HO4      MAN 139   9.700 -16.432 -16.432
 1036    HO6  MAN 139           HO6      MAN 139  11.093 -15.210 -15.210

  Start of MODEL    8
    1   1H    ALA   1           HT1      ALA   1  -8.739   4.650   4.650
    2   2H    ALA   1           HT3      ALA   1  -9.930   3.877   3.877
    3   3H    ALA   1           HT2      ALA   1  -8.676   2.968   2.968
    4    HA   ALA   1           HA       ALA   1 -10.683   2.660   2.660
    5   1HB   ALA   1           HB2      ALA   1 -11.696   4.764   4.764
    6   2HB   ALA   1           HB1      ALA   1 -10.540   5.691   5.691
    7   3HB   ALA   1           HB3      ALA   1 -11.748   4.688   4.688
    8    H    MET   1           HN       MET   1  -8.466   5.357   5.357
    9    HA   MET   1           HA       MET   1  -7.018   5.679   5.679
   10   1HB   MET   1           HB2      MET   1  -7.079   2.648   2.648
   11   2HB   MET   1           HB1      MET   1  -5.901   3.567   3.567
   12   1HG   MET   1           HG2      MET   1  -6.346   3.874   3.874
   13   2HG   MET   1           HG1      MET   1  -5.043   2.935   2.935
   14   1HE   MET   1           HE3      MET   1  -4.174   4.521   4.521
   15   2HE   MET   1           HE2      MET   1  -2.797   4.375   4.375
   16   3HE   MET   1           HE1      MET   1  -3.233   5.953   5.953
   17    H    HIS   2           HN       HIS   2  -6.796   5.276   5.276
   18    HA   HIS   2           HA       HIS   2  -9.420   4.487   4.487
   19   1HB   HIS   2           HB2      HIS   2  -7.500   6.725   6.725
   20   2HB   HIS   2           HB1      HIS   2  -8.971   6.337   6.337
   21    HD1  HIS   2           HD1      HIS   2 -11.228   6.327   6.327
   22    HD2  HIS   2           HD2      HIS   2  -7.947   8.573   8.573
   23    HE1  HIS   2           HE1      HIS   2 -12.101   7.973   7.973
   24    H    VAL   3           HN       VAL   3  -7.120   2.771   2.771
   25    HA   VAL   3           HA       VAL   3  -5.958   2.548   2.548
   26    HB   VAL   3           HB       VAL   3  -5.288   1.247   1.247
   27   1HG1  VAL   3          HG12      VAL   3  -4.685  -0.094  -0.094
   28   2HG1  VAL   3          HG11      VAL   3  -3.665   1.255   1.255
   29   3HG1  VAL   3          HG13      VAL   3  -3.305   0.383   0.383
   30   1HG2  VAL   3          HG23      VAL   3  -4.896   3.763   3.763
   31   2HG2  VAL   3          HG22      VAL   3  -3.485   2.806   2.806
   32   3HG2  VAL   3          HG21      VAL   3  -3.705   3.318   3.318
   33    H    ALA   4           HN       ALA   4  -6.546   0.855   0.855
   34    HA   ALA   4           HA       ALA   4  -8.495  -1.148  -1.148
   35   1HB   ALA   4           HB2      ALA   4  -7.951   0.132   0.132
   36   2HB   ALA   4           HB1      ALA   4  -8.868  -1.374  -1.374
   37   3HB   ALA   4           HB3      ALA   4  -9.463   0.076   0.076
   38    H    GLN   5           HN       GLN   5  -7.863  -3.274  -3.274
   39    HA   GLN   5           HA       GLN   5  -5.821  -4.312  -4.312
   40   1HB   GLN   5           HB2      GLN   5  -4.305  -4.956  -4.956
   41   2HB   GLN   5           HB1      GLN   5  -4.519  -3.207  -3.207
   42   1HG   GLN   5           HG2      GLN   5  -6.602  -3.990  -3.990
   43   2HG   GLN   5           HG1      GLN   5  -5.314  -5.084  -5.084
   44   1HE2  GLN   5          HE22      GLN   5  -5.005  -1.901  -1.901
   45   2HE2  GLN   5          HE21      GLN   5  -6.237  -3.053  -3.053
   46    HA   PRO   6           HA       PRO   6  -8.096  -8.044  -8.044
   47   1HB   PRO   6           HB2      PRO   6  -6.219  -9.931  -9.931
   48   2HB   PRO   6           HB1      PRO   6  -7.023  -8.945  -8.945
   49   1HG   PRO   6           HG2      PRO   6  -4.313  -8.652  -8.652
   50   2HG   PRO   6           HG1      PRO   6  -4.851  -8.399  -8.399
   51   1HD   PRO   6           HD2      PRO   6  -4.394  -6.370  -6.370
   52   2HD   PRO   6           HD1      PRO   6  -5.528  -6.256  -6.256
   53    H    ALA   7           HN       ALA   7  -8.376  -9.633  -9.633
   54    HA   ALA   7           HA       ALA   7  -6.673  -9.306  -9.306
   55   1HB   ALA   7           HB1      ALA   7  -9.293  -9.439  -9.439
   56   2HB   ALA   7           HB3      ALA   7  -9.013 -11.179 -11.179
   57   3HB   ALA   7           HB2      ALA   7  -8.514 -10.253 -10.253
   58    H    VAL   8           HN       VAL   8  -7.171 -11.604 -11.604
   59    HA   VAL   8           HA       VAL   8  -4.921 -13.163 -13.163
   60    HB   VAL   8           HB       VAL   8  -7.190 -13.857 -13.857
   61   1HG1  VAL   8          HG12      VAL   8  -7.770 -14.438 -14.438
   62   2HG1  VAL   8          HG11      VAL   8  -7.961 -15.861 -15.861
   63   3HG1  VAL   8          HG13      VAL   8  -8.854 -14.371 -14.371
   64   1HG2  VAL   8          HG22      VAL   8  -4.886 -15.167 -15.167
   65   2HG2  VAL   8          HG21      VAL   8  -6.256 -15.844 -15.844
   66   3HG2  VAL   8          HG23      VAL   8  -5.985 -16.242 -16.242
   67    H    VAL   9           HN       VAL   9  -4.100 -14.595 -14.595
   68    HA   VAL   9           HA       VAL   9  -5.259 -14.275 -14.275
   69    HB   VAL   9           HB       VAL   9  -2.538 -13.567 -13.567
   70   1HG1  VAL   9          HG12      VAL   9  -3.230 -14.317 -14.317
   71   2HG1  VAL   9          HG11      VAL   9  -1.791 -13.399 -13.399
   72   3HG1  VAL   9          HG13      VAL   9  -1.994 -15.055 -15.055
   73   1HG2  VAL   9          HG21      VAL   9  -4.639 -12.033 -12.033
   74   2HG2  VAL   9          HG23      VAL   9  -3.004 -11.484 -11.484
   75   3HG2  VAL   9          HG22      VAL   9  -4.021 -12.145 -12.145
   76    H    LEU  10           HN       LEU  10  -4.609 -15.984 -15.984
   77    HA   LEU  10           HA       LEU  10  -3.724 -18.478 -18.478
   78   1HB   LEU  10           HB2      LEU  10  -5.476 -18.082 -18.082
   79   2HB   LEU  10           HB1      LEU  10  -5.128 -19.627 -19.627
   80    HG   LEU  10           HG       LEU  10  -6.537 -17.290 -17.290
   81   1HD1  LEU  10          HD11      LEU  10  -7.509 -19.796 -19.796
   82   2HD1  LEU  10          HD13      LEU  10  -8.447 -19.068 -19.068
   83   3HD1  LEU  10          HD12      LEU  10  -8.109 -18.146 -18.146
   84   1HD2  LEU  10          HD23      LEU  10  -5.297 -19.716 -19.716
   85   2HD2  LEU  10          HD22      LEU  10  -5.984 -18.352 -18.352
   86   3HD2  LEU  10          HD21      LEU  10  -7.023 -19.680 -19.680
   87    H    ALA  11           HN       ALA  11  -1.792 -19.315 -19.315
   88    HA   ALA  11           HA       ALA  11  -0.422 -18.108 -18.108
   89   1HB   ALA  11           HB2      ALA  11   0.234 -20.202 -20.202
   90   2HB   ALA  11           HB1      ALA  11   1.359 -19.775 -19.775
   91   3HB   ALA  11           HB3      ALA  11   0.861 -18.557 -18.557
   92    H    SER  12           HN       SER  12   0.561 -19.599 -19.599
   93    HA   SER  12           HA       SER  12  -0.885 -22.157 -22.157
   94   1HB   SER  12           HB2      SER  12  -2.309 -20.324 -20.324
   95   2HB   SER  12           HB1      SER  12  -0.975 -19.809 -19.809
   96    HG   SER  12           HG       SER  12  -1.054 -21.860 -21.860
   97    H    SER  13           HN       SER  13   0.055 -23.409 -23.409
   98    HA   SER  13           HA       SER  13   1.890 -24.301 -24.301
   99   1HB   SER  13           HB2      SER  13   1.267 -22.323 -22.323
  100   2HB   SER  13           HB1      SER  13   2.365 -21.327 -21.327
  101    HG   SER  13           HG       SER  13   2.926 -23.403 -23.403
  102    H    ARG  14           HN       ARG  14   4.453 -22.375 -22.375
  103    HA   ARG  14           HA       ARG  14   6.066 -23.735 -23.735
  104   1HB   ARG  14           HB2      ARG  14   6.805 -22.301 -22.301
  105   2HB   ARG  14           HB1      ARG  14   6.287 -20.884 -20.884
  106   1HG   ARG  14           HG2      ARG  14   8.205 -20.853 -20.853
  107   2HG   ARG  14           HG1      ARG  14   7.989 -22.537 -22.537
  108   1HD   ARG  14           HD2      ARG  14   8.894 -23.221 -23.221
  109   2HD   ARG  14           HD1      ARG  14   9.278 -21.513 -21.513
  110    HE   ARG  14           HE       ARG  14  10.355 -22.018 -22.018
  111   1HH1  ARG  14          HH21      ARG  14  10.724 -23.438 -23.438
  112   2HH1  ARG  14          HH22      ARG  14  12.351 -23.936 -23.936
  113   1HH2  ARG  14          HH11      ARG  14  12.462 -22.683 -22.683
  114   2HH2  ARG  14          HH12      ARG  14  13.326 -23.515 -23.515
  115    H    GLY  15           HN       GLY  15   3.825 -21.143 -21.143
  116   1HA   GLY  15           HA2      GLY  15   3.073 -21.024 -21.024
  117   2HA   GLY  15           HA1      GLY  15   4.788 -21.067 -21.067
  118    H    ILE  16           HN       ILE  16   3.091 -19.291 -19.291
  119    HA   ILE  16           HA       ILE  16   4.357 -16.810 -16.810
  120    HB   ILE  16           HB       ILE  16   3.398 -17.868 -17.868
  121   1HG1  ILE  16          HG12      ILE  16   5.675 -17.099 -17.099
  122   2HG1  ILE  16          HG11      ILE  16   5.935 -16.549 -16.549
  123   1HG2  ILE  16          HG23      ILE  16   3.766 -14.970 -14.970
  124   2HG2  ILE  16          HG22      ILE  16   4.051 -15.512 -15.512
  125   3HG2  ILE  16          HG21      ILE  16   2.455 -15.699 -15.699
  126   1HD1  ILE  16          HD13      ILE  16   5.163 -19.412 -19.412
  127   2HD1  ILE  16          HD12      ILE  16   6.839 -18.890 -18.890
  128   3HD1  ILE  16          HD11      ILE  16   6.049 -18.717 -18.717
  129    H    ALA  17           HN       ALA  17   3.084 -15.664 -15.664
  130    HA   ALA  17           HA       ALA  17   0.131 -15.568 -15.568
  131   1HB   ALA  17           HB3      ALA  17   0.991 -16.503 -16.503
  132   2HB   ALA  17           HB2      ALA  17   1.640 -14.901 -14.901
  133   3HB   ALA  17           HB1      ALA  17  -0.098 -15.129 -15.129
  134    H    SER  18           HN       SER  18  -0.591 -13.623 -13.623
  135    HA   SER  18           HA       SER  18   1.116 -11.204 -11.204
  136   1HB   SER  18           HB2      SER  18   0.555 -10.525 -10.525
  137   2HB   SER  18           HB1      SER  18   1.115 -12.193 -12.193
  138    HG   SER  18           HG       SER  18  -0.755 -12.662 -12.662
  139    H    PHE  19           HN       PHE  19   0.070  -9.384  -9.384
  140    HA   PHE  19           HA       PHE  19  -2.877  -9.181  -9.181
  141   1HB   PHE  19           HB2      PHE  19  -3.001  -8.808  -8.808
  142   2HB   PHE  19           HB1      PHE  19  -2.441 -10.424 -10.424
  143    HD1  PHE  19           HD1      PHE  19   0.038 -10.965 -10.965
  144    HD2  PHE  19           HD2      PHE  19  -1.620  -7.252  -7.252
  145    HE1  PHE  19           HE1      PHE  19   2.113 -10.577 -10.577
  146    HE2  PHE  19           HE2      PHE  19   0.458  -6.862  -6.862
  147    HZ   PHE  19           HZ       PHE  19   2.324  -8.528  -8.528
  148    H    VAL  20           HN       VAL  20  -3.575  -6.964  -6.964
  149    HA   VAL  20           HA       VAL  20  -1.346  -4.982  -4.982
  150    HB   VAL  20           HB       VAL  20  -4.121  -4.957  -4.957
  151   1HG1  VAL  20          HG13      VAL  20  -3.267  -2.689  -2.689
  152   2HG1  VAL  20          HG12      VAL  20  -1.830  -3.007  -3.007
  153   3HG1  VAL  20          HG11      VAL  20  -3.415  -2.917  -2.917
  154   1HG2  VAL  20          HG22      VAL  20  -2.314  -6.525  -6.525
  155   2HG2  VAL  20          HG21      VAL  20  -3.084  -5.411  -5.411
  156   3HG2  VAL  20          HG23      VAL  20  -1.478  -5.053  -5.053
  157    H    CYS  21           HN       CYS  21  -1.215  -3.702  -3.702
  158    HA   CYS  21           HA       CYS  21  -3.609  -3.353  -3.353
  159   1HB   CYS  21           HB2      CYS  21  -1.431  -4.185  -4.185
  160   2HB   CYS  21           HB1      CYS  21  -0.672  -2.679  -2.679
  161    H    GLU  22           HN       GLU  22  -4.781  -1.646  -1.646
  162    HA   GLU  22           HA       GLU  22  -3.485   0.685   0.685
  163   1HB   GLU  22           HB2      GLU  22  -5.570  -0.263  -0.263
  164   2HB   GLU  22           HB1      GLU  22  -6.345   0.018   0.018
  165   1HG   GLU  22           HG2      GLU  22  -6.075   2.435   2.435
  166   2HG   GLU  22           HG1      GLU  22  -5.213   2.191   2.191
  167    H    TYR  23           HN       TYR  23  -3.257   2.720   2.720
  168    HA   TYR  23           HA       TYR  23  -3.978   3.018   3.018
  169   1HB   TYR  23           HB2      TYR  23  -1.852   4.174   4.174
  170   2HB   TYR  23           HB1      TYR  23  -1.536   2.654   2.654
  171    HD1  TYR  23           HD2      TYR  23  -1.856   6.341   6.341
  172    HD2  TYR  23           HD1      TYR  23  -0.757   2.602   2.602
  173    HE1  TYR  23           HE2      TYR  23  -0.813   7.603   7.603
  174    HE2  TYR  23           HE1      TYR  23   0.284   3.865   3.865
  175    HH   TYR  23           HH       TYR  23  -0.163   6.393   6.393
  176    H    ALA  24           HN       ALA  24  -3.905   5.510   5.510
  177    HA   ALA  24           HA       ALA  24  -5.129   7.068   7.068
  178   1HB   ALA  24           HB3      ALA  24  -6.748   5.930   5.930
  179   2HB   ALA  24           HB2      ALA  24  -6.146   7.065   7.065
  180   3HB   ALA  24           HB1      ALA  24  -6.963   7.665   7.665
  181    H    SER  25           HN       SER  25  -4.431   9.183   9.183
  182    HA   SER  25           HA       SER  25  -3.094  10.369  10.369
  183   1HB   SER  25           HB2      SER  25  -1.157  10.935  10.935
  184   2HB   SER  25           HB1      SER  25  -1.446   9.201   9.201
  185    HG   SER  25           HG       SER  25  -2.072   9.403   9.403
  186    HA   PRO  26           HA       PRO  26  -5.268  13.975  13.975
  187   1HB   PRO  26           HB2      PRO  26  -3.649  15.960  15.960
  188   2HB   PRO  26           HB1      PRO  26  -4.717  14.986  14.986
  189   1HG   PRO  26           HG2      PRO  26  -1.789  14.705  14.705
  190   2HG   PRO  26           HG1      PRO  26  -2.699  14.556  14.556
  191   1HD   PRO  26           HD2      PRO  26  -1.848  12.406  12.406
  192   2HD   PRO  26           HD1      PRO  26  -3.344  12.393  12.393
  193    H    GLY  27           HN       GLY  27  -2.053  13.252  13.252
  194   1HA   GLY  27           HA2      GLY  27  -2.473  14.716  14.716
  195   2HA   GLY  27           HA1      GLY  27  -1.127  15.314  15.314
  196    H    LYS  28           HN       LYS  28  -0.223  14.421  14.421
  197    HA   LYS  28           HA       LYS  28   0.613  11.573  11.573
  198   1HB   LYS  28           HB2      LYS  28   0.251  13.212  13.212
  199   2HB   LYS  28           HB1      LYS  28   0.860  11.557  11.557
  200   1HG   LYS  28           HG2      LYS  28  -1.244  10.841  10.841
  201   2HG   LYS  28           HG1      LYS  28  -1.858  12.487  12.487
  202   1HD   LYS  28           HD2      LYS  28  -2.741  11.262  11.262
  203   2HD   LYS  28           HD1      LYS  28  -1.441  12.267  12.267
  204   1HE   LYS  28           HE2      LYS  28   0.106  10.368  10.368
  205   2HE   LYS  28           HE1      LYS  28  -1.140   9.346   9.346
  206   1HZ   LYS  28           HZ1      LYS  28  -1.396  10.739  10.739
  207   2HZ   LYS  28           HZ3      LYS  28  -1.096   9.081   9.081
  208   3HZ   LYS  28           HZ2      LYS  28  -2.571   9.743   9.743
  209    H    ALA  29           HN       ALA  29   2.799  11.133  11.133
  210    HA   ALA  29           HA       ALA  29   4.703  13.343  13.343
  211   1HB   ALA  29           HB3      ALA  29   4.123  12.986  12.986
  212   2HB   ALA  29           HB2      ALA  29   5.018  11.473  11.473
  213   3HB   ALA  29           HB1      ALA  29   5.834  13.011  13.011
  214    H    THR  30           HN       THR  30   7.023  12.343  12.343
  215    HA   THR  30           HA       THR  30   6.924  10.047  10.047
  216    HB   THR  30           HB       THR  30   9.395  10.399  10.399
  217    HG1  THR  30           HG1      THR  30  10.270  11.887  11.887
  218   1HG2  THR  30          HG22      THR  30   7.415  12.409  12.409
  219   2HG2  THR  30          HG21      THR  30   9.010  13.091  13.091
  220   3HG2  THR  30          HG23      THR  30   8.824  11.841  11.841
  221    H    GLU  31           HN       GLU  31   8.368  10.726  10.726
  222    HA   GLU  31           HA       GLU  31   9.390   8.032   8.032
  223   1HB   GLU  31           HB2      GLU  31   9.033  10.217  10.217
  224   2HB   GLU  31           HB1      GLU  31  10.187   8.892   8.892
  225   1HG   GLU  31           HG2      GLU  31  10.404  10.579  10.579
  226   2HG   GLU  31           HG1      GLU  31  10.752  11.421  11.421
  227    H    VAL  32           HN       VAL  32   7.953   6.389   6.389
  228    HA   VAL  32           HA       VAL  32   5.883   6.806   6.806
  229    HB   VAL  32           HB       VAL  32   5.855   5.046   5.046
  230   1HG1  VAL  32          HG13      VAL  32   4.265   5.033   5.033
  231   2HG1  VAL  32          HG12      VAL  32   3.304   5.021   5.021
  232   3HG1  VAL  32          HG11      VAL  32   4.496   3.754   3.754
  233   1HG2  VAL  32          HG22      VAL  32   5.354   7.702   7.702
  234   2HG2  VAL  32          HG21      VAL  32   4.484   6.616   6.616
  235   3HG2  VAL  32          HG23      VAL  32   3.765   7.089   7.089
  236    H    ARG  33           HN       ARG  33   7.596   6.187   6.187
  237    HA   ARG  33           HA       ARG  33   9.179   3.835   3.835
  238   1HB   ARG  33           HB2      ARG  33   9.472   5.770   5.770
  239   2HB   ARG  33           HB1      ARG  33   8.033   5.253   5.253
  240   1HG   ARG  33           HG2      ARG  33   9.086   3.467   3.467
  241   2HG   ARG  33           HG1      ARG  33  10.153   3.207   3.207
  242   1HD   ARG  33           HD2      ARG  33  11.732   4.711   4.711
  243   2HD   ARG  33           HD1      ARG  33  10.517   5.740   5.740
  244    HE   ARG  33           HE       ARG  33  10.695   3.088   3.088
  245   1HH1  ARG  33          HH21      ARG  33  12.043   6.316   6.316
  246   2HH1  ARG  33          HH22      ARG  33  12.635   6.184   6.184
  247   1HH2  ARG  33          HH11      ARG  33  11.477   2.963   2.963
  248   2HH2  ARG  33          HH12      ARG  33  12.319   4.308   4.308
  249    H    VAL  34           HN       VAL  34   8.137   1.892   1.892
  250    HA   VAL  34           HA       VAL  34   5.919   1.119   1.119
  251    HB   VAL  34           HB       VAL  34   5.264  -0.436  -0.436
  252   1HG1  VAL  34          HG12      VAL  34   5.440   2.531   2.531
  253   2HG1  VAL  34          HG11      VAL  34   4.774   1.525   1.525
  254   3HG1  VAL  34          HG13      VAL  34   4.023   1.527   1.527
  255   1HG2  VAL  34          HG23      VAL  34   7.869   0.086   0.086
  256   2HG2  VAL  34          HG22      VAL  34   6.625  -0.857  -0.857
  257   3HG2  VAL  34          HG21      VAL  34   6.803   0.862   0.862
  258    H    THR  35           HN       THR  35   6.093  -0.834  -0.834
  259    HA   THR  35           HA       THR  35   8.546  -2.478  -2.478
  260    HB   THR  35           HB       THR  35   7.514  -1.396  -1.396
  261    HG1  THR  35           HG1      THR  35   8.510   0.272   0.272
  262   1HG2  THR  35          HG21      THR  35   9.607  -3.366  -3.366
  263   2HG2  THR  35          HG23      THR  35  10.021  -2.229  -2.229
  264   3HG2  THR  35          HG22      THR  35   8.623  -3.288  -3.288
  265    H    VAL  36           HN       VAL  36   8.096  -4.640  -4.640
  266    HA   VAL  36           HA       VAL  36   5.398  -5.510  -5.510
  267    HB   VAL  36           HB       VAL  36   7.595  -6.815  -6.815
  268   1HG1  VAL  36          HG13      VAL  36   4.858  -7.786  -7.786
  269   2HG1  VAL  36          HG12      VAL  36   5.704  -8.455  -8.455
  270   3HG1  VAL  36          HG11      VAL  36   6.410  -8.595  -8.595
  271   1HG2  VAL  36          HG21      VAL  36   5.146  -5.225  -5.225
  272   2HG2  VAL  36          HG23      VAL  36   6.679  -5.313  -5.313
  273   3HG2  VAL  36          HG22      VAL  36   5.489  -6.602  -6.602
  274    H    LEU  37           HN       LEU  37   5.252  -6.657  -6.657
  275    HA   LEU  37           HA       LEU  37   7.918  -7.526  -7.526
  276   1HB   LEU  37           HB2      LEU  37   5.387  -6.570  -6.570
  277   2HB   LEU  37           HB1      LEU  37   6.873  -7.029  -7.029
  278    HG   LEU  37           HG       LEU  37   6.966  -4.924  -4.924
  279   1HD1  LEU  37          HD13      LEU  37   5.139  -4.618  -4.618
  280   2HD1  LEU  37          HD12      LEU  37   6.576  -4.073  -4.073
  281   3HD1  LEU  37          HD11      LEU  37   6.091  -3.267  -3.267
  282   1HD2  LEU  37          HD22      LEU  37   8.691  -6.057  -6.057
  283   2HD2  LEU  37          HD21      LEU  37   9.118  -5.031  -5.031
  284   3HD2  LEU  37          HD23      LEU  37   8.580  -4.299  -4.299
  285    H    ARG  38           HN       ARG  38   7.857  -9.357  -9.357
  286    HA   ARG  38           HA       ARG  38   5.610 -11.268 -11.268
  287   1HB   ARG  38           HB2      ARG  38   7.836 -11.822 -11.822
  288   2HB   ARG  38           HB1      ARG  38   8.534 -11.806 -11.806
  289   1HG   ARG  38           HG2      ARG  38   6.961 -13.604 -13.604
  290   2HG   ARG  38           HG1      ARG  38   6.327 -13.645 -13.645
  291   1HD   ARG  38           HD2      ARG  38   8.616 -14.200 -14.200
  292   2HD   ARG  38           HD1      ARG  38   9.181 -14.267 -14.267
  293    HE   ARG  38           HE       ARG  38   6.803 -15.882 -15.882
  294   1HH1  ARG  38          HH21      ARG  38  10.270 -15.841 -15.841
  295   2HH1  ARG  38          HH22      ARG  38  10.398 -17.564 -17.564
  296   1HH2  ARG  38          HH11      ARG  38   7.016 -18.105 -18.105
  297   2HH2  ARG  38          HH12      ARG  38   8.578 -18.834 -18.834
  298    H    GLN  39           HN       GLN  39   4.487 -11.918 -11.918
  299    HA   GLN  39           HA       GLN  39   5.640 -11.195 -11.195
  300   1HB   GLN  39           HB2      GLN  39   3.446 -10.245 -10.245
  301   2HB   GLN  39           HB1      GLN  39   2.800 -11.879 -11.879
  302   1HG   GLN  39           HG2      GLN  39   3.525 -11.967 -11.967
  303   2HG   GLN  39           HG1      GLN  39   3.826 -10.233 -10.233
  304   1HE2  GLN  39          HE22      GLN  39   0.305  -9.451  -9.451
  305   2HE2  GLN  39          HE21      GLN  39   1.830  -8.976  -8.976
  306    H    ALA  40           HN       ALA  40   5.625 -12.716 -12.716
  307    HA   ALA  40           HA       ALA  40   5.056 -15.560 -15.560
  308   1HB   ALA  40           HB2      ALA  40   7.527 -14.454 -14.454
  309   2HB   ALA  40           HB1      ALA  40   7.208 -14.973 -14.973
  310   3HB   ALA  40           HB3      ALA  40   7.178 -16.149 -16.149
  311    H    ASP  41           HN       ASP  41   5.340 -16.817 -16.817
  312    HA   ASP  41           HA       ASP  41   3.012 -16.177 -16.177
  313   1HB   ASP  41           HB2      ASP  41   5.483 -17.776 -17.776
  314   2HB   ASP  41           HB1      ASP  41   4.110 -17.757 -17.757
  315    H    SER  42           HN       SER  42   6.442 -15.458 -15.458
  316    HA   SER  42           HA       SER  42   5.460 -13.399 -13.399
  317   1HB   SER  42           HB2      SER  42   7.695 -15.422 -15.422
  318   2HB   SER  42           HB1      SER  42   7.386 -14.123 -14.123
  319    HG   SER  42           HG       SER  42   6.091 -15.564 -15.564
  320    H    GLN  43           HN       GLN  43   7.613 -14.107 -14.107
  321    HA   GLN  43           HA       GLN  43   9.062 -11.534 -11.534
  322   1HB   GLN  43           HB2      GLN  43  10.397 -13.620 -13.620
  323   2HB   GLN  43           HB1      GLN  43   9.980 -14.055 -14.055
  324   1HG   GLN  43           HG2      GLN  43  11.045 -11.992 -11.992
  325   2HG   GLN  43           HG1      GLN  43  11.468 -11.554 -11.554
  326   1HE2  GLN  43          HE21      GLN  43  13.791 -11.663 -11.663
  327   2HE2  GLN  43          HE22      GLN  43  14.556 -13.170 -13.170
  328    H    VAL  44           HN       VAL  44   9.213 -10.114 -10.114
  329    HA   VAL  44           HA       VAL  44   8.053 -10.964 -10.964
  330    HB   VAL  44           HB       VAL  44   7.591  -8.358  -8.358
  331   1HG1  VAL  44          HG13      VAL  44   7.554  -8.687  -8.687
  332   2HG1  VAL  44          HG12      VAL  44   5.907  -9.193  -9.193
  333   3HG1  VAL  44          HG11      VAL  44   6.466  -7.585  -7.585
  334   1HG2  VAL  44          HG22      VAL  44   5.723 -10.696 -10.696
  335   2HG2  VAL  44          HG21      VAL  44   6.405 -10.261 -10.261
  336   3HG2  VAL  44          HG23      VAL  44   5.266  -9.177  -9.177
  337    H    THR  45           HN       THR  45   9.359 -10.352 -10.352
  338    HA   THR  45           HA       THR  45  11.499  -8.313  -8.313
  339    HB   THR  45           HB       THR  45  13.019  -9.808  -9.808
  340    HG1  THR  45           HG1      THR  45  11.988 -11.144 -11.144
  341   1HG2  THR  45          HG22      THR  45  12.505  -9.996  -9.996
  342   2HG2  THR  45          HG21      THR  45  11.718 -11.509 -11.509
  343   3HG2  THR  45          HG23      THR  45  13.433 -11.275 -11.275
  344    H    GLU  46           HN       GLU  46  12.434  -7.432  -7.432
  345    HA   GLU  46           HA       GLU  46  10.312  -6.704  -6.704
  346   1HB   GLU  46           HB2      GLU  46  13.272  -6.089  -6.089
  347   2HB   GLU  46           HB1      GLU  46  12.199  -5.341  -5.341
  348   1HG   GLU  46           HG2      GLU  46  10.813  -4.415  -4.415
  349   2HG   GLU  46           HG1      GLU  46  11.792  -5.232  -5.232
  350    H    VAL  47           HN       VAL  47  10.282  -7.171  -7.171
  351    HA   VAL  47           HA       VAL  47  11.879  -9.571  -9.571
  352    HB   VAL  47           HB       VAL  47   9.165  -8.484  -8.484
  353   1HG1  VAL  47          HG13      VAL  47  10.921 -10.412 -10.412
  354   2HG1  VAL  47          HG12      VAL  47   9.346 -11.100 -11.100
  355   3HG1  VAL  47          HG11      VAL  47   9.444  -9.651  -9.651
  356   1HG2  VAL  47          HG23      VAL  47  10.127 -10.550 -10.550
  357   2HG2  VAL  47          HG22      VAL  47   8.716  -9.495  -9.495
  358   3HG2  VAL  47          HG21      VAL  47   8.675 -10.928 -10.928
  359    H    CYS  48           HN       CYS  48  10.116  -6.958  -6.958
  360    HA   CYS  48           HA       CYS  48  12.614  -6.311  -6.311
  361   1HB   CYS  48           HB2      CYS  48   9.831  -6.955  -6.955
  362   2HB   CYS  48           HB1      CYS  48  10.987  -6.074  -6.074
  363    H    ALA  49           HN       ALA  49  12.750  -4.066  -4.066
  364    HA   ALA  49           HA       ALA  49  10.529  -2.235  -2.235
  365   1HB   ALA  49           HB3      ALA  49  11.979  -3.110  -3.110
  366   2HB   ALA  49           HB2      ALA  49  12.824  -1.617  -1.617
  367   3HB   ALA  49           HB1      ALA  49  11.097  -1.583  -1.583
  368    H    ALA  50           HN       ALA  50  10.797  -0.395  -0.395
  369    HA   ALA  50           HA       ALA  50  13.320   0.935   0.935
  370   1HB   ALA  50           HB2      ALA  50  12.962  -1.305  -1.305
  371   2HB   ALA  50           HB1      ALA  50  12.266  -0.059  -0.059
  372   3HB   ALA  50           HB3      ALA  50  13.939   0.081   0.081
  373    H    THR  51           HN       THR  51  12.936   2.949   2.949
  374    HA   THR  51           HA       THR  51  10.145   3.873   3.873
  375    HB   THR  51           HB       THR  51  12.455   5.431   5.431
  376    HG1  THR  51           HG1      THR  51  13.476   5.088   5.088
  377   1HG2  THR  51          HG21      THR  51   9.935   6.010   6.010
  378   2HG2  THR  51          HG23      THR  51  11.258   7.174   7.174
  379   3HG2  THR  51          HG22      THR  51  10.481   6.687   6.687
  380    H    TYR  52           HN       TYR  52   8.724   3.763   3.763
  381    HA   TYR  52           HA       TYR  52   9.699   3.002   3.002
  382   1HB   TYR  52           HB2      TYR  52   7.663   2.081   2.081
  383   2HB   TYR  52           HB1      TYR  52   6.895   3.645   3.645
  384    HD1  TYR  52           HD2      TYR  52   6.597   4.485   4.485
  385    HD2  TYR  52           HD1      TYR  52   7.849   0.452   0.452
  386    HE1  TYR  52           HE2      TYR  52   5.996   3.728   3.728
  387    HE2  TYR  52           HE1      TYR  52   7.252  -0.300  -0.300
  388    HH   TYR  52           HH       TYR  52   7.064   1.176   1.176
  389    H    MET  53           HN       MET  53  10.470   4.695   4.695
  390    HA   MET  53           HA       MET  53   9.352   7.409   7.409
  391   1HB   MET  53           HB2      MET  53  11.229   6.122   6.122
  392   2HB   MET  53           HB1      MET  53  10.970   7.856   7.856
  393   1HG   MET  53           HG2      MET  53  11.681   6.575   6.575
  394   2HG   MET  53           HG1      MET  53  12.909   6.302   6.302
  395   1HE   MET  53           HE3      MET  53  11.514   8.418   8.418
  396   2HE   MET  53           HE2      MET  53  11.692  10.108  10.108
  397   3HE   MET  53           HE1      MET  53  10.472   9.103   9.103
  398    H    MET  54           HN       MET  54   8.331   8.354   8.354
  399    HA   MET  54           HA       MET  54   6.179   6.695   6.695
  400   1HB   MET  54           HB2      MET  54   7.500   9.131   9.131
  401   2HB   MET  54           HB1      MET  54   5.930   8.490   8.490
  402   1HG   MET  54           HG2      MET  54   6.688   9.605   9.605
  403   2HG   MET  54           HG1      MET  54   5.512  10.266  10.266
  404   1HE   MET  54           HE1      MET  54   6.605   8.145   8.145
  405   2HE   MET  54           HE3      MET  54   5.122   7.836   7.836
  406   3HE   MET  54           HE2      MET  54   5.777   6.598   6.598
  407    H    GLY  55           HN       GLY  55   9.456   7.120   7.120
  408   1HA   GLY  55           HA2      GLY  55   8.921   5.464   5.464
  409   2HA   GLY  55           HA1      GLY  55  10.460   6.238   6.238
  410    H    ASN  56           HN       ASN  56  11.836   4.417   4.417
  411    HA   ASN  56           HA       ASN  56  11.038   2.251   2.251
  412   1HB   ASN  56           HB2      ASN  56  12.859   2.195   2.195
  413   2HB   ASN  56           HB1      ASN  56  12.579   0.839   0.839
  414   1HD2  ASN  56          HD22      ASN  56  10.019   1.330   1.330
  415   2HD2  ASN  56          HD21      ASN  56  11.599   1.949   1.949
  416    H    GLU  57           HN       GLU  57  12.322   1.897   1.897
  417    HA   GLU  57           HA       GLU  57  15.152   2.267   2.267
  418   1HB   GLU  57           HB2      GLU  57  14.457   4.674   4.674
  419   2HB   GLU  57           HB1      GLU  57  13.468   4.508   4.508
  420   1HG   GLU  57           HG2      GLU  57  15.494   3.914   3.914
  421   2HG   GLU  57           HG1      GLU  57  16.474   4.132   4.132
  422    H    LEU  58           HN       LEU  58  15.875   1.858   1.858
  423    HA   LEU  58           HA       LEU  58  15.682   0.699   0.699
  424   1HB   LEU  58           HB2      LEU  58  13.363   2.613   2.613
  425   2HB   LEU  58           HB1      LEU  58  13.600   1.636   1.636
  426    HG   LEU  58           HG       LEU  58  15.807   3.312   3.312
  427   1HD1  LEU  58          HD12      LEU  58  13.598   4.486   4.486
  428   2HD1  LEU  58          HD11      LEU  58  14.352   4.149   4.149
  429   3HD1  LEU  58          HD13      LEU  58  15.195   5.136   5.136
  430   1HD2  LEU  58          HD22      LEU  58  15.411   1.611   1.611
  431   2HD2  LEU  58          HD21      LEU  58  16.863   1.865   1.865
  432   3HD2  LEU  58          HD23      LEU  58  16.362   3.084   3.084
  433    H    THR  59           HN       THR  59  15.339  -1.350  -1.350
  434    HA   THR  59           HA       THR  59  12.567  -2.362  -2.362
  435    HB   THR  59           HB       THR  59  13.734  -4.161  -4.161
  436    HG1  THR  59           HG1      THR  59  15.742  -4.412  -4.412
  437   1HG2  THR  59          HG21      THR  59  13.056  -1.867  -1.867
  438   2HG2  THR  59          HG23      THR  59  14.790  -1.544  -1.544
  439   3HG2  THR  59          HG22      THR  59  14.136  -2.899  -2.899
  440    H    PHE  60           HN       PHE  60  12.184  -4.568  -4.568
  441    HA   PHE  60           HA       PHE  60  13.423  -4.883  -4.883
  442   1HB   PHE  60           HB2      PHE  60  11.132  -6.199  -6.199
  443   2HB   PHE  60           HB1      PHE  60  11.586  -6.623  -6.623
  444    HD1  PHE  60           HD2      PHE  60  12.195  -3.103  -3.103
  445    HD2  PHE  60           HD1      PHE  60   9.015  -5.987  -5.987
  446    HE1  PHE  60           HE2      PHE  60  10.720  -1.292  -1.292
  447    HE2  PHE  60           HE1      PHE  60   7.552  -4.170  -4.170
  448    HZ   PHE  60           HZ       PHE  60   8.403  -1.828  -1.828
  449    H    LEU  61           HN       LEU  61  14.472  -5.797  -5.797
  450    HA   LEU  61           HA       LEU  61  14.756  -8.623  -8.623
  451   1HB   LEU  61           HB2      LEU  61  15.201  -7.069  -7.069
  452   2HB   LEU  61           HB1      LEU  61  16.640  -6.489  -6.489
  453    HG   LEU  61           HG       LEU  61  17.540  -8.815  -8.815
  454   1HD1  LEU  61          HD11      LEU  61  15.048  -9.333  -9.333
  455   2HD1  LEU  61          HD13      LEU  61  16.416 -10.443 -10.443
  456   3HD1  LEU  61          HD12      LEU  61  15.476 -10.080 -10.080
  457   1HD2  LEU  61          HD23      LEU  61  17.954  -7.088  -7.088
  458   2HD2  LEU  61          HD22      LEU  61  18.248  -8.773  -8.773
  459   3HD2  LEU  61          HD21      LEU  61  16.764  -7.975  -7.975
  460    H    ASP  62           HN       ASP  62  16.591  -6.120  -6.120
  461    HA   ASP  62           HA       ASP  62  18.908  -7.577  -7.577
  462   1HB   ASP  62           HB2      ASP  62  19.115  -5.946  -5.946
  463   2HB   ASP  62           HB1      ASP  62  18.553  -5.156  -5.156
  464    H    ASP  63           HN       ASP  63  15.748  -7.790  -7.790
  465    HA   ASP  63           HA       ASP  63  16.522  -9.384  -9.384
  466   1HB   ASP  63           HB2      ASP  63  13.863  -8.585  -8.585
  467   2HB   ASP  63           HB1      ASP  63  14.040  -9.450  -9.450
  468    H    SER  64           HN       SER  64  16.069 -10.042 -10.042
  469    HA   SER  64           HA       SER  64  15.602 -11.983 -11.983
  470   1HB   SER  64           HB2      SER  64  16.980 -13.841 -13.841
  471   2HB   SER  64           HB1      SER  64  17.820 -12.308 -12.308
  472    HG   SER  64           HG       SER  64  17.954 -13.477 -13.477
  473    H    ILE  67           HN       ILE  67  13.453 -11.323 -11.323
  474    HA   ILE  67           HA       ILE  67  12.268 -14.065 -14.065
  475    HB   ILE  67           HB       ILE  67  12.545 -12.017 -12.017
  476   1HG1  ILE  67          HG12      ILE  67  13.243 -14.964 -14.964
  477   2HG1  ILE  67          HG11      ILE  67  14.391 -13.665 -13.665
  478   1HG2  ILE  67          HG21      ILE  67  10.707 -14.417 -14.417
  479   2HG2  ILE  67          HG23      ILE  67  11.234 -13.782 -13.782
  480   3HG2  ILE  67          HG22      ILE  67  10.290 -12.768 -12.768
  481   1HD1  ILE  67          HD12      ILE  67  13.678 -12.754 -12.754
  482   2HD1  ILE  67          HD11      ILE  67  12.991 -14.356 -14.356
  483   3HD1  ILE  67          HD13      ILE  67  14.720 -14.176 -14.176
  484    H    CYS  68           HN       CYS  68  11.569 -10.562 -10.562
  485    HA   CYS  68           HA       CYS  68   8.862 -11.081 -11.081
  486   1HB   CYS  68           HB2      CYS  68   8.844  -8.644  -8.644
  487   2HB   CYS  68           HB1      CYS  68   8.174 -10.178 -10.178
  488    H    THR  69           HN       THR  69   8.387 -10.027 -10.027
  489    HA   THR  69           HA       THR  69   9.860  -7.535  -7.535
  490    HB   THR  69           HB       THR  69  11.001  -9.474  -9.474
  491    HG1  THR  69           HG1      THR  69   9.423  -8.131  -8.131
  492   1HG2  THR  69          HG23      THR  69   8.874 -10.898 -10.898
  493   2HG2  THR  69          HG22      THR  69   8.416 -10.057 -10.057
  494   3HG2  THR  69          HG21      THR  69   9.884 -11.033 -11.033
  495    H    GLY  70           HN       GLY  70   8.534  -6.107  -6.107
  496   1HA   GLY  70           HA2      GLY  70   6.047  -6.976  -6.976
  497   2HA   GLY  70           HA1      GLY  70   5.753  -6.204  -6.204
  498    H    THR  71           HN       THR  71   4.545  -4.790  -4.790
  499    HA   THR  71           HA       THR  71   6.303  -2.552  -2.552
  500    HB   THR  71           HB       THR  71   3.874  -3.814  -3.814
  501    HG1  THR  71           HG1      THR  71   6.525  -3.590  -3.590
  502   1HG2  THR  71          HG23      THR  71   5.387  -1.327  -1.327
  503   2HG2  THR  71          HG22      THR  71   4.467  -2.230  -2.230
  504   3HG2  THR  71          HG21      THR  71   3.646  -1.542  -1.542
  505    H    SER  72           HN       SER  72   4.955  -0.492  -0.492
  506    HA   SER  72           HA       SER  72   2.670  -0.370  -0.370
  507   1HB   SER  72           HB2      SER  72   4.849   0.340   0.340
  508   2HB   SER  72           HB1      SER  72   5.007   1.562   1.562
  509    HG   SER  72           HG       SER  72   3.342   1.462   1.462
  510    H    SER  73           HN       SER  73   0.920   0.742   0.742
  511    HA   SER  73           HA       SER  73   1.573   2.628   2.628
  512   1HB   SER  73           HB2      SER  73  -0.490   0.409   0.409
  513   2HB   SER  73           HB1      SER  73  -0.382   1.604   1.604
  514    HG   SER  73           HG       SER  73   1.269   0.566   0.566
  515    H    GLY  74           HN       GLY  74   0.533   4.563   4.563
  516   1HA   GLY  74           HA2      GLY  74  -0.862   6.212   6.212
  517   2HA   GLY  74           HA1      GLY  74  -2.136   5.013   5.013
  518    H    ASN  75           HN       ASN  75  -3.223   4.676   4.676
  519    HA   ASN  75           HA       ASN  75  -1.847   5.049   5.049
  520   1HB   ASN  75           HB2      ASN  75  -4.752   4.807   4.807
  521   2HB   ASN  75           HB1      ASN  75  -4.218   5.076   5.076
  522   1HD2  ASN  75          HD22      ASN  75  -2.789   8.373   8.373
  523   2HD2  ASN  75          HD21      ASN  75  -2.163   6.952   6.952
  524    H    GLN  76           HN       GLN  76  -2.047   2.516   2.516
  525    HA   GLN  76           HA       GLN  76  -2.816   0.553   0.553
  526   1HB   GLN  76           HB2      GLN  76  -2.921   0.496   0.496
  527   2HB   GLN  76           HB1      GLN  76  -3.202  -0.931  -0.931
  528   1HG   GLN  76           HG2      GLN  76  -5.074   0.169   0.169
  529   2HG   GLN  76           HG1      GLN  76  -4.765   1.658   1.658
  530   1HE2  GLN  76          HE22      GLN  76  -6.205  -1.553  -1.553
  531   2HE2  GLN  76          HE21      GLN  76  -5.161  -1.841  -1.841
  532    H    VAL  77           HN       VAL  77  -1.132  -0.703  -0.703
  533    HA   VAL  77           HA       VAL  77   1.402  -0.642  -0.642
  534    HB   VAL  77           HB       VAL  77   2.431  -1.115  -1.115
  535   1HG1  VAL  77          HG12      VAL  77   1.134   1.224   1.224
  536   2HG1  VAL  77          HG11      VAL  77   0.532   0.880   0.880
  537   3HG1  VAL  77          HG13      VAL  77   2.268   1.020   1.020
  538   1HG2  VAL  77          HG22      VAL  77  -0.277  -1.948  -1.948
  539   2HG2  VAL  77          HG21      VAL  77   1.269  -2.450  -2.450
  540   3HG2  VAL  77          HG23      VAL  77   0.502  -0.959  -0.959
  541    H    ASN  78           HN       ASN  78   1.782  -2.430  -2.430
  542    HA   ASN  78           HA       ASN  78   0.404  -4.979  -4.979
  543   1HB   ASN  78           HB2      ASN  78   0.657  -3.879  -3.879
  544   2HB   ASN  78           HB1      ASN  78   2.394  -4.170  -4.170
  545    HD2  ASN  78          HD22      ASN  78   0.552  -5.311  -5.311
  546    H    LEU  79           HN       LEU  79   1.385  -6.243  -6.243
  547    HA   LEU  79           HA       LEU  79   4.382  -6.468  -6.468
  548   1HB   LEU  79           HB2      LEU  79   2.272  -6.903  -6.903
  549   2HB   LEU  79           HB1      LEU  79   3.964  -7.344  -7.344
  550    HG   LEU  79           HG       LEU  79   2.962  -4.551  -4.551
  551   1HD1  LEU  79          HD13      LEU  79   3.602  -5.993  -5.993
  552   2HD1  LEU  79          HD12      LEU  79   4.075  -4.298  -4.298
  553   3HD1  LEU  79          HD11      LEU  79   2.382  -4.757  -4.757
  554   1HD2  LEU  79          HD22      LEU  79   5.712  -5.694  -5.694
  555   2HD2  LEU  79          HD21      LEU  79   5.182  -4.844  -4.844
  556   3HD2  LEU  79          HD23      LEU  79   5.353  -3.967  -3.967
  557    H    THR  80           HN       THR  80   5.227  -8.470  -8.470
  558    HA   THR  80           HA       THR  80   3.376 -10.832 -10.832
  559    HB   THR  80           HB       THR  80   5.383  -9.967  -9.967
  560    HG1  THR  80           HG1      THR  80   3.561  -9.535  -9.535
  561   1HG2  THR  80          HG21      THR  80   3.902 -12.483 -12.483
  562   2HG2  THR  80          HG23      THR  80   3.844 -11.885 -11.885
  563   3HG2  THR  80          HG22      THR  80   5.399 -12.214 -12.214
  564    H    ILE  81           HN       ILE  81   4.332 -12.788 -12.788
  565    HA   ILE  81           HA       ILE  81   7.230 -12.701 -12.701
  566    HB   ILE  81           HB       ILE  81   4.818 -14.021 -14.021
  567   1HG1  ILE  81          HG12      ILE  81   6.641 -11.962 -11.962
  568   2HG1  ILE  81          HG11      ILE  81   5.273 -11.474 -11.474
  569   1HG2  ILE  81          HG23      ILE  81   6.856 -15.423 -15.423
  570   2HG2  ILE  81          HG22      ILE  81   7.727 -14.035 -14.035
  571   3HG2  ILE  81          HG21      ILE  81   6.379 -14.737 -14.737
  572   1HD1  ILE  81          HD12      ILE  81   3.990 -13.229 -13.229
  573   2HD1  ILE  81          HD11      ILE  81   5.283 -12.813 -12.813
  574   3HD1  ILE  81          HD13      ILE  81   4.214 -11.554 -11.554
  575    H    GLN  82           HN       GLN  82   8.457 -14.483 -14.483
  576    HA   GLN  82           HA       GLN  82   7.005 -16.736 -16.736
  577   1HB   GLN  82           HB2      GLN  82   9.666 -15.422 -15.422
  578   2HB   GLN  82           HB1      GLN  82   9.137 -16.946 -16.946
  579   1HG   GLN  82           HG2      GLN  82   7.516 -15.951 -15.951
  580   2HG   GLN  82           HG1      GLN  82   7.268 -14.622 -14.622
  581   1HE2  GLN  82          HE22      GLN  82   9.695 -14.045 -14.045
  582   2HE2  GLN  82          HE21      GLN  82   8.599 -15.335 -15.335
  583    H    GLY  83           HN       GLY  83   7.251 -18.577 -18.577
  584   1HA   GLY  83           HA2      GLY  83   8.804 -20.332 -20.332
  585   2HA   GLY  83           HA1      GLY  83   9.779 -19.043 -19.043
  586    H    LEU  84           HN       LEU  84   6.252 -19.304 -19.304
  587    HA   LEU  84           HA       LEU  84   6.276 -18.934 -18.934
  588   1HB   LEU  84           HB2      LEU  84   4.138 -19.391 -19.391
  589   2HB   LEU  84           HB1      LEU  84   3.777 -19.086 -19.086
  590    HG   LEU  84           HG       LEU  84   5.454 -17.247 -17.247
  591   1HD1  LEU  84          HD11      LEU  84   2.514 -17.241 -17.241
  592   2HD1  LEU  84          HD13      LEU  84   3.366 -15.771 -15.771
  593   3HD1  LEU  84          HD12      LEU  84   3.257 -17.126 -17.126
  594   1HD2  LEU  84          HD23      LEU  84   4.550 -17.308 -17.308
  595   2HD2  LEU  84          HD22      LEU  84   6.045 -16.676 -16.676
  596   3HD2  LEU  84          HD21      LEU  84   4.555 -15.740 -15.740
  597    H    ARG  85           HN       ARG  85   7.381 -20.909 -20.909
  598    HA   ARG  85           HA       ARG  85   6.270 -23.547 -23.547
  599   1HB   ARG  85           HB2      ARG  85   8.672 -22.911 -22.911
  600   2HB   ARG  85           HB1      ARG  85   8.114 -22.683 -22.683
  601   1HG   ARG  85           HG2      ARG  85   7.444 -24.983 -24.983
  602   2HG   ARG  85           HG1      ARG  85   7.693 -25.250 -25.250
  603   1HD   ARG  85           HD2      ARG  85  10.111 -24.818 -24.818
  604   2HD   ARG  85           HD1      ARG  85   9.864 -24.572 -24.572
  605    HE   ARG  85           HE       ARG  85   8.665 -27.035 -27.035
  606   1HH1  ARG  85          HH21      ARG  85  11.863 -25.663 -25.663
  607   2HH1  ARG  85          HH22      ARG  85  12.648 -27.192 -27.192
  608   1HH2  ARG  85          HH11      ARG  85   9.725 -28.991 -28.991
  609   2HH2  ARG  85          HH12      ARG  85  11.454 -29.056 -29.056
  610    H    ALA  86           HN       ALA  86   5.496 -24.945 -24.945
  611    HA   ALA  86           HA       ALA  86   3.166 -23.915 -23.915
  612   1HB   ALA  86           HB3      ALA  86   4.040 -26.326 -26.326
  613   2HB   ALA  86           HB2      ALA  86   4.947 -26.048 -26.048
  614   3HB   ALA  86           HB1      ALA  86   3.185 -25.971 -25.971
  615    H    MET  87           HN       MET  87   6.479 -24.121 -24.121
  616    HA   MET  87           HA       MET  87   5.921 -23.043 -23.043
  617   1HB   MET  87           HB2      MET  87   7.924 -24.372 -24.372
  618   2HB   MET  87           HB1      MET  87   8.458 -23.014 -23.014
  619   1HG   MET  87           HG2      MET  87   9.632 -22.825 -22.825
  620   2HG   MET  87           HG1      MET  87   8.368 -21.595 -21.595
  621   1HE   MET  87           HE1      MET  87   9.698 -21.977 -21.977
  622   2HE   MET  87           HE3      MET  87   8.289 -21.763 -21.763
  623   3HE   MET  87           HE2      MET  87   9.329 -23.172 -23.172
  624    H    ASP  88           HN       ASP  88   6.814 -21.621 -21.621
  625    HA   ASP  88           HA       ASP  88   7.347 -18.949 -18.949
  626   1HB   ASP  88           HB2      ASP  88   6.371 -20.082 -20.082
  627   2HB   ASP  88           HB1      ASP  88   6.967 -18.436 -18.436
  628    H    THR  89           HN       THR  89   4.336 -20.654 -20.654
  629    HA   THR  89           HA       THR  89   2.519 -18.616 -18.616
  630    HB   THR  89           HB       THR  89   2.201 -20.948 -20.948
  631    HG1  THR  89           HG1      THR  89   2.079 -22.158 -22.158
  632   1HG2  THR  89          HG22      THR  89   0.400 -19.001 -19.001
  633   2HG2  THR  89          HG21      THR  89   0.032 -20.023 -20.023
  634   3HG2  THR  89          HG23      THR  89  -0.065 -20.684 -20.684
  635    H    GLY  90           HN       GLY  90   1.559 -17.029 -17.029
  636   1HA   GLY  90           HA2      GLY  90   1.314 -16.935 -16.935
  637   2HA   GLY  90           HA1      GLY  90   2.907 -16.270 -16.270
  638    H    LEU  91           HN       LEU  91   2.402 -14.175 -14.175
  639    HA   LEU  91           HA       LEU  91   0.229 -12.730 -12.730
  640   1HB   LEU  91           HB2      LEU  91   0.386 -12.902 -12.902
  641   2HB   LEU  91           HB1      LEU  91   1.842 -11.924 -11.924
  642    HG   LEU  91           HG       LEU  91  -0.092 -10.527 -10.527
  643   1HD1  LEU  91          HD13      LEU  91   1.760  -9.857  -9.857
  644   2HD1  LEU  91          HD12      LEU  91   0.346  -9.725  -9.725
  645   3HD1  LEU  91          HD11      LEU  91   0.445  -8.774  -8.774
  646   1HD2  LEU  91          HD23      LEU  91  -1.368 -12.120 -12.120
  647   2HD2  LEU  91          HD22      LEU  91  -2.102 -11.100 -11.100
  648   3HD2  LEU  91          HD21      LEU  91  -1.593 -10.396 -10.396
  649    H    TYR  92           HN       TYR  92   0.755 -11.125 -11.125
  650    HA   TYR  92           HA       TYR  92   3.566 -10.108 -10.108
  651   1HB   TYR  92           HB2      TYR  92   1.637 -10.883 -10.883
  652   2HB   TYR  92           HB1      TYR  92   2.987  -9.790  -9.790
  653    HD1  TYR  92           HD1      TYR  92   2.040 -13.241 -13.241
  654    HD2  TYR  92           HD2      TYR  92   5.309 -10.546 -10.546
  655    HE1  TYR  92           HE1      TYR  92   3.614 -15.183 -15.183
  656    HE2  TYR  92           HE2      TYR  92   6.883 -12.486 -12.486
  657    HH   TYR  92           HH       TYR  92   6.445 -15.291 -15.291
  658    H    ILE  93           HN       ILE  93   3.617  -7.921  -7.921
  659    HA   ILE  93           HA       ILE  93   1.049  -6.442  -6.442
  660    HB   ILE  93           HB       ILE  93   3.793  -6.003  -6.003
  661   1HG1  ILE  93          HG12      ILE  93   2.088  -6.003  -6.003
  662   2HG1  ILE  93          HG11      ILE  93   1.154  -6.985  -6.985
  663   1HG2  ILE  93          HG23      ILE  93   1.486  -4.119  -4.119
  664   2HG2  ILE  93          HG22      ILE  93   2.310  -4.165  -4.165
  665   3HG2  ILE  93          HG21      ILE  93   3.213  -3.770  -3.770
  666   1HD1  ILE  93          HD11      ILE  93   3.234  -8.405  -8.405
  667   2HD1  ILE  93          HD13      ILE  93   3.933  -7.518  -7.518
  668   3HD1  ILE  93          HD12      ILE  93   2.478  -8.497  -8.497
  669    H    CYS  94           HN       CYS  94   0.542  -5.026  -5.026
  670    HA   CYS  94           HA       CYS  94   2.610  -4.076  -4.076
  671   1HB   CYS  94           HB2      CYS  94   0.674  -3.189  -3.189
  672   2HB   CYS  94           HB1      CYS  94   0.255  -4.809  -4.809
  673    H    LYS  95           HN       LYS  95   3.850  -2.401  -2.401
  674    HA   LYS  95           HA       LYS  95   2.570  -0.443  -0.443
  675   1HB   LYS  95           HB2      LYS  95   4.560  -1.676  -1.676
  676   2HB   LYS  95           HB1      LYS  95   5.450  -1.104  -1.104
  677   1HG   LYS  95           HG2      LYS  95   5.987   0.805   0.805
  678   2HG   LYS  95           HG1      LYS  95   4.282   1.158   1.158
  679   1HD   LYS  95           HD2      LYS  95   4.318  -0.353  -0.353
  680   2HD   LYS  95           HD1      LYS  95   6.044  -0.626  -0.626
  681   1HE   LYS  95           HE2      LYS  95   6.506   1.767   1.767
  682   2HE   LYS  95           HE1      LYS  95   4.772   2.084   2.084
  683   1HZ   LYS  95           HZ3      LYS  95   4.735   0.511   0.511
  684   2HZ   LYS  95           HZ2      LYS  95   6.396   0.214   0.214
  685   3HZ   LYS  95           HZ1      LYS  95   5.855   1.746   1.746
  686    H    VAL  96           HN       VAL  96   2.436   1.728   1.728
  687    HA   VAL  96           HA       VAL  96   3.702   2.540   2.540
  688    HB   VAL  96           HB       VAL  96   0.817   3.033   3.033
  689   1HG1  VAL  96          HG13      VAL  96   2.328   4.410   4.410
  690   2HG1  VAL  96          HG12      VAL  96   1.689   3.134   3.134
  691   3HG1  VAL  96          HG11      VAL  96   0.585   4.190   4.190
  692   1HG2  VAL  96          HG21      VAL  96   2.008   0.911   0.911
  693   2HG2  VAL  96          HG23      VAL  96   1.042   0.655   0.655
  694   3HG2  VAL  96          HG22      VAL  96   0.295   1.334   1.334
  695    H    GLU  97           HN       GLU  97   5.077   4.146   4.146
  696    HA   GLU  97           HA       GLU  97   3.766   6.265   6.265
  697   1HB   GLU  97           HB2      GLU  97   6.521   5.032   5.032
  698   2HB   GLU  97           HB1      GLU  97   5.941   6.391   6.391
  699   1HG   GLU  97           HG2      GLU  97   3.976   4.850   4.850
  700   2HG   GLU  97           HG1      GLU  97   4.919   3.533   3.533
  701    H    LEU  98           HN       LEU  98   4.054   8.315   8.315
  702    HA   LEU  98           HA       LEU  98   5.918   8.788   8.788
  703   1HB   LEU  98           HB2      LEU  98   4.219  10.773  10.773
  704   2HB   LEU  98           HB1      LEU  98   4.772  10.928  10.928
  705    HG   LEU  98           HG       LEU  98   2.634   9.074   9.074
  706   1HD1  LEU  98          HD11      LEU  98   2.699  11.339  11.339
  707   2HD1  LEU  98          HD13      LEU  98   1.337  10.225  10.225
  708   3HD1  LEU  98          HD12      LEU  98   1.784  11.240  11.240
  709   1HD2  LEU  98          HD22      LEU  98   4.198   8.947   8.947
  710   2HD2  LEU  98          HD21      LEU  98   3.644   7.631   7.631
  711   3HD2  LEU  98          HD23      LEU  98   2.496   8.477   8.477
  712    H    MET  99           HN       MET  99   7.759   8.166   8.166
  713    HA   MET  99           HA       MET  99   8.246   9.597   9.597
  714   1HB   MET  99           HB2      MET  99   9.845   7.712   7.712
  715   2HB   MET  99           HB1      MET  99  10.450   8.319   8.319
  716   1HG   MET  99           HG2      MET  99   8.389   6.293   6.293
  717   2HG   MET  99           HG1      MET  99   9.356   6.557   6.557
  718   1HE   MET  99           HE3      MET  99   7.851   5.939   5.939
  719   2HE   MET  99           HE2      MET  99   8.058   7.460   7.460
  720   3HE   MET  99           HE1      MET  99   6.436   6.814   6.814
  721    H    TYR 100           HN       TYR 100   9.715   9.775   9.775
  722    HA   TYR 100           HA       TYR 100  11.783  11.641  11.641
  723   1HB   TYR 100           HB2      TYR 100  10.429  10.800  10.800
  724   2HB   TYR 100           HB1      TYR 100  11.719  11.999  11.999
  725    HD1  TYR 100           HD1      TYR 100  10.860   8.466   8.466
  726    HD2  TYR 100           HD2      TYR 100  14.021  11.384  11.384
  727    HE1  TYR 100           HE1      TYR 100  12.570   6.651   6.651
  728    HE2  TYR 100           HE2      TYR 100  15.733   9.569   9.569
  729    HH   TYR 100           HH       TYR 100  15.097   6.540   6.540
  730    HA   PRO 101           HA       PRO 101   8.959  15.157  15.157
  731   1HB   PRO 101           HB2      PRO 101   6.260  14.744  14.744
  732   2HB   PRO 101           HB1      PRO 101   7.500  14.454  14.454
  733   1HG   PRO 101           HG2      PRO 101   6.063  12.504  12.504
  734   2HG   PRO 101           HG1      PRO 101   6.592  12.360  12.360
  735   1HD   PRO 101           HD2      PRO 101   7.894  11.285  11.285
  736   2HD   PRO 101           HD1      PRO 101   8.632  11.560  11.560
  737    HA   PRO 102           HA       PRO 102   7.618  15.248  15.248
  738   1HB   PRO 102           HB2      PRO 102   8.919  17.700  17.700
  739   2HB   PRO 102           HB1      PRO 102   9.726  16.124  16.124
  740   1HG   PRO 102           HG2      PRO 102   9.820  18.386  18.386
  741   2HG   PRO 102           HG1      PRO 102  10.992  17.103  17.103
  742   1HD   PRO 102           HD2      PRO 102   9.161  17.299  17.299
  743   2HD   PRO 102           HD1      PRO 102  10.289  15.968  15.968
  744    HA   PRO 103           HA       PRO 103   7.059  16.193  16.193
  745   1HB   PRO 103           HB2      PRO 103   5.258  15.743  15.743
  746   2HB   PRO 103           HB1      PRO 103   6.429  17.093  17.093
  747   1HG   PRO 103           HG2      PRO 103   3.686  17.387  17.387
  748   2HG   PRO 103           HG1      PRO 103   4.932  18.591  18.591
  749   1HD   PRO 103           HD2      PRO 103   3.870  16.403  16.403
  750   2HD   PRO 103           HD1      PRO 103   3.445  18.055  18.055
  751    H    TYR 104           HN       TYR 104   5.867  13.995  13.995
  752    HA   TYR 104           HA       TYR 104   4.987  12.459  12.459
  753   1HB   TYR 104           HB2      TYR 104   6.707  11.440  11.440
  754   2HB   TYR 104           HB1      TYR 104   5.939  11.868  11.868
  755    HD1  TYR 104           HD1      TYR 104   4.680  10.135  10.135
  756    HD2  TYR 104           HD2      TYR 104   5.391   9.953   9.953
  757    HE1  TYR 104           HE1      TYR 104   3.497   7.922   7.922
  758    HE2  TYR 104           HE2      TYR 104   4.210   7.742   7.742
  759    HH   TYR 104           HH       TYR 104   3.697   5.874   5.874
  760    H    TYR 105           HN       TYR 105   2.951  11.521  11.521
  761    HA   TYR 105           HA       TYR 105   0.976  11.454  11.454
  762   1HB   TYR 105           HB2      TYR 105  -0.685  12.700  12.700
  763   2HB   TYR 105           HB1      TYR 105   0.584  13.655  13.655
  764    HD1  TYR 105           HD2      TYR 105   2.575  14.394  14.394
  765    HD2  TYR 105           HD1      TYR 105  -0.852  12.502  12.502
  766    HE1  TYR 105           HE2      TYR 105   3.285  15.260  15.260
  767    HE2  TYR 105           HE1      TYR 105  -0.160  13.373  13.373
  768    HH   TYR 105           HH       TYR 105   1.743  15.773  15.773
  769    H    LEU 106           HN       LEU 106   0.898   9.180   9.180
  770    HA   LEU 106           HA       LEU 106  -0.866   8.360   8.360
  771   1HB   LEU 106           HB2      LEU 106   1.859   8.453   8.453
  772   2HB   LEU 106           HB1      LEU 106   1.616   6.760   6.760
  773    HG   LEU 106           HG       LEU 106  -0.280   6.676   6.676
  774   1HD1  LEU 106          HD13      LEU 106   0.721   9.481   9.481
  775   2HD1  LEU 106          HD12      LEU 106  -0.162   8.563   8.563
  776   3HD1  LEU 106          HD11      LEU 106  -0.931   8.953   8.953
  777   1HD2  LEU 106          HD22      LEU 106   2.578   7.099   7.099
  778   2HD2  LEU 106          HD21      LEU 106   1.529   5.723   5.723
  779   3HD2  LEU 106          HD23      LEU 106   1.430   7.165   7.165
  780    H    GLY 108           HN       GLY 108   0.043   5.508   5.508
  781   1HA   GLY 108           HA2      GLY 108  -0.220   4.814   4.814
  782   2HA   GLY 108           HA1      GLY 108  -1.702   4.537   4.537
  783    H    ILE 109           HN       ILE 109  -0.734   2.334   2.334
  784    HA   ILE 109           HA       ILE 109   0.822   0.952   0.952
  785    HB   ILE 109           HB       ILE 109   0.574   0.592   0.592
  786   1HG1  ILE 109          HG12      ILE 109   3.109   0.809   0.809
  787   2HG1  ILE 109          HG11      ILE 109   2.821   1.360   1.360
  788   1HG2  ILE 109          HG21      ILE 109   1.979  -1.176  -1.176
  789   2HG2  ILE 109          HG23      ILE 109   2.187  -1.286  -1.286
  790   3HG2  ILE 109          HG22      ILE 109   0.616  -1.622  -1.622
  791   1HD1  ILE 109          HD13      ILE 109   1.160   2.692   2.692
  792   2HD1  ILE 109          HD12      ILE 109   2.889   3.001   3.001
  793   3HD1  ILE 109          HD11      ILE 109   2.057   3.381   3.381
  794    H    GLY 110           HN       GLY 110   0.107  -1.289  -1.289
  795   1HA   GLY 110           HA2      GLY 110  -2.821  -1.616  -1.616
  796   2HA   GLY 110           HA1      GLY 110  -1.741  -2.635  -2.635
  797    H    ASN 111           HN       ASN 111  -3.766  -3.373  -3.373
  798    HA   ASN 111           HA       ASN 111  -2.488  -4.178  -4.178
  799   1HB   ASN 111           HB2      ASN 111  -4.957  -4.115  -4.115
  800   2HB   ASN 111           HB1      ASN 111  -4.725  -5.597  -5.597
  801    HD2  ASN 111          HD22      ASN 111  -2.618  -6.311  -6.311
  802    H    GLY 112           HN       GLY 112  -2.733  -5.782  -5.782
  803   1HA   GLY 112           HA2      GLY 112  -0.703  -7.115  -7.115
  804   2HA   GLY 112           HA1      GLY 112  -0.795  -7.832  -7.832
  805    H    THR 113           HN       THR 113  -1.183  -8.660  -8.660
  806    HA   THR 113           HA       THR 113  -3.788 -10.079 -10.079
  807    HB   THR 113           HB       THR 113  -1.677  -9.894  -9.894
  808    HG1  THR 113           HG1      THR 113  -2.584  -8.077  -8.077
  809   1HG2  THR 113          HG21      THR 113  -4.399 -11.185 -11.185
  810   2HG2  THR 113          HG23      THR 113  -3.724 -10.640 -10.640
  811   3HG2  THR 113          HG22      THR 113  -2.881 -11.876 -11.876
  812    H    GLN 114           HN       GLN 114  -3.828 -12.222 -12.222
  813    HA   GLN 114           HA       GLN 114  -1.286 -13.595 -13.595
  814   1HB   GLN 114           HB2      GLN 114  -3.415 -13.762 -13.762
  815   2HB   GLN 114           HB1      GLN 114  -4.139 -14.657 -14.657
  816   1HG   GLN 114           HG2      GLN 114  -3.336 -16.391 -16.391
  817   2HG   GLN 114           HG1      GLN 114  -1.992 -16.153 -16.153
  818   1HE2  GLN 114          HE22      GLN 114  -0.300 -16.169 -16.169
  819   2HE2  GLN 114          HE21      GLN 114  -0.940 -17.251 -17.251
  820    H    ILE 115           HN       ILE 115  -0.270 -15.016 -15.016
  821    HA   ILE 115           HA       ILE 115  -1.675 -15.487 -15.487
  822    HB   ILE 115           HB       ILE 115   1.221 -15.804 -15.804
  823   1HG1  ILE 115          HG12      ILE 115  -0.112 -13.817 -13.817
  824   2HG1  ILE 115          HG11      ILE 115   0.355 -13.471 -13.471
  825   1HG2  ILE 115          HG22      ILE 115  -0.145 -16.304 -16.304
  826   2HG2  ILE 115          HG21      ILE 115   1.586 -15.995 -15.995
  827   3HG2  ILE 115          HG23      ILE 115   0.883 -17.406 -17.406
  828   1HD1  ILE 115          HD12      ILE 115   2.710 -14.367 -14.367
  829   2HD1  ILE 115          HD11      ILE 115   2.085 -13.909 -13.909
  830   3HD1  ILE 115          HD13      ILE 115   2.230 -12.697 -12.697
  831    H    TYR 116           HN       TYR 116  -2.582 -17.471 -17.471
  832    HA   TYR 116           HA       TYR 116  -1.944 -19.730 -19.730
  833   1HB   TYR 116           HB2      TYR 116  -4.218 -19.024 -19.024
  834   2HB   TYR 116           HB1      TYR 116  -4.095 -20.607 -20.607
  835    HD1  TYR 116           HD2      TYR 116  -2.811 -19.082 -19.082
  836    HD2  TYR 116           HD1      TYR 116  -6.477 -18.816 -18.816
  837    HE1  TYR 116           HE2      TYR 116  -4.036 -18.245 -18.245
  838    HE2  TYR 116           HE1      TYR 116  -7.685 -18.016 -18.016
  839    HH   TYR 116           HH       TYR 116  -6.295 -18.124 -18.124
  840    H    VAL 117           HN       VAL 117  -1.484 -21.818 -21.818
  841    HA   VAL 117           HA       VAL 117  -0.501 -21.841 -21.841
  842    HB   VAL 117           HB       VAL 117  -0.054 -23.709 -23.709
  843   1HG1  VAL 117          HG11      VAL 117   1.006 -23.753 -23.753
  844   2HG1  VAL 117          HG13      VAL 117   1.721 -24.689 -24.689
  845   3HG1  VAL 117          HG12      VAL 117   0.061 -25.007 -25.007
  846   1HG2  VAL 117          HG22      VAL 117   1.026 -21.378 -21.378
  847   2HG2  VAL 117          HG21      VAL 117   2.127 -22.747 -22.747
  848   3HG2  VAL 117          HG23      VAL 117   1.947 -21.938 -21.938
  849    H    ILE 118           HN       ILE 118  -0.990 -23.925 -23.925
  850    HA   ILE 118           HA       ILE 118  -3.838 -24.664 -24.664
  851    HB   ILE 118           HB       ILE 118  -1.889 -24.954 -24.954
  852   1HG1  ILE 118          HG12      ILE 118  -2.366 -22.623 -22.623
  853   2HG1  ILE 118          HG11      ILE 118  -3.209 -23.097 -23.097
  854   1HG2  ILE 118          HG23      ILE 118  -4.776 -25.691 -25.691
  855   2HG2  ILE 118          HG22      ILE 118  -4.204 -25.151 -25.151
  856   3HG2  ILE 118          HG21      ILE 118  -3.489 -26.574 -26.574
  857   1HD1  ILE 118          HD12      ILE 118  -5.062 -23.706 -23.706
  858   2HD1  ILE 118          HD11      ILE 118  -4.294 -22.281 -22.281
  859   3HD1  ILE 118          HD13      ILE 118  -5.029 -22.191 -22.191
  860    H    ASP 119           HN       ASP 119  -4.212 -26.591 -26.591
  861    HA   ASP 119           HA       ASP 119  -2.222 -28.813 -28.813
  862   1HB   ASP 119           HB2      ASP 119  -3.989 -27.974 -27.974
  863   2HB   ASP 119           HB1      ASP 119  -3.128 -29.512 -29.512
  864    HA   PRO 120           HA       PRO 120  -5.602 -31.036 -31.036
  865   1HB   PRO 120           HB2      PRO 120  -4.843 -33.614 -33.614
  866   2HB   PRO 120           HB1      PRO 120  -4.078 -32.619 -32.619
  867   1HG   PRO 120           HG2      PRO 120  -3.145 -33.224 -33.224
  868   2HG   PRO 120           HG1      PRO 120  -2.219 -33.127 -33.127
  869   1HD   PRO 120           HD2      PRO 120  -2.257 -31.130 -31.130
  870   2HD   PRO 120           HD1      PRO 120  -2.052 -30.838 -30.838
  871    H    GLU 121           HN       GLU 121  -7.569 -32.009 -32.009
  872    HA   GLU 121           HA       GLU 121  -7.794 -32.644 -32.644
  873   1HB   GLU 121           HB2      GLU 121  -9.633 -31.039 -31.039
  874   2HB   GLU 121           HB1      GLU 121 -10.014 -31.483 -31.483
  875   1HG   GLU 121           HG2      GLU 121  -8.067 -30.252 -30.252
  876   2HG   GLU 121           HG1      GLU 121  -7.586 -29.873 -29.873
  877    HA   PRO 122           HA       PRO 122  -9.689 -36.350 -36.350
  878   1HB   PRO 122           HB2      PRO 122 -11.082 -37.122 -37.122
  879   2HB   PRO 122           HB1      PRO 122  -9.323 -37.304 -37.304
  880   1HG   PRO 122           HG2      PRO 122 -10.891 -35.210 -35.210
  881   2HG   PRO 122           HG1      PRO 122  -9.399 -36.030 -36.030
  882   1HD   PRO 122           HD2      PRO 122  -9.434 -33.521 -33.521
  883   2HD   PRO 122           HD1      PRO 122  -8.068 -34.639 -34.639
  884    H    CYS 123           HN       CYS 123 -11.868 -37.181 -37.181
  885    HA   CYS 123           HA       CYS 123 -13.794 -35.027 -35.027
  886   1HB   CYS 123           HB2      CYS 123 -13.777 -38.018 -38.018
  887   2HB   CYS 123           HB1      CYS 123 -14.996 -36.908 -36.908
  888    HG   CYS 123           HG       CYS 123 -13.020 -35.663 -35.663
  889    HA   PRO 124           HA       PRO 124 -16.099 -35.797 -35.797
  890   1HB   PRO 124           HB2      PRO 124 -18.476 -34.628 -34.628
  891   2HB   PRO 124           HB1      PRO 124 -17.036 -33.700 -33.700
  892   1HG   PRO 124           HG2      PRO 124 -18.113 -34.294 -34.294
  893   2HG   PRO 124           HG1      PRO 124 -17.398 -32.801 -32.801
  894   1HD   PRO 124           HD2      PRO 124 -16.039 -34.542 -34.542
  895   2HD   PRO 124           HD1      PRO 124 -15.249 -33.524 -33.524
  896    H    ASP 125           HN       ASP 125 -17.565 -36.557 -36.557
  897    HA   ASP 125           HA       ASP 125 -19.640 -38.290 -38.290
  898   1HB   ASP 125           HB2      ASP 125 -19.714 -39.016 -39.016
  899   2HB   ASP 125           HB1      ASP 125 -19.623 -37.261 -37.261
  900    H    SER 126           HN       SER 126 -16.300 -38.908 -38.908
  901    HA   SER 126           HA       SER 126 -16.402 -41.775 -41.775
  902   1HB   SER 126           HB2      SER 126 -13.952 -41.551 -41.551
  903   2HB   SER 126           HB1      SER 126 -14.678 -40.390 -40.390
  904    HG   SER 126           HG       SER 126 -13.004 -39.609 -39.609
  905    H    ASP 127           HN       ASP 127 -15.818 -39.298 -39.298
  906    HA   ASP 127           HA       ASP 127 -15.344 -41.431 -41.431
  907   1HB   ASP 127           HB2      ASP 127 -13.679 -39.569 -39.569
  908   2HB   ASP 127           HB1      ASP 127 -14.904 -38.436 -38.436
  909    H    GLN 128           HN       GLN 128 -17.045 -41.890 -41.890
  910    HA   GLN 128           HA       GLN 128 -19.507 -40.341 -40.341
  911   1HB   GLN 128           HB2      GLN 128 -18.473 -42.599 -42.599
  912   2HB   GLN 128           HB1      GLN 128 -20.142 -42.028 -42.028
  913   1HG   GLN 128           HG2      GLN 128 -20.374 -42.610 -42.610
  914   2HG   GLN 128           HG1      GLN 128 -18.679 -43.091 -43.091
  915   1HE2  GLN 128          HE22      GLN 128 -20.911 -46.097 -46.097
  916   2HE2  GLN 128          HE21      GLN 128 -20.972 -44.867 -44.867
  917    H    GLU 129           HN       GLU 129 -20.417 -39.207 -39.207
  918    HA   GLU 129           HA       GLU 129 -20.301 -37.631 -37.631
  919   1HB   GLU 129           HB2      GLU 129 -18.243 -39.690 -39.690
  920   2HB   GLU 129           HB1      GLU 129 -18.912 -38.449 -38.449
  921   1HG   GLU 129           HG2      GLU 129 -21.165 -39.339 -39.339
  922   2HG   GLU 129           HG1      GLU 129 -20.557 -40.529 -40.529
  923    HA   PRO 130           HA       PRO 130 -16.151 -36.089 -36.089
  924   1HB   PRO 130           HB2      PRO 130 -17.106 -34.271 -34.271
  925   2HB   PRO 130           HB1      PRO 130 -16.743 -35.957 -35.957
  926   1HG   PRO 130           HG2      PRO 130 -19.367 -34.680 -34.680
  927   2HG   PRO 130           HG1      PRO 130 -18.955 -35.882 -35.882
  928   1HD   PRO 130           HD2      PRO 130 -20.190 -36.525 -36.525
  929   2HD   PRO 130           HD1      PRO 130 -19.100 -37.638 -37.638
  930    H    LYS 131           HN       LYS 131 -15.412 -33.758 -33.758
  931    HA   LYS 131           HA       LYS 131 -16.267 -32.520 -32.520
  932   1HB   LYS 131           HB2      LYS 131 -14.885 -31.394 -31.394
  933   2HB   LYS 131           HB1      LYS 131 -14.933 -30.591 -30.591
  934   1HG   LYS 131           HG2      LYS 131 -13.823 -32.560 -32.560
  935   2HG   LYS 131           HG1      LYS 131 -13.727 -33.317 -33.317
  936   1HD   LYS 131           HD2      LYS 131 -12.668 -30.561 -30.561
  937   2HD   LYS 131           HD1      LYS 131 -11.771 -31.718 -31.718
  938   1HE   LYS 131           HE2      LYS 131 -10.837 -31.670 -31.670
  939   2HE   LYS 131           HE1      LYS 131 -11.631 -33.234 -33.234
  940   1HZ   LYS 131           HZ3      LYS 131 -13.040 -30.889 -30.889
  941   2HZ   LYS 131           HZ2      LYS 131 -12.279 -32.063 -32.063
  942   3HZ   LYS 131           HZ1      LYS 131 -13.572 -32.499 -32.499
  943    H1   NAG 132           H1       NAG 132  -2.818  -6.010  -6.010
  944    H2   NAG 132           H2       NAG 132  -3.844  -3.382  -3.382
  945    H3   NAG 132           H3       NAG 132  -2.449  -3.830  -3.830
  946    H4   NAG 132           H4       NAG 132  -5.387  -3.106  -3.106
  947    H5   NAG 132           H5       NAG 132  -4.231  -5.787  -5.787
  948   1H6   NAG 132           H61      NAG 132  -6.291  -5.735  -5.735
  949   2H6   NAG 132           H62      NAG 132  -6.964  -4.630  -4.630
  950   1H8   NAG 132           H81      NAG 132   0.501  -3.199  -3.199
  951   2H8   NAG 132           H82      NAG 132   0.110  -1.496  -1.496
  952   3H8   NAG 132           H83      NAG 132   0.414  -1.989  -1.989
  953    HN2  NAG 132           HN2      NAG 132  -1.151  -4.434  -4.434
  954    HO3  NAG 132           HO3      NAG 132  -2.242  -1.746  -1.746
  955    H1   NAG 133           H1       NAG 133  -6.295  -2.267  -2.267
  956    H2   NAG 133           H2       NAG 133  -4.162  -2.084  -2.084
  957    H3   NAG 133           H3       NAG 133  -6.897  -0.713  -0.713
  958    H4   NAG 133           H4       NAG 133  -4.146   0.584   0.584
  959    H5   NAG 133           H5       NAG 133  -6.294   0.151   0.151
  960   1H6   NAG 133           H61      NAG 133  -3.625   0.811   0.811
  961   2H6   NAG 133           H62      NAG 133  -4.255   2.043   2.043
  962   1H8   NAG 133           H81      NAG 133  -7.523  -4.135  -4.135
  963   2H8   NAG 133           H82      NAG 133  -7.688  -5.230  -5.230
  964   3H8   NAG 133           H83      NAG 133  -8.983  -4.060  -4.060
  965    HN2  NAG 133           HN2      NAG 133  -5.400  -3.849  -3.849
  966    HO3  NAG 133           HO3      NAG 133  -6.425  -0.297  -0.297
  967    HO6  NAG 133           HO6      NAG 133  -5.538   2.684   2.684
  968    H1   FUC 134           H1       FUC 134  -7.681  -7.230  -7.230
  969    H2   FUC 134           H2       FUC 134  -8.355  -6.219  -6.219
  970    H3   FUC 134           H3       FUC 134  -9.570  -8.962  -8.962
  971    H4   FUC 134           H4       FUC 134  -8.339  -9.414  -9.414
  972    H5   FUC 134           H5       FUC 134  -6.931  -9.922  -9.922
  973   1H6   FUC 134           H61      FUC 134  -4.689  -9.324  -9.324
  974   2H6   FUC 134           H62      FUC 134  -5.729 -10.371 -10.371
  975   3H6   FUC 134           H63      FUC 134  -5.562  -8.630  -8.630
  976    HO2  FUC 134           HO2      FUC 134 -10.228  -6.119  -6.119
  977    HO3  FUC 134           HO3      FUC 134 -11.020  -8.014  -8.014
  978    HO4  FUC 134           HO4      FUC 134  -8.239  -7.538  -7.538
  979    H1   MAN 135           H1       MAN 135  -4.657   1.868   1.868
  980    H2   MAN 135           H2       MAN 135  -3.858   3.398   3.398
  981    H3   MAN 135           H3       MAN 135  -3.427   4.167   4.167
  982    H4   MAN 135           H4       MAN 135  -6.139   5.562   5.562
  983    H5   MAN 135           H5       MAN 135  -5.285   3.085   3.085
  984   1H6   MAN 135           H61      MAN 135  -7.842   4.678   4.678
  985   2H6   MAN 135           H62      MAN 135  -7.802   2.990   2.990
  986    HO2  MAN 135           HO2      MAN 135  -6.488   4.500   4.500
  987    HO3  MAN 135           HO3      MAN 135  -2.872   5.731   5.731
  988    HO4  MAN 135           HO4      MAN 135  -4.707   6.600   6.600
  989    HO6  MAN 135           HO6      MAN 135  -7.583   4.739   4.739
  990    H1   NAG 136           H1       NAG 136   1.628  -7.994  -7.994
  991    H2   NAG 136           H2       NAG 136  -1.103  -7.264  -7.264
  992    H3   NAG 136           H3       NAG 136   0.130 -10.063 -10.063
  993    H4   NAG 136           H4       NAG 136  -0.204  -8.627  -8.627
  994    H5   NAG 136           H5       NAG 136   2.361  -9.077  -9.077
  995   1H6   NAG 136           H61      NAG 136   3.110  -8.941  -8.941
  996   2H6   NAG 136           H62      NAG 136   1.590  -8.263  -8.263
  997   1H8   NAG 136           H81      NAG 136  -2.035  -9.698  -9.698
  998   2H8   NAG 136           H82      NAG 136  -3.155  -8.381  -8.381
  999   3H8   NAG 136           H83      NAG 136  -3.672  -9.630  -9.630
 1000    HN2  NAG 136           HN2      NAG 136  -0.392  -8.267  -8.267
 1001    HO3  NAG 136           HO3      NAG 136  -1.815 -10.678 -10.678
 1002    H1   NAG 137           H1       NAG 137   2.396 -10.543 -10.543
 1003    H2   NAG 137           H2       NAG 137   0.800 -12.887 -12.887
 1004    H3   NAG 137           H3       NAG 137   3.815 -12.680 -12.680
 1005    H4   NAG 137           H4       NAG 137   2.267 -12.745 -12.745
 1006    H5   NAG 137           H5       NAG 137   3.743 -10.369 -10.369
 1007   1H6   NAG 137           H61      NAG 137   3.858 -10.244 -10.244
 1008   2H6   NAG 137           H62      NAG 137   2.606  -9.114  -9.114
 1009   1H8   NAG 137           H81      NAG 137   2.187 -13.980 -13.980
 1010   2H8   NAG 137           H82      NAG 137   0.749 -15.040 -15.040
 1011   3H8   NAG 137           H83      NAG 137   2.326 -15.630 -15.630
 1012    HN2  NAG 137           HN2      NAG 137   1.881 -12.361 -12.361
 1013    HO3  NAG 137           HO3      NAG 137   3.787 -14.698 -14.698
 1014    HO6  NAG 137           HO6      NAG 137   1.490 -10.163 -10.163
 1015    H1   FUC 138           H1       FUC 138   3.197  -7.158  -7.158
 1016    H2   FUC 138           H2       FUC 138   1.763  -4.541  -4.541
 1017    H3   FUC 138           H3       FUC 138   1.349  -5.309  -5.309
 1018    H4   FUC 138           H4       FUC 138   2.785  -3.119  -3.119
 1019    H5   FUC 138           H5       FUC 138   4.361  -5.232  -5.232
 1020   1H6   FUC 138           H61      FUC 138   5.060  -2.624  -2.624
 1021   2H6   FUC 138           H62      FUC 138   6.112  -4.060  -4.060
 1022   3H6   FUC 138           H63      FUC 138   5.767  -3.381  -3.381
 1023    HO2  FUC 138           HO2      FUC 138   0.131  -6.076  -6.076
 1024    HO3  FUC 138           HO3      FUC 138  -0.345  -4.301  -4.301
 1025    HO4  FUC 138           HO4      FUC 138   3.118  -3.026  -3.026
 1026    H1   MAN 139           H1       MAN 139   3.708 -12.206 -12.206
 1027    H2   MAN 139           H2       MAN 139   6.168 -11.846 -11.846
 1028    H3   MAN 139           H3       MAN 139   5.322 -12.535 -12.535
 1029    H4   MAN 139           H4       MAN 139   5.760 -15.424 -15.424
 1030    H5   MAN 139           H5       MAN 139   3.111 -13.912 -13.912
 1031   1H6   MAN 139           H61      MAN 139   2.030 -15.859 -15.859
 1032   2H6   MAN 139           H62      MAN 139   3.161 -16.349 -16.349
 1033    HO2  MAN 139           HO2      MAN 139   7.373 -13.266 -13.266
 1034    HO3  MAN 139           HO3      MAN 139   7.673 -13.987 -13.987
 1035    HO4  MAN 139           HO4      MAN 139   4.577 -14.227 -14.227
 1036    HO6  MAN 139           HO6      MAN 139   3.026 -17.366 -17.366

  Start of MODEL    9
    1   1H    ALA   1           HT3      ALA   1  -5.894   9.711   9.711
    2   2H    ALA   1           HT2      ALA   1  -6.775   8.871   8.871
    3   3H    ALA   1           HT1      ALA   1  -6.405  10.515  10.515
    4    HA   ALA   1           HA       ALA   1  -4.104  10.066  10.066
    5   1HB   ALA   1           HB3      ALA   1  -6.035   8.202   8.202
    6   2HB   ALA   1           HB2      ALA   1  -4.362   8.404   8.404
    7   3HB   ALA   1           HB1      ALA   1  -5.467   9.778   9.778
    8    H    MET   1           HN       MET   1  -5.768   6.906   6.906
    9    HA   MET   1           HA       MET   1  -3.452   5.958   5.958
   10   1HB   MET   1           HB2      MET   1  -4.772   4.606   4.606
   11   2HB   MET   1           HB1      MET   1  -3.571   3.839   3.839
   12   1HG   MET   1           HG2      MET   1  -1.917   5.534   5.534
   13   2HG   MET   1           HG1      MET   1  -3.115   6.398   6.398
   14   1HE   MET   1           HE2      MET   1  -0.597   5.940   5.940
   15   2HE   MET   1           HE1      MET   1  -1.965   6.394   6.394
   16   3HE   MET   1           HE3      MET   1  -0.889   5.081   5.081
   17    H    HIS   2           HN       HIS   2  -5.134   6.383   6.383
   18    HA   HIS   2           HA       HIS   2  -7.371   4.411   4.411
   19   1HB   HIS   2           HB2      HIS   2  -6.644   6.822   6.822
   20   2HB   HIS   2           HB1      HIS   2  -8.098   5.849   5.849
   21    HD1  HIS   2           HD1      HIS   2  -6.607   8.473   8.473
   22    HD2  HIS   2           HD2      HIS   2 -10.013   6.069   6.069
   23    HE1  HIS   2           HE1      HIS   2  -8.181   9.447   9.447
   24    H    VAL   3           HN       VAL   3  -6.939   2.504   2.504
   25    HA   VAL   3           HA       VAL   3  -5.438   2.518   2.518
   26    HB   VAL   3           HB       VAL   3  -4.709   0.917   0.917
   27   1HG1  VAL   3          HG11      VAL   3  -3.531   0.855   0.855
   28   2HG1  VAL   3          HG13      VAL   3  -2.848   0.034   0.034
   29   3HG1  VAL   3          HG12      VAL   3  -4.425  -0.450  -0.450
   30   1HG2  VAL   3          HG23      VAL   3  -3.407   3.196   3.196
   31   2HG2  VAL   3          HG22      VAL   3  -3.815   3.110   3.110
   32   3HG2  VAL   3          HG21      VAL   3  -2.487   2.142   2.142
   33    H    ALA   4           HN       ALA   4  -6.045   0.740   0.740
   34    HA   ALA   4           HA       ALA   4  -8.341  -0.895  -0.895
   35   1HB   ALA   4           HB2      ALA   4  -8.232   0.822   0.822
   36   2HB   ALA   4           HB1      ALA   4  -7.845  -0.705  -0.705
   37   3HB   ALA   4           HB3      ALA   4  -9.353  -0.537  -0.537
   38    H    GLN   5           HN       GLN   5  -8.059  -3.072  -3.072
   39    HA   GLN   5           HA       GLN   5  -5.973  -4.382  -4.382
   40   1HB   GLN   5           HB2      GLN   5  -6.212  -4.278  -4.278
   41   2HB   GLN   5           HB1      GLN   5  -5.372  -5.612  -5.612
   42   1HG   GLN   5           HG2      GLN   5  -4.719  -2.732  -2.732
   43   2HG   GLN   5           HG1      GLN   5  -3.939  -3.605  -3.605
   44   1HE2  GLN   5          HE22      GLN   5  -1.760  -5.341  -5.341
   45   2HE2  GLN   5          HE21      GLN   5  -2.161  -4.889  -4.889
   46    HA   PRO   6           HA       PRO   6  -9.250  -7.438  -7.438
   47   1HB   PRO   6           HB2      PRO   6  -7.802  -9.492  -9.492
   48   2HB   PRO   6           HB1      PRO   6  -8.363  -8.108  -8.108
   49   1HG   PRO   6           HG2      PRO   6  -5.673  -8.637  -8.637
   50   2HG   PRO   6           HG1      PRO   6  -6.106  -7.951  -7.951
   51   1HD   PRO   6           HD2      PRO   6  -5.282  -6.440  -6.440
   52   2HD   PRO   6           HD1      PRO   6  -6.405  -5.844  -5.844
   53    H    ALA   7           HN       ALA   7  -9.922  -9.005  -9.005
   54    HA   ALA   7           HA       ALA   7  -8.289  -9.499  -9.499
   55   1HB   ALA   7           HB2      ALA   7 -10.773  -9.388  -9.388
   56   2HB   ALA   7           HB1      ALA   7 -10.818 -10.851 -10.851
   57   3HB   ALA   7           HB3      ALA   7 -10.213 -10.919 -10.919
   58    H    VAL   8           HN       VAL   8  -8.796 -11.281 -11.281
   59    HA   VAL   8           HA       VAL   8  -6.627 -13.070 -13.070
   60    HB   VAL   8           HB       VAL   8  -8.939 -13.840 -13.840
   61   1HG1  VAL   8          HG13      VAL   8  -9.469 -13.885 -13.885
   62   2HG1  VAL   8          HG12      VAL   8  -9.705 -15.477 -15.477
   63   3HG1  VAL   8          HG11      VAL   8 -10.583 -14.067 -14.067
   64   1HG2  VAL   8          HG21      VAL   8  -6.662 -15.156 -15.156
   65   2HG2  VAL   8          HG23      VAL   8  -8.054 -15.886 -15.886
   66   3HG2  VAL   8          HG22      VAL   8  -7.815 -16.040 -16.040
   67    H    VAL   9           HN       VAL   9  -5.928 -14.414 -14.414
   68    HA   VAL   9           HA       VAL   9  -6.861 -13.610 -13.610
   69    HB   VAL   9           HB       VAL   9  -4.169 -13.213 -13.213
   70   1HG1  VAL   9          HG13      VAL   9  -4.747 -13.695 -13.695
   71   2HG1  VAL   9          HG12      VAL   9  -3.396 -12.677 -12.677
   72   3HG1  VAL   9          HG11      VAL   9  -3.450 -14.374 -14.374
   73   1HG2  VAL   9          HG23      VAL   9  -5.943 -11.416 -11.416
   74   2HG2  VAL   9          HG22      VAL   9  -4.386 -11.008 -11.008
   75   3HG2  VAL   9          HG21      VAL   9  -5.728 -11.503 -11.503
   76    H    LEU  10           HN       LEU  10  -6.323 -15.181 -15.181
   77    HA   LEU  10           HA       LEU  10  -5.660 -17.877 -17.877
   78   1HB   LEU  10           HB2      LEU  10  -7.128 -17.012 -17.012
   79   2HB   LEU  10           HB1      LEU  10  -6.921 -18.680 -18.680
   80    HG   LEU  10           HG       LEU  10  -8.340 -16.512 -16.512
   81   1HD1  LEU  10          HD11      LEU  10  -9.584 -17.203 -17.203
   82   2HD1  LEU  10          HD13      LEU  10  -9.450 -18.889 -18.889
   83   3HD1  LEU  10          HD12      LEU  10 -10.390 -17.753 -17.753
   84   1HD2  LEU  10          HD22      LEU  10  -7.568 -19.347 -19.347
   85   2HD2  LEU  10          HD21      LEU  10  -7.681 -17.979 -17.979
   86   3HD2  LEU  10          HD23      LEU  10  -9.145 -18.806 -18.806
   87    H    ALA  11           HN       ALA  11  -3.752 -18.797 -18.797
   88    HA   ALA  11           HA       ALA  11  -2.109 -17.377 -17.377
   89   1HB   ALA  11           HB1      ALA  11  -1.689 -19.467 -19.467
   90   2HB   ALA  11           HB3      ALA  11  -0.446 -19.170 -19.170
   91   3HB   ALA  11           HB2      ALA  11  -0.953 -17.870 -17.870
   92    H    SER  12           HN       SER  12  -1.423 -18.335 -18.335
   93    HA   SER  12           HA       SER  12  -3.058 -20.478 -20.478
   94   1HB   SER  12           HB2      SER  12  -0.572 -19.046 -19.046
   95   2HB   SER  12           HB1      SER  12  -1.623 -20.055 -20.055
   96    HG   SER  12           HG       SER  12  -1.900 -17.480 -17.480
   97    H    SER  13           HN       SER  13  -1.905 -22.378 -22.378
   98    HA   SER  13           HA       SER  13  -0.561 -24.025 -24.025
   99   1HB   SER  13           HB2      SER  13  -0.246 -25.499 -25.499
  100   2HB   SER  13           HB1      SER  13  -1.847 -24.767 -24.767
  101    HG   SER  13           HG       SER  13  -1.294 -23.873 -23.873
  102    H    ARG  14           HN       ARG  14   0.694 -21.875 -21.875
  103    HA   ARG  14           HA       ARG  14   3.428 -22.689 -22.689
  104   1HB   ARG  14           HB2      ARG  14   2.219 -21.137 -21.137
  105   2HB   ARG  14           HB1      ARG  14   2.330 -19.890 -19.890
  106   1HG   ARG  14           HG2      ARG  14   4.455 -19.432 -19.432
  107   2HG   ARG  14           HG1      ARG  14   4.926 -21.109 -21.109
  108   1HD   ARG  14           HD2      ARG  14   4.065 -21.638 -21.638
  109   2HD   ARG  14           HD1      ARG  14   3.746 -19.908 -19.908
  110    HE   ARG  14           HE       ARG  14   6.450 -20.358 -20.358
  111   1HH1  ARG  14          HH21      ARG  14   4.421 -20.443 -20.443
  112   2HH1  ARG  14          HH22      ARG  14   5.747 -20.172 -20.172
  113   1HH2  ARG  14          HH11      ARG  14   8.135 -20.009 -20.009
  114   2HH2  ARG  14          HH12      ARG  14   7.828 -19.928 -19.928
  115    H    GLY  15           HN       GLY  15   1.574 -20.756 -20.756
  116   1HA   GLY  15           HA2      GLY  15   2.291 -20.447 -20.447
  117   2HA   GLY  15           HA1      GLY  15   3.965 -20.611 -20.611
  118    H    ILE  16           HN       ILE  16   1.626 -18.619 -18.619
  119    HA   ILE  16           HA       ILE  16   3.258 -16.224 -16.224
  120    HB   ILE  16           HB       ILE  16   1.521 -17.084 -17.084
  121   1HG1  ILE  16          HG12      ILE  16   3.457 -16.735 -16.735
  122   2HG1  ILE  16          HG11      ILE  16   4.238 -15.766 -15.766
  123   1HG2  ILE  16          HG22      ILE  16   2.209 -14.286 -14.286
  124   2HG2  ILE  16          HG21      ILE  16   2.187 -14.668 -14.668
  125   3HG2  ILE  16          HG23      ILE  16   0.733 -14.896 -14.896
  126   1HD1  ILE  16          HD13      ILE  16   3.657 -18.729 -18.729
  127   2HD1  ILE  16          HD12      ILE  16   5.193 -18.085 -18.085
  128   3HD1  ILE  16          HD11      ILE  16   4.654 -17.715 -17.715
  129    H    ALA  17           HN       ALA  17   2.302 -15.385 -15.385
  130    HA   ALA  17           HA       ALA  17  -0.667 -14.974 -14.974
  131   1HB   ALA  17           HB2      ALA  17   0.512 -16.268 -16.268
  132   2HB   ALA  17           HB1      ALA  17   1.285 -14.746 -14.746
  133   3HB   ALA  17           HB3      ALA  17  -0.468 -14.901 -14.901
  134    H    SER  18           HN       SER  18  -1.289 -12.898 -12.898
  135    HA   SER  18           HA       SER  18   0.579 -10.677 -10.677
  136   1HB   SER  18           HB2      SER  18   0.124  -9.690  -9.690
  137   2HB   SER  18           HB1      SER  18   0.806 -11.304 -11.304
  138    HG   SER  18           HG       SER  18  -0.938 -11.747 -11.747
  139    H    PHE  19           HN       PHE  19  -0.429  -8.721  -8.721
  140    HA   PHE  19           HA       PHE  19  -3.346  -8.402  -8.402
  141   1HB   PHE  19           HB2      PHE  19  -3.553  -8.111  -8.111
  142   2HB   PHE  19           HB1      PHE  19  -3.112  -9.748  -9.748
  143    HD1  PHE  19           HD1      PHE  19  -1.885  -6.576  -6.576
  144    HD2  PHE  19           HD2      PHE  19  -0.910 -10.672 -10.672
  145    HE1  PHE  19           HE1      PHE  19   0.167  -6.443  -6.443
  146    HE2  PHE  19           HE2      PHE  19   1.142 -10.539 -10.539
  147    HZ   PHE  19           HZ       PHE  19   1.680  -8.428  -8.428
  148    H    VAL  20           HN       VAL  20  -3.955  -6.165  -6.165
  149    HA   VAL  20           HA       VAL  20  -1.599  -4.325  -4.325
  150    HB   VAL  20           HB       VAL  20  -4.320  -4.114  -4.114
  151   1HG1  VAL  20          HG12      VAL  20  -3.404  -1.900  -1.900
  152   2HG1  VAL  20          HG11      VAL  20  -1.954  -2.232  -2.232
  153   3HG1  VAL  20          HG13      VAL  20  -3.515  -2.058  -2.058
  154   1HG2  VAL  20          HG21      VAL  20  -2.535  -5.708  -5.708
  155   2HG2  VAL  20          HG23      VAL  20  -3.208  -4.520  -4.520
  156   3HG2  VAL  20          HG22      VAL  20  -1.619  -4.253  -4.253
  157    H    CYS  21           HN       CYS  21  -1.438  -3.024  -3.024
  158    HA   CYS  21           HA       CYS  21  -3.845  -2.540  -2.540
  159   1HB   CYS  21           HB2      CYS  21  -1.699  -3.549  -3.549
  160   2HB   CYS  21           HB1      CYS  21  -0.893  -2.032  -2.032
  161    H    GLU  22           HN       GLU  22  -4.852  -0.667  -0.667
  162    HA   GLU  22           HA       GLU  22  -3.321   1.469   1.469
  163   1HB   GLU  22           HB2      GLU  22  -5.501   2.428   2.428
  164   2HB   GLU  22           HB1      GLU  22  -5.620   0.688   0.688
  165   1HG   GLU  22           HG2      GLU  22  -6.353   0.519   0.519
  166   2HG   GLU  22           HG1      GLU  22  -6.504   2.271   2.271
  167    H    TYR  23           HN       TYR  23  -3.351   3.714   3.714
  168    HA   TYR  23           HA       TYR  23  -3.749   4.035   4.035
  169   1HB   TYR  23           HB2      TYR  23  -1.494   5.003   5.003
  170   2HB   TYR  23           HB1      TYR  23  -1.386   3.396   3.396
  171    HD1  TYR  23           HD2      TYR  23  -1.170   7.040   7.040
  172    HD2  TYR  23           HD1      TYR  23  -0.713   3.062   3.062
  173    HE1  TYR  23           HE2      TYR  23  -0.020   8.000   8.000
  174    HE2  TYR  23           HE1      TYR  23   0.441   4.022   4.022
  175    HH   TYR  23           HH       TYR  23   0.294   7.141   7.141
  176    H    ALA  24           HN       ALA  24  -3.268   6.567   6.567
  177    HA   ALA  24           HA       ALA  24  -4.472   8.145   8.145
  178   1HB   ALA  24           HB2      ALA  24  -5.323   7.765   7.765
  179   2HB   ALA  24           HB1      ALA  24  -5.667   9.302   9.302
  180   3HB   ALA  24           HB3      ALA  24  -6.311   7.801   7.801
  181    H    SER  25           HN       SER  25  -3.242   9.910   9.910
  182    HA   SER  25           HA       SER  25  -1.885  11.380  11.380
  183   1HB   SER  25           HB2      SER  25   0.278  11.203  11.203
  184   2HB   SER  25           HB1      SER  25  -0.346   9.595   9.595
  185    HG   SER  25           HG       SER  25   0.454  10.052  10.052
  186    HA   PRO  26           HA       PRO  26  -2.986  14.803  14.803
  187   1HB   PRO  26           HB2      PRO  26  -0.964  16.586  16.586
  188   2HB   PRO  26           HB1      PRO  26  -2.249  16.233  16.233
  189   1HG   PRO  26           HG2      PRO  26   0.542  15.195  15.195
  190   2HG   PRO  26           HG1      PRO  26  -0.415  15.701  15.701
  191   1HD   PRO  26           HD2      PRO  26  -0.041  13.098  13.098
  192   2HD   PRO  26           HD1      PRO  26  -1.509  13.686  13.686
  193    H    GLY  27           HN       GLY  27  -2.767  14.884  14.884
  194   1HA   GLY  27           HA2      GLY  27  -1.796  14.783  14.783
  195   2HA   GLY  27           HA1      GLY  27  -0.364  15.493  15.493
  196    H    LYS  28           HN       LYS  28   1.337  14.244  14.244
  197    HA   LYS  28           HA       LYS  28   1.099  11.276  11.276
  198   1HB   LYS  28           HB2      LYS  28   2.456  12.923  12.923
  199   2HB   LYS  28           HB1      LYS  28   2.714  11.189  11.189
  200   1HG   LYS  28           HG2      LYS  28   0.256  10.832  10.832
  201   2HG   LYS  28           HG1      LYS  28   0.061  12.558  12.558
  202   1HD   LYS  28           HD2      LYS  28   1.475  12.406  12.406
  203   2HD   LYS  28           HD1      LYS  28   1.787  10.700  10.700
  204   1HE   LYS  28           HE2      LYS  28  -0.655  10.233  10.233
  205   2HE   LYS  28           HE1      LYS  28  -0.911  11.936  11.936
  206   1HZ   LYS  28           HZ2      LYS  28   0.996  10.126  10.126
  207   2HZ   LYS  28           HZ1      LYS  28  -0.561  10.488  10.488
  208   3HZ   LYS  28           HZ3      LYS  28   0.601  11.717  11.717
  209    H    ALA  29           HN       ALA  29   2.865  10.296  10.296
  210    HA   ALA  29           HA       ALA  29   4.994  12.147  12.147
  211   1HB   ALA  29           HB1      ALA  29   3.537   9.753   9.753
  212   2HB   ALA  29           HB3      ALA  29   5.059  10.305  10.305
  213   3HB   ALA  29           HB2      ALA  29   3.659  11.377  11.377
  214    H    THR  30           HN       THR  30   7.154  11.445  11.445
  215    HA   THR  30           HA       THR  30   7.754   9.441   9.441
  216    HB   THR  30           HB       THR  30  10.123  10.058  10.058
  217    HG1  THR  30           HG1      THR  30  10.250  11.647  11.647
  218   1HG2  THR  30          HG23      THR  30   8.168  11.679  11.679
  219   2HG2  THR  30          HG22      THR  30   9.650  12.492  12.492
  220   3HG2  THR  30          HG21      THR  30   9.739  11.038  11.038
  221    H    GLU  31           HN       GLU  31   8.888   9.818   9.818
  222    HA   GLU  31           HA       GLU  31   9.839   7.065   7.065
  223   1HB   GLU  31           HB2      GLU  31   9.631   9.164   9.164
  224   2HB   GLU  31           HB1      GLU  31  10.681   7.760   7.760
  225   1HG   GLU  31           HG2      GLU  31  10.998   9.535   9.535
  226   2HG   GLU  31           HG1      GLU  31  11.457  10.248  10.248
  227    H    VAL  32           HN       VAL  32   7.509   6.091   6.091
  228    HA   VAL  32           HA       VAL  32   5.891   6.255   6.255
  229    HB   VAL  32           HB       VAL  32   4.448   4.583   4.583
  230   1HG1  VAL  32          HG11      VAL  32   4.636   7.294   7.294
  231   2HG1  VAL  32          HG13      VAL  32   4.766   6.771   6.771
  232   3HG1  VAL  32          HG12      VAL  32   3.359   6.307   6.307
  233   1HG2  VAL  32          HG23      VAL  32   6.744   4.181   4.181
  234   2HG2  VAL  32          HG22      VAL  32   5.129   3.606   3.606
  235   3HG2  VAL  32          HG21      VAL  32   5.722   5.130   5.130
  236    H    ARG  33           HN       ARG  33   7.441   5.430   5.430
  237    HA   ARG  33           HA       ARG  33   9.004   3.093   3.093
  238   1HB   ARG  33           HB2      ARG  33   9.140   4.875   4.875
  239   2HB   ARG  33           HB1      ARG  33   7.652   4.247   4.247
  240   1HG   ARG  33           HG2      ARG  33   8.665   2.294   2.294
  241   2HG   ARG  33           HG1      ARG  33   9.936   2.361   2.361
  242   1HD   ARG  33           HD2      ARG  33  11.238   3.168   3.168
  243   2HD   ARG  33           HD1      ARG  33  10.368   4.692   4.692
  244    HE   ARG  33           HE       ARG  33   9.076   4.250   4.250
  245   1HH1  ARG  33          HH21      ARG  33  10.785   1.364   1.364
  246   2HH1  ARG  33          HH22      ARG  33  10.371   0.500   0.500
  247   1HH2  ARG  33          HH11      ARG  33   8.562   3.090   3.090
  248   2HH2  ARG  33          HH12      ARG  33   9.125   1.463   1.463
  249    H    VAL  34           HN       VAL  34   7.888   1.300   1.300
  250    HA   VAL  34           HA       VAL  34   5.495   0.330   0.330
  251    HB   VAL  34           HB       VAL  34   5.182  -1.080  -1.080
  252   1HG1  VAL  34          HG12      VAL  34   5.241   1.876   1.876
  253   2HG1  VAL  34          HG11      VAL  34   5.132   1.166   1.166
  254   3HG1  VAL  34          HG13      VAL  34   3.917   0.781   0.781
  255   1HG2  VAL  34          HG23      VAL  34   7.667  -1.116  -1.116
  256   2HG2  VAL  34          HG22      VAL  34   6.579  -0.805  -0.805
  257   3HG2  VAL  34          HG21      VAL  34   7.462   0.526   0.526
  258    H    THR  35           HN       THR  35   5.642  -1.418  -1.418
  259    HA   THR  35           HA       THR  35   7.938  -3.300  -3.300
  260    HB   THR  35           HB       THR  35   6.866  -2.166  -2.166
  261    HG1  THR  35           HG1      THR  35   8.152  -0.660  -0.660
  262   1HG2  THR  35          HG21      THR  35   8.556  -4.490  -4.490
  263   2HG2  THR  35          HG23      THR  35   9.254  -3.401  -3.401
  264   3HG2  THR  35          HG22      THR  35   7.668  -4.120  -4.120
  265    H    VAL  36           HN       VAL  36   7.442  -5.466  -5.466
  266    HA   VAL  36           HA       VAL  36   4.543  -6.080  -6.080
  267    HB   VAL  36           HB       VAL  36   6.749  -7.546  -7.546
  268   1HG1  VAL  36          HG11      VAL  36   3.814  -8.179  -8.179
  269   2HG1  VAL  36          HG13      VAL  36   4.809  -8.940  -8.940
  270   3HG1  VAL  36          HG12      VAL  36   5.195  -9.173  -9.173
  271   1HG2  VAL  36          HG23      VAL  36   4.598  -5.625  -5.625
  272   2HG2  VAL  36          HG22      VAL  36   6.205  -5.852  -5.852
  273   3HG2  VAL  36          HG21      VAL  36   4.908  -6.974  -6.974
  274    H    LEU  37           HN       LEU  37   4.067  -7.352  -7.352
  275    HA   LEU  37           HA       LEU  37   6.464  -8.551  -8.551
  276   1HB   LEU  37           HB2      LEU  37   3.887  -7.383  -7.383
  277   2HB   LEU  37           HB1      LEU  37   5.186  -8.060  -8.060
  278    HG   LEU  37           HG       LEU  37   5.788  -5.868  -5.868
  279   1HD1  LEU  37          HD11      LEU  37   3.787  -5.477  -5.477
  280   2HD1  LEU  37          HD13      LEU  37   5.181  -5.124  -5.124
  281   3HD1  LEU  37          HD12      LEU  37   4.931  -4.207  -4.207
  282   1HD2  LEU  37          HD23      LEU  37   7.043  -7.233  -7.233
  283   2HD2  LEU  37          HD22      LEU  37   7.791  -6.464  -6.464
  284   3HD2  LEU  37          HD21      LEU  37   7.256  -5.480  -5.480
  285    H    ARG  38           HN       ARG  38   5.870 -10.369 -10.369
  286    HA   ARG  38           HA       ARG  38   3.528 -11.954 -11.954
  287   1HB   ARG  38           HB2      ARG  38   5.708 -12.743 -12.743
  288   2HB   ARG  38           HB1      ARG  38   6.316 -12.923 -12.923
  289   1HG   ARG  38           HG2      ARG  38   4.540 -14.565 -14.565
  290   2HG   ARG  38           HG1      ARG  38   3.925 -14.383 -14.383
  291   1HD   ARG  38           HD2      ARG  38   6.129 -15.156 -15.156
  292   2HD   ARG  38           HD1      ARG  38   6.666 -15.438 -15.438
  293    HE   ARG  38           HE       ARG  38   4.705 -17.047 -17.047
  294   1HH1  ARG  38          HH21      ARG  38   5.839 -16.046 -16.046
  295   2HH1  ARG  38          HH22      ARG  38   5.213 -17.455 -17.455
  296   1HH2  ARG  38          HH11      ARG  38   3.910 -18.850 -18.850
  297   2HH2  ARG  38          HH12      ARG  38   4.131 -19.025 -19.025
  298    H    GLN  39           HN       GLN  39   2.144 -12.286 -12.286
  299    HA   GLN  39           HA       GLN  39   3.313 -12.182 -12.182
  300   1HB   GLN  39           HB2      GLN  39   0.560 -11.692 -11.692
  301   2HB   GLN  39           HB1      GLN  39   0.854 -11.800 -11.800
  302   1HG   GLN  39           HG2      GLN  39   2.457  -9.960  -9.960
  303   2HG   GLN  39           HG1      GLN  39   2.258  -9.876  -9.876
  304   1HE2  GLN  39          HE22      GLN  39  -1.095  -8.477  -8.477
  305   2HE2  GLN  39          HE21      GLN  39  -0.219  -9.587  -9.587
  306    H    ALA  40           HN       ALA  40   3.352 -13.955 -13.955
  307    HA   ALA  40           HA       ALA  40   1.644 -16.301 -16.301
  308   1HB   ALA  40           HB3      ALA  40   4.542 -15.936 -15.936
  309   2HB   ALA  40           HB2      ALA  40   3.964 -17.254 -17.254
  310   3HB   ALA  40           HB1      ALA  40   3.641 -17.274 -17.274
  311    H    ASP  41           HN       ASP  41   1.029 -17.627 -17.627
  312    HA   ASP  41           HA       ASP  41   0.262 -16.175 -16.175
  313   1HB   ASP  41           HB2      ASP  41   0.614 -19.092 -19.092
  314   2HB   ASP  41           HB1      ASP  41  -0.090 -18.534 -18.534
  315    H    SER  42           HN       SER  42   3.027 -18.378 -18.378
  316    HA   SER  42           HA       SER  42   4.027 -18.211 -18.211
  317   1HB   SER  42           HB2      SER  42   4.541 -19.983 -19.983
  318   2HB   SER  42           HB1      SER  42   5.448 -18.806 -18.806
  319    HG   SER  42           HG       SER  42   7.056 -19.089 -19.089
  320    H    GLN  43           HN       GLN  43   5.099 -16.556 -16.556
  321    HA   GLN  43           HA       GLN  43   5.962 -14.210 -14.210
  322   1HB   GLN  43           HB2      GLN  43   7.809 -16.069 -16.069
  323   2HB   GLN  43           HB1      GLN  43   8.277 -14.429 -14.429
  324   1HG   GLN  43           HG2      GLN  43   7.697 -15.030 -15.030
  325   2HG   GLN  43           HG1      GLN  43   7.553 -16.703 -16.703
  326   1HE2  GLN  43          HE22      GLN  43  11.195 -15.267 -15.267
  327   2HE2  GLN  43          HE21      GLN  43   9.759 -14.506 -14.506
  328    H    VAL  44           HN       VAL  44   6.687 -12.419 -12.419
  329    HA   VAL  44           HA       VAL  44   5.624 -12.654 -12.654
  330    HB   VAL  44           HB       VAL  44   5.455 -10.379 -10.379
  331   1HG1  VAL  44          HG12      VAL  44   5.774  -9.580  -9.580
  332   2HG1  VAL  44          HG11      VAL  44   4.371 -10.528 -10.528
  333   3HG1  VAL  44          HG13      VAL  44   4.175  -9.181  -9.181
  334   1HG2  VAL  44          HG23      VAL  44   3.884 -12.584 -12.584
  335   2HG2  VAL  44          HG22      VAL  44   3.280 -10.999 -10.999
  336   3HG2  VAL  44          HG21      VAL  44   3.045 -11.568 -11.568
  337    H    THR  45           HN       THR  45   7.024 -11.868 -11.868
  338    HA   THR  45           HA       THR  45   9.388 -10.247 -10.247
  339    HB   THR  45           HB       THR  45  10.821 -11.784 -11.784
  340    HG1  THR  45           HG1      THR  45   9.860 -13.051 -13.051
  341   1HG2  THR  45          HG22      THR  45  10.346 -12.159 -12.159
  342   2HG2  THR  45          HG21      THR  45   9.128 -13.338 -13.338
  343   3HG2  THR  45          HG23      THR  45  10.825 -13.607 -13.607
  344    H    GLU  46           HN       GLU  46  10.534  -9.292  -9.292
  345    HA   GLU  46           HA       GLU  46   8.622  -8.203  -8.203
  346   1HB   GLU  46           HB2      GLU  46  10.498  -6.946  -6.946
  347   2HB   GLU  46           HB1      GLU  46  11.632  -7.926  -7.926
  348   1HG   GLU  46           HG2      GLU  46  10.392  -7.109  -7.109
  349   2HG   GLU  46           HG1      GLU  46   9.633  -5.919  -5.919
  350    H    VAL  47           HN       VAL  47   8.913  -8.388  -8.388
  351    HA   VAL  47           HA       VAL  47  10.233 -10.952 -10.952
  352    HB   VAL  47           HB       VAL  47   7.677  -9.585  -9.585
  353   1HG1  VAL  47          HG12      VAL  47   8.837 -10.735 -10.735
  354   2HG1  VAL  47          HG11      VAL  47   8.834 -12.221 -12.221
  355   3HG1  VAL  47          HG13      VAL  47   7.309 -11.503 -11.503
  356   1HG2  VAL  47          HG22      VAL  47   8.038 -11.054 -11.054
  357   2HG2  VAL  47          HG21      VAL  47   6.539 -11.083 -11.083
  358   3HG2  VAL  47          HG23      VAL  47   7.742 -12.353 -12.353
  359    H    CYS  48           HN       CYS  48   8.797  -8.210  -8.210
  360    HA   CYS  48           HA       CYS  48  11.451  -7.768  -7.768
  361   1HB   CYS  48           HB2      CYS  48   8.654  -7.942  -7.942
  362   2HB   CYS  48           HB1      CYS  48  10.085  -7.485  -7.485
  363    H    ALA  49           HN       ALA  49  11.889  -5.529  -5.529
  364    HA   ALA  49           HA       ALA  49   9.787  -3.528  -3.528
  365   1HB   ALA  49           HB3      ALA  49  11.410  -4.515  -4.515
  366   2HB   ALA  49           HB2      ALA  49  12.253  -3.042  -3.042
  367   3HB   ALA  49           HB1      ALA  49  10.573  -2.963  -2.963
  368    H    ALA  50           HN       ALA  50  10.071  -1.681  -1.681
  369    HA   ALA  50           HA       ALA  50  12.627  -0.562  -0.562
  370   1HB   ALA  50           HB3      ALA  50  11.634  -2.743  -2.743
  371   2HB   ALA  50           HB2      ALA  50  11.453  -1.292  -1.292
  372   3HB   ALA  50           HB1      ALA  50  13.036  -1.733  -1.733
  373    H    THR  51           HN       THR  51  12.304   1.540   1.540
  374    HA   THR  51           HA       THR  51   9.494   2.521   2.521
  375    HB   THR  51           HB       THR  51  11.969   4.159   4.159
  376    HG1  THR  51           HG1      THR  51  12.627   3.944   3.944
  377   1HG2  THR  51          HG23      THR  51   9.289   4.790   4.790
  378   2HG2  THR  51          HG22      THR  51   9.964   5.142   5.142
  379   3HG2  THR  51          HG21      THR  51  10.637   5.916   5.916
  380    H    TYR  52           HN       TYR  52   8.340   2.533   2.533
  381    HA   TYR  52           HA       TYR  52   9.674   2.164   2.164
  382   1HB   TYR  52           HB2      TYR  52   7.363   1.337   1.337
  383   2HB   TYR  52           HB1      TYR  52   6.810   2.986   2.986
  384    HD1  TYR  52           HD2      TYR  52   6.942   4.002   4.002
  385    HD2  TYR  52           HD1      TYR  52   7.875  -0.157  -0.157
  386    HE1  TYR  52           HE2      TYR  52   6.755   3.463   3.463
  387    HE2  TYR  52           HE1      TYR  52   7.696  -0.683  -0.683
  388    HH   TYR  52           HH       TYR  52   6.386   1.582   1.582
  389    H    MET  53           HN       MET  53  10.655   3.841   3.841
  390    HA   MET  53           HA       MET  53   9.871   6.638   6.638
  391   1HB   MET  53           HB2      MET  53  11.796   5.467   5.467
  392   2HB   MET  53           HB1      MET  53  11.764   7.128   7.128
  393   1HG   MET  53           HG2      MET  53  12.006   5.270   5.270
  394   2HG   MET  53           HG1      MET  53  13.305   5.034   5.034
  395   1HE   MET  53           HE1      MET  53  11.123   8.047   8.047
  396   2HE   MET  53           HE3      MET  53  11.593   7.294   7.294
  397   3HE   MET  53           HE2      MET  53  12.167   8.913   8.913
  398    H    MET  54           HN       MET  54   9.393   7.964   7.964
  399    HA   MET  54           HA       MET  54   7.154   6.742   6.742
  400   1HB   MET  54           HB2      MET  54   8.862   9.162   9.162
  401   2HB   MET  54           HB1      MET  54   7.312   8.798   8.798
  402   1HG   MET  54           HG2      MET  54   7.804   9.329   9.329
  403   2HG   MET  54           HG1      MET  54   6.930  10.366  10.366
  404   1HE   MET  54           HE2      MET  54   7.269   7.705   7.705
  405   2HE   MET  54           HE1      MET  54   5.629   7.337   7.337
  406   3HE   MET  54           HE3      MET  54   6.407   6.343   6.343
  407    H    GLY  55           HN       GLY  55  10.611   6.835   6.835
  408   1HA   GLY  55           HA2      GLY  55   9.977   5.011   5.011
  409   2HA   GLY  55           HA1      GLY  55  10.857   6.483   6.483
  410    H    ASN  56           HN       ASN  56  11.272   4.253   4.253
  411    HA   ASN  56           HA       ASN  56  14.005   3.627   3.627
  412   1HB   ASN  56           HB2      ASN  56  13.269   4.359   4.359
  413   2HB   ASN  56           HB1      ASN  56  14.872   3.902   3.902
  414   1HD2  ASN  56          HD22      ASN  56  14.482   7.677   7.677
  415   2HD2  ASN  56          HD21      ASN  56  14.178   6.518   6.518
  416    H    GLU  57           HN       GLU  57  14.912   1.608   1.608
  417    HA   GLU  57           HA       GLU  57  12.738  -0.354  -0.354
  418   1HB   GLU  57           HB2      GLU  57  14.198  -0.669  -0.669
  419   2HB   GLU  57           HB1      GLU  57  15.603  -0.730  -0.730
  420   1HG   GLU  57           HG2      GLU  57  14.710  -2.706  -2.706
  421   2HG   GLU  57           HG1      GLU  57  13.238  -2.621  -2.621
  422    H    LEU  58           HN       LEU  58  12.617  -1.112  -1.112
  423    HA   LEU  58           HA       LEU  58  14.822  -0.517  -0.517
  424   1HB   LEU  58           HB2      LEU  58  11.931  -1.381  -1.381
  425   2HB   LEU  58           HB1      LEU  58  12.994  -1.256  -1.256
  426    HG   LEU  58           HG       LEU  58  11.708   0.777   0.777
  427   1HD1  LEU  58          HD13      LEU  58  14.208   0.843   0.843
  428   2HD1  LEU  58          HD12      LEU  58  14.448   1.481   1.481
  429   3HD1  LEU  58          HD11      LEU  58  13.458   2.370   2.370
  430   1HD2  LEU  58          HD22      LEU  58  11.394   0.475   0.475
  431   2HD2  LEU  58          HD21      LEU  58  11.559   2.120   2.120
  432   3HD2  LEU  58          HD23      LEU  58  12.932   1.324   1.324
  433    H    THR  59           HN       THR  59  15.983  -2.143  -2.143
  434    HA   THR  59           HA       THR  59  15.590  -4.922  -4.922
  435    HB   THR  59           HB       THR  59  17.890  -5.118  -5.118
  436    HG1  THR  59           HG1      THR  59  17.882  -2.361  -2.361
  437   1HG2  THR  59          HG21      THR  59  17.329  -4.188  -4.188
  438   2HG2  THR  59          HG23      THR  59  17.722  -2.607  -2.607
  439   3HG2  THR  59          HG22      THR  59  18.952  -3.869  -3.869
  440    H    PHE  60           HN       PHE  60  15.179  -6.590  -6.590
  441    HA   PHE  60           HA       PHE  60  14.469  -5.781  -5.781
  442   1HB   PHE  60           HB2      PHE  60  13.737  -8.114  -8.114
  443   2HB   PHE  60           HB1      PHE  60  13.199  -7.961  -7.961
  444    HD1  PHE  60           HD2      PHE  60  12.909  -6.567  -6.567
  445    HD2  PHE  60           HD1      PHE  60  11.612  -6.221  -6.221
  446    HE1  PHE  60           HE2      PHE  60  11.055  -5.040  -5.040
  447    HE2  PHE  60           HE1      PHE  60   9.762  -4.697  -4.697
  448    HZ   PHE  60           HZ       PHE  60   9.476  -4.111  -4.111
  449    H    LEU  61           HN       LEU  61  15.685  -6.588  -6.588
  450    HA   LEU  61           HA       LEU  61  18.244  -7.737  -7.737
  451   1HB   LEU  61           HB2      LEU  61  17.454  -6.449  -6.449
  452   2HB   LEU  61           HB1      LEU  61  16.443  -7.814  -7.814
  453    HG   LEU  61           HG       LEU  61  18.488  -9.236  -9.236
  454   1HD1  LEU  61          HD11      LEU  61  19.820  -6.603  -6.603
  455   2HD1  LEU  61          HD13      LEU  61  20.685  -7.938  -7.938
  456   3HD1  LEU  61          HD12      LEU  61  19.981  -8.142  -8.142
  457   1HD2  LEU  61          HD21      LEU  61  17.534  -7.930  -7.930
  458   2HD2  LEU  61          HD23      LEU  61  19.242  -8.347  -8.347
  459   3HD2  LEU  61          HD22      LEU  61  18.770  -6.710  -6.710
  460    H    ASP  62           HN       ASP  62  15.206  -9.424  -9.424
  461    HA   ASP  62           HA       ASP  62  16.154 -11.934 -11.934
  462   1HB   ASP  62           HB2      ASP  62  16.492 -13.091 -13.091
  463   2HB   ASP  62           HB1      ASP  62  17.543 -11.686 -11.686
  464    H    ASP  63           HN       ASP  63  14.616 -13.569 -13.569
  465    HA   ASP  63           HA       ASP  63  12.439 -14.375 -14.375
  466   1HB   ASP  63           HB2      ASP  63  11.996 -11.381 -11.381
  467   2HB   ASP  63           HB1      ASP  63  10.717 -12.530 -12.530
  468    H    SER  64           HN       SER  64  13.300 -14.776 -14.776
  469    HA   SER  64           HA       SER  64  12.576 -15.326 -15.326
  470   1HB   SER  64           HB2      SER  64  10.313 -15.780 -15.780
  471   2HB   SER  64           HB1      SER  64  10.445 -15.652 -15.652
  472    HG   SER  64           HG       SER  64   8.857 -14.272 -14.272
  473    H    ILE  67           HN       ILE  67  13.044 -12.277 -12.277
  474    HA   ILE  67           HA       ILE  67  13.096 -10.170 -10.170
  475    HB   ILE  67           HB       ILE  67  13.343 -12.140 -12.140
  476   1HG1  ILE  67          HG12      ILE  67  15.416 -10.652 -10.652
  477   2HG1  ILE  67          HG11      ILE  67  14.953 -12.334 -12.334
  478   1HG2  ILE  67          HG22      ILE  67  13.638  -9.156  -9.156
  479   2HG2  ILE  67          HG21      ILE  67  14.762 -10.060 -10.060
  480   3HG2  ILE  67          HG23      ILE  67  13.029 -10.152 -10.152
  481   1HD1  ILE  67          HD12      ILE  67  15.496 -12.616 -12.616
  482   2HD1  ILE  67          HD11      ILE  67  16.402 -11.119 -11.119
  483   3HD1  ILE  67          HD13      ILE  67  16.827 -12.543 -12.543
  484    H    CYS  68           HN       CYS  68  10.608 -10.151 -10.151
  485    HA   CYS  68           HA       CYS  68   8.541 -10.617 -10.617
  486   1HB   CYS  68           HB2      CYS  68   8.621  -8.382  -8.382
  487   2HB   CYS  68           HB1      CYS  68   7.216  -9.297  -9.297
  488    H    THR  69           HN       THR  69   7.928  -9.438  -9.438
  489    HA   THR  69           HA       THR  69   9.587  -7.156  -7.156
  490    HB   THR  69           HB       THR  69   8.797  -8.887  -8.887
  491    HG1  THR  69           HG1      THR  69   9.054  -7.086  -7.086
  492   1HG2  THR  69          HG21      THR  69   6.390  -8.657  -8.657
  493   2HG2  THR  69          HG23      THR  69   6.039  -7.988  -7.988
  494   3HG2  THR  69          HG22      THR  69   6.672  -9.627  -9.627
  495    H    GLY  70           HN       GLY  70   9.083  -5.031  -5.031
  496   1HA   GLY  70           HA2      GLY  70   6.383  -4.452  -4.452
  497   2HA   GLY  70           HA1      GLY  70   7.824  -3.488  -3.488
  498    H    THR  71           HN       THR  71   5.051  -3.787  -3.787
  499    HA   THR  71           HA       THR  71   6.090  -1.798  -1.798
  500    HB   THR  71           HB       THR  71   3.599  -3.414  -3.414
  501    HG1  THR  71           HG1      THR  71   4.930  -4.948  -4.948
  502   1HG2  THR  71          HG21      THR  71   4.553  -1.437  -1.437
  503   2HG2  THR  71          HG23      THR  71   5.424  -2.789  -2.789
  504   3HG2  THR  71          HG22      THR  71   3.661  -2.800  -2.800
  505    H    SER  72           HN       SER  72   4.783   0.058   0.058
  506    HA   SER  72           HA       SER  72   2.349   0.409   0.409
  507   1HB   SER  72           HB2      SER  72   4.878   2.056   2.056
  508   2HB   SER  72           HB1      SER  72   3.343   2.486   2.486
  509    HG   SER  72           HG       SER  72   4.400   1.331   1.331
  510    H    SER  73           HN       SER  73   0.873   1.602   1.602
  511    HA   SER  73           HA       SER  73   1.835   3.550   3.550
  512   1HB   SER  73           HB2      SER  73   0.250   2.561   2.561
  513   2HB   SER  73           HB1      SER  73   1.369   1.326   1.326
  514    HG   SER  73           HG       SER  73  -0.372   0.298   0.298
  515    H    GLY  74           HN       GLY  74   0.545   5.407   5.407
  516   1HA   GLY  74           HA2      GLY  74  -1.092   6.930   6.930
  517   2HA   GLY  74           HA1      GLY  74  -2.207   5.563   5.563
  518    H    ASN  75           HN       ASN  75  -3.200   5.304   5.304
  519    HA   ASN  75           HA       ASN  75  -1.688   5.937   5.937
  520   1HB   ASN  75           HB2      ASN  75  -4.645   5.772   5.772
  521   2HB   ASN  75           HB1      ASN  75  -4.004   6.138   6.138
  522   1HD2  ASN  75          HD22      ASN  75  -4.441   9.156   9.156
  523   2HD2  ASN  75          HD21      ASN  75  -5.272   7.679   7.679
  524    H    GLN  76           HN       GLN  76  -1.962   3.281   3.281
  525    HA   GLN  76           HA       GLN  76  -2.748   1.521   1.521
  526   1HB   GLN  76           HB2      GLN  76  -3.089   1.277   1.277
  527   2HB   GLN  76           HB1      GLN  76  -3.319  -0.088  -0.088
  528   1HG   GLN  76           HG2      GLN  76  -5.056   1.116   1.116
  529   2HG   GLN  76           HG1      GLN  76  -4.789   2.552   2.552
  530   1HE2  GLN  76          HE22      GLN  76  -6.498  -0.715  -0.715
  531   2HE2  GLN  76          HE21      GLN  76  -5.353  -0.971  -0.971
  532    H    VAL  77           HN       VAL  77  -1.115   0.200   0.200
  533    HA   VAL  77           HA       VAL  77   1.338  -0.044  -0.044
  534    HB   VAL  77           HB       VAL  77   2.447  -0.413  -0.413
  535   1HG1  VAL  77          HG11      VAL  77   1.000   1.866   1.866
  536   2HG1  VAL  77          HG13      VAL  77   0.470   1.344   1.344
  537   3HG1  VAL  77          HG12      VAL  77   2.185   1.612   1.612
  538   1HG2  VAL  77          HG23      VAL  77  -0.198  -1.347  -1.347
  539   2HG2  VAL  77          HG22      VAL  77   1.402  -2.044  -2.044
  540   3HG2  VAL  77          HG21      VAL  77   0.894  -0.623  -0.623
  541    H    ASN  78           HN       ASN  78   1.770  -2.004  -2.004
  542    HA   ASN  78           HA       ASN  78   0.035  -4.327  -4.327
  543   1HB   ASN  78           HB2      ASN  78   0.012  -3.277  -3.277
  544   2HB   ASN  78           HB1      ASN  78   1.679  -3.816  -3.816
  545    HD2  ASN  78          HD22      ASN  78  -0.745  -5.265  -5.265
  546    H    LEU  79           HN       LEU  79   1.039  -5.853  -5.853
  547    HA   LEU  79           HA       LEU  79   3.993  -6.287  -6.287
  548   1HB   LEU  79           HB2      LEU  79   2.048  -6.727  -6.727
  549   2HB   LEU  79           HB1      LEU  79   3.710  -7.307  -7.307
  550    HG   LEU  79           HG       LEU  79   2.958  -4.397  -4.397
  551   1HD1  LEU  79          HD11      LEU  79   3.228  -6.029  -6.029
  552   2HD1  LEU  79          HD13      LEU  79   4.120  -4.507  -4.507
  553   3HD1  LEU  79          HD12      LEU  79   2.377  -4.506  -4.506
  554   1HD2  LEU  79          HD21      LEU  79   5.321  -5.710  -5.710
  555   2HD2  LEU  79          HD23      LEU  79   5.199  -3.993  -3.993
  556   3HD2  LEU  79          HD22      LEU  79   5.598  -5.154  -5.154
  557    H    THR  80           HN       THR  80   4.584  -8.280  -8.280
  558    HA   THR  80           HA       THR  80   2.544 -10.489 -10.489
  559    HB   THR  80           HB       THR  80   4.548  -9.752  -9.752
  560    HG1  THR  80           HG1      THR  80   3.061  -8.462  -8.462
  561   1HG2  THR  80          HG23      THR  80   2.669 -12.005 -12.005
  562   2HG2  THR  80          HG22      THR  80   2.717 -11.325 -11.325
  563   3HG2  THR  80          HG21      THR  80   4.190 -11.960 -11.960
  564    H    ILE  81           HN       ILE  81   3.300 -12.490 -12.490
  565    HA   ILE  81           HA       ILE  81   6.208 -12.733 -12.733
  566    HB   ILE  81           HB       ILE  81   3.694 -14.056 -14.056
  567   1HG1  ILE  81          HG12      ILE  81   5.607 -12.247 -12.247
  568   2HG1  ILE  81          HG11      ILE  81   4.236 -11.600 -11.600
  569   1HG2  ILE  81          HG23      ILE  81   5.653 -15.582 -15.582
  570   2HG2  ILE  81          HG22      ILE  81   6.578 -14.340 -14.340
  571   3HG2  ILE  81          HG21      ILE  81   5.175 -15.077 -15.077
  572   1HD1  ILE  81          HD11      ILE  81   2.919 -13.490 -13.490
  573   2HD1  ILE  81          HD13      ILE  81   4.252 -13.267 -13.267
  574   3HD1  ILE  81          HD12      ILE  81   3.220 -11.902 -11.902
  575    H    GLN  82           HN       GLN  82   7.335 -14.505 -14.505
  576    HA   GLN  82           HA       GLN  82   5.741 -16.486 -16.486
  577   1HB   GLN  82           HB2      GLN  82   8.450 -15.262 -15.262
  578   2HB   GLN  82           HB1      GLN  82   7.687 -16.545 -16.545
  579   1HG   GLN  82           HG2      GLN  82   5.808 -15.093 -15.093
  580   2HG   GLN  82           HG1      GLN  82   6.469 -13.813 -13.813
  581   1HE2  GLN  82          HE22      GLN  82   8.590 -12.604 -12.604
  582   2HE2  GLN  82          HE21      GLN  82   7.883 -12.361 -12.361
  583    H    GLY  83           HN       GLY  83   5.958 -18.457 -18.457
  584   1HA   GLY  83           HA2      GLY  83   7.493 -20.360 -20.360
  585   2HA   GLY  83           HA1      GLY  83   8.541 -19.218 -19.218
  586    H    LEU  84           HN       LEU  84   5.010 -19.384 -19.384
  587    HA   LEU  84           HA       LEU  84   5.304 -19.672 -19.672
  588   1HB   LEU  84           HB2      LEU  84   3.033 -19.088 -19.088
  589   2HB   LEU  84           HB1      LEU  84   2.807 -19.227 -19.227
  590    HG   LEU  84           HG       LEU  84   4.829 -17.356 -17.356
  591   1HD1  LEU  84          HD13      LEU  84   1.919 -16.950 -16.950
  592   2HD1  LEU  84          HD12      LEU  84   3.057 -15.603 -15.603
  593   3HD1  LEU  84          HD11      LEU  84   2.750 -16.552 -16.552
  594   1HD2  LEU  84          HD22      LEU  84   3.876 -18.036 -18.036
  595   2HD2  LEU  84          HD21      LEU  84   5.447 -17.432 -17.432
  596   3HD2  LEU  84          HD23      LEU  84   4.095 -16.317 -16.317
  597    H    ARG  85           HN       ARG  85   5.219 -21.658 -21.658
  598    HA   ARG  85           HA       ARG  85   3.944 -23.921 -23.921
  599   1HB   ARG  85           HB2      ARG  85   5.759 -23.690 -23.690
  600   2HB   ARG  85           HB1      ARG  85   5.153 -25.222 -25.222
  601   1HG   ARG  85           HG2      ARG  85   6.509 -23.311 -23.311
  602   2HG   ARG  85           HG1      ARG  85   7.496 -24.315 -24.315
  603   1HD   ARG  85           HD2      ARG  85   6.314 -26.340 -26.340
  604   2HD   ARG  85           HD1      ARG  85   5.439 -25.299 -25.299
  605    HE   ARG  85           HE       ARG  85   8.278 -26.013 -26.013
  606   1HH1  ARG  85          HH21      ARG  85   5.835 -23.669 -23.669
  607   2HH1  ARG  85          HH22      ARG  85   6.727 -23.114 -23.114
  608   1HH2  ARG  85          HH11      ARG  85   9.396 -25.259 -25.259
  609   2HH2  ARG  85          HH12      ARG  85   8.720 -24.001 -24.001
  610    H    ALA  86           HN       ALA  86   2.811 -25.500 -25.500
  611    HA   ALA  86           HA       ALA  86   0.486 -24.208 -24.208
  612   1HB   ALA  86           HB3      ALA  86   1.852 -26.869 -26.869
  613   2HB   ALA  86           HB2      ALA  86   0.356 -26.471 -26.471
  614   3HB   ALA  86           HB1      ALA  86   0.385 -26.529 -26.529
  615    H    MET  87           HN       MET  87   3.529 -25.177 -25.177
  616    HA   MET  87           HA       MET  87   2.807 -24.506 -24.506
  617   1HB   MET  87           HB2      MET  87   4.671 -25.992 -25.992
  618   2HB   MET  87           HB1      MET  87   5.509 -24.583 -24.583
  619   1HG   MET  87           HG2      MET  87   6.429 -24.959 -24.959
  620   2HG   MET  87           HG1      MET  87   5.356 -23.567 -23.567
  621   1HE   MET  87           HE2      MET  87   6.266 -24.468 -24.468
  622   2HE   MET  87           HE1      MET  87   4.716 -24.034 -24.034
  623   3HE   MET  87           HE3      MET  87   5.424 -25.625 -25.625
  624    H    ASP  88           HN       ASP  88   4.226 -22.671 -22.671
  625    HA   ASP  88           HA       ASP  88   5.027 -20.353 -20.353
  626   1HB   ASP  88           HB2      ASP  88   4.280 -20.779 -20.779
  627   2HB   ASP  88           HB1      ASP  88   5.065 -19.325 -19.325
  628    H    THR  89           HN       THR  89   1.882 -21.431 -21.431
  629    HA   THR  89           HA       THR  89   0.409 -19.137 -19.137
  630    HB   THR  89           HB       THR  89  -0.389 -21.403 -21.403
  631    HG1  THR  89           HG1      THR  89  -0.474 -22.629 -22.629
  632   1HG2  THR  89          HG22      THR  89  -1.849 -19.262 -19.262
  633   2HG2  THR  89          HG21      THR  89  -2.153 -20.144 -20.144
  634   3HG2  THR  89          HG23      THR  89  -2.576 -20.868 -20.868
  635    H    GLY  90           HN       GLY  90  -0.238 -17.415 -17.415
  636   1HA   GLY  90           HA2      GLY  90  -0.594 -17.439 -17.439
  637   2HA   GLY  90           HA1      GLY  90   1.025 -16.842 -16.842
  638    H    LEU  91           HN       LEU  91   0.278 -14.803 -14.803
  639    HA   LEU  91           HA       LEU  91  -1.566 -13.215 -13.215
  640   1HB   LEU  91           HB2      LEU  91  -2.134 -13.563 -13.563
  641   2HB   LEU  91           HB1      LEU  91  -0.597 -12.830 -12.830
  642    HG   LEU  91           HG       LEU  91  -1.384 -10.801 -10.801
  643   1HD1  LEU  91          HD12      LEU  91  -3.333 -12.259 -12.259
  644   2HD1  LEU  91          HD11      LEU  91  -4.109 -11.890 -11.890
  645   3HD1  LEU  91          HD13      LEU  91  -3.670 -10.583 -10.583
  646   1HD2  LEU  91          HD23      LEU  91  -1.357 -11.208 -11.208
  647   2HD2  LEU  91          HD22      LEU  91  -2.164  -9.790  -9.790
  648   3HD2  LEU  91          HD21      LEU  91  -3.111 -11.201 -11.201
  649    H    TYR  92           HN       TYR  92  -0.713 -11.599 -11.599
  650    HA   TYR  92           HA       TYR  92   2.037 -10.616 -10.616
  651   1HB   TYR  92           HB2      TYR  92   0.420 -10.836 -10.836
  652   2HB   TYR  92           HB1      TYR  92   1.939  -9.939  -9.939
  653    HD1  TYR  92           HD1      TYR  92   0.408 -13.316 -13.316
  654    HD2  TYR  92           HD2      TYR  92   4.051 -11.051 -11.051
  655    HE1  TYR  92           HE1      TYR  92   1.700 -15.448 -15.448
  656    HE2  TYR  92           HE2      TYR  92   5.343 -13.180 -13.180
  657    HH   TYR  92           HH       TYR  92   4.878 -15.571 -15.571
  658    H    ILE  93           HN       ILE  93   2.298  -8.393  -8.393
  659    HA   ILE  93           HA       ILE  93  -0.222  -6.767  -6.767
  660    HB   ILE  93           HB       ILE  93   2.396  -6.613  -6.613
  661   1HG1  ILE  93          HG12      ILE  93   0.774  -7.149  -7.149
  662   2HG1  ILE  93          HG11      ILE  93  -0.329  -7.702  -7.702
  663   1HG2  ILE  93          HG21      ILE  93   0.473  -4.581  -4.581
  664   2HG2  ILE  93          HG23      ILE  93   0.186  -5.178  -5.178
  665   3HG2  ILE  93          HG22      ILE  93   1.781  -4.583  -4.583
  666   1HD1  ILE  93          HD13      ILE  93   2.478  -8.698  -8.698
  667   2HD1  ILE  93          HD12      ILE  93   1.441  -9.344  -9.344
  668   3HD1  ILE  93          HD11      ILE  93   0.983  -9.524  -9.524
  669    H    CYS  94           HN       CYS  94  -0.294  -4.934  -4.934
  670    HA   CYS  94           HA       CYS  94   2.123  -4.129  -4.129
  671   1HB   CYS  94           HB2      CYS  94   0.576  -2.534  -2.534
  672   2HB   CYS  94           HB1      CYS  94  -0.190  -4.117  -4.117
  673    H    LYS  95           HN       LYS  95   3.235  -2.147  -2.147
  674    HA   LYS  95           HA       LYS  95   2.460  -0.668  -0.668
  675   1HB   LYS  95           HB2      LYS  95   3.999  -2.525  -2.525
  676   2HB   LYS  95           HB1      LYS  95   5.119  -1.928  -1.928
  677   1HG   LYS  95           HG2      LYS  95   6.028  -0.507  -0.507
  678   2HG   LYS  95           HG1      LYS  95   4.457   0.253   0.253
  679   1HD   LYS  95           HD2      LYS  95   3.893  -1.643  -1.643
  680   2HD   LYS  95           HD1      LYS  95   5.576  -2.162  -2.162
  681   1HE   LYS  95           HE2      LYS  95   6.352  -0.016  -0.016
  682   2HE   LYS  95           HE1      LYS  95   4.683   0.586   0.586
  683   1HZ   LYS  95           HZ3      LYS  95   5.685  -1.835  -1.835
  684   2HZ   LYS  95           HZ2      LYS  95   5.371  -0.336  -0.336
  685   3HZ   LYS  95           HZ1      LYS  95   4.099  -1.236  -1.236
  686    H    VAL  96           HN       VAL  96   1.901   0.843   0.843
  687    HA   VAL  96           HA       VAL  96   4.228   2.029   2.029
  688    HB   VAL  96           HB       VAL  96   2.364   1.373   1.373
  689   1HG1  VAL  96          HG11      VAL  96   0.686   2.883   2.883
  690   2HG1  VAL  96          HG13      VAL  96   0.109   2.533   2.533
  691   3HG1  VAL  96          HG12      VAL  96   0.532   1.211   1.211
  692   1HG2  VAL  96          HG23      VAL  96   2.904   4.275   4.275
  693   2HG2  VAL  96          HG22      VAL  96   3.076   3.264   3.264
  694   3HG2  VAL  96          HG21      VAL  96   1.486   3.859   3.859
  695    H    GLU  97           HN       GLU  97   5.219   3.631   3.631
  696    HA   GLU  97           HA       GLU  97   3.534   5.611   5.611
  697   1HB   GLU  97           HB2      GLU  97   6.252   4.441   4.441
  698   2HB   GLU  97           HB1      GLU  97   5.502   5.749   5.749
  699   1HG   GLU  97           HG2      GLU  97   3.490   4.128   4.128
  700   2HG   GLU  97           HG1      GLU  97   4.606   2.872   2.872
  701    H    LEU  98           HN       LEU  98   3.846   7.689   7.689
  702    HA   LEU  98           HA       LEU  98   5.936   8.282   8.282
  703   1HB   LEU  98           HB2      LEU  98   4.046  10.086  10.086
  704   2HB   LEU  98           HB1      LEU  98   4.872  10.503  10.503
  705    HG   LEU  98           HG       LEU  98   2.854   8.258   8.258
  706   1HD1  LEU  98          HD11      LEU  98   2.600  11.086  11.086
  707   2HD1  LEU  98          HD13      LEU  98   1.451   9.813   9.813
  708   3HD1  LEU  98          HD12      LEU  98   1.662  10.295  10.295
  709   1HD2  LEU  98          HD21      LEU  98   4.680   9.176   9.176
  710   2HD2  LEU  98          HD23      LEU  98   3.967   7.586   7.586
  711   3HD2  LEU  98          HD22      LEU  98   3.022   8.854   8.854
  712    H    MET  99           HN       MET  99   7.587   7.493   7.493
  713    HA   MET  99           HA       MET  99   7.969   8.868   8.868
  714   1HB   MET  99           HB2      MET  99   8.442   6.477   6.477
  715   2HB   MET  99           HB1      MET  99   9.855   7.059   7.059
  716   1HG   MET  99           HG2      MET  99  10.419   6.329   6.329
  717   2HG   MET  99           HG1      MET  99  10.769   8.037   8.037
  718   1HE   MET  99           HE3      MET  99   7.970   5.686   5.686
  719   2HE   MET  99           HE2      MET  99   8.439   5.529   5.529
  720   3HE   MET  99           HE1      MET  99   6.950   6.372   6.372
  721    H    TYR 100           HN       TYR 100   9.781   8.850   8.850
  722    HA   TYR 100           HA       TYR 100  11.851  10.620  10.620
  723   1HB   TYR 100           HB2      TYR 100  10.857   9.781   9.781
  724   2HB   TYR 100           HB1      TYR 100  12.299  10.766  10.766
  725    HD1  TYR 100           HD2      TYR 100  14.249   9.893   9.893
  726    HD2  TYR 100           HD1      TYR 100  10.811   7.427   7.427
  727    HE1  TYR 100           HE2      TYR 100  15.593   7.849   7.849
  728    HE2  TYR 100           HE1      TYR 100  12.159   5.371   5.371
  729    HH   TYR 100           HH       TYR 100  14.324   4.879   4.879
  730    HA   PRO 101           HA       PRO 101   9.517  14.132  14.132
  731   1HB   PRO 101           HB2      PRO 101   6.968  13.856  13.856
  732   2HB   PRO 101           HB1      PRO 101   8.363  13.421  13.421
  733   1HG   PRO 101           HG2      PRO 101   6.445  11.693  11.693
  734   2HG   PRO 101           HG1      PRO 101   7.392  11.339  11.339
  735   1HD   PRO 101           HD2      PRO 101   7.929  10.480  10.480
  736   2HD   PRO 101           HD1      PRO 101   8.994  10.321  10.321
  737    HA   PRO 102           HA       PRO 102   7.166  14.591  14.591
  738   1HB   PRO 102           HB2      PRO 102   8.216  16.847  16.847
  739   2HB   PRO 102           HB1      PRO 102   9.052  15.268  15.268
  740   1HG   PRO 102           HG2      PRO 102   9.529  17.581  17.581
  741   2HG   PRO 102           HG1      PRO 102  10.712  16.445  16.445
  742   1HD   PRO 102           HD2      PRO 102   9.575  16.353  16.353
  743   2HD   PRO 102           HD1      PRO 102  10.452  15.035  15.035
  744    HA   PRO 103           HA       PRO 103   6.502  15.689  15.689
  745   1HB   PRO 103           HB2      PRO 103   4.552  15.297  15.297
  746   2HB   PRO 103           HB1      PRO 103   5.791  16.576  16.576
  747   1HG   PRO 103           HG2      PRO 103   3.107  16.909  16.909
  748   2HG   PRO 103           HG1      PRO 103   4.358  18.101  18.101
  749   1HD   PRO 103           HD2      PRO 103   3.341  15.798  15.798
  750   2HD   PRO 103           HD1      PRO 103   3.044  17.465  17.465
  751    H    TYR 104           HN       TYR 104   5.615  13.376  13.376
  752    HA   TYR 104           HA       TYR 104   4.750  11.687  11.687
  753   1HB   TYR 104           HB2      TYR 104   6.501  10.862  10.862
  754   2HB   TYR 104           HB1      TYR 104   5.753  11.382  11.382
  755    HD1  TYR 104           HD1      TYR 104   4.220   9.557   9.557
  756    HD2  TYR 104           HD2      TYR 104   5.607   9.288   9.288
  757    HE1  TYR 104           HE1      TYR 104   3.176   7.307   7.307
  758    HE2  TYR 104           HE2      TYR 104   4.555   6.996   6.996
  759    HH   TYR 104           HH       TYR 104   2.570   5.793   5.793
  760    H    TYR 105           HN       TYR 105   2.689  11.103  11.103
  761    HA   TYR 105           HA       TYR 105   0.625  11.075  11.075
  762   1HB   TYR 105           HB2      TYR 105   0.859  13.253  13.253
  763   2HB   TYR 105           HB1      TYR 105   0.405  12.409  12.409
  764    HD1  TYR 105           HD1      TYR 105  -0.710  13.206  13.206
  765    HD2  TYR 105           HD2      TYR 105  -1.861  11.945  11.945
  766    HE1  TYR 105           HE1      TYR 105  -3.120  13.399  13.399
  767    HE2  TYR 105           HE2      TYR 105  -4.282  12.129  12.129
  768    HH   TYR 105           HH       TYR 105  -5.425  13.804  13.804
  769    H    LEU 106           HN       LEU 106   1.216   8.700   8.700
  770    HA   LEU 106           HA       LEU 106  -0.825   7.752   7.752
  771   1HB   LEU 106           HB2      LEU 106   1.856   7.921   7.921
  772   2HB   LEU 106           HB1      LEU 106   1.701   6.247   6.247
  773    HG   LEU 106           HG       LEU 106  -0.284   5.969   5.969
  774   1HD1  LEU 106          HD13      LEU 106   0.248   8.869   8.869
  775   2HD1  LEU 106          HD12      LEU 106  -0.285   7.921   7.921
  776   3HD1  LEU 106          HD11      LEU 106  -1.286   8.002   8.002
  777   1HD2  LEU 106          HD23      LEU 106   2.335   5.828   5.828
  778   2HD2  LEU 106          HD22      LEU 106   1.014   5.394   5.394
  779   3HD2  LEU 106          HD21      LEU 106   1.756   6.990   6.990
  780    H    GLY 108           HN       GLY 108   0.091   4.967   4.967
  781   1HA   GLY 108           HA2      GLY 108   0.287   4.334   4.334
  782   2HA   GLY 108           HA1      GLY 108  -1.356   4.131   4.131
  783    H    ILE 109           HN       ILE 109  -0.741   1.853   1.853
  784    HA   ILE 109           HA       ILE 109   0.689   0.303   0.303
  785    HB   ILE 109           HB       ILE 109   0.221  -0.075  -0.075
  786   1HG1  ILE 109          HG12      ILE 109   2.789  -0.229  -0.229
  787   2HG1  ILE 109          HG11      ILE 109   2.639   0.451   0.451
  788   1HG2  ILE 109          HG22      ILE 109   0.039  -2.248  -2.248
  789   2HG2  ILE 109          HG21      ILE 109   1.689  -1.993  -1.993
  790   3HG2  ILE 109          HG23      ILE 109   1.364  -2.185  -2.185
  791   1HD1  ILE 109          HD11      ILE 109   1.091   1.826   1.826
  792   2HD1  ILE 109          HD13      ILE 109   2.845   1.966   1.966
  793   3HD1  ILE 109          HD12      ILE 109   2.020   2.499   2.499
  794    H    GLY 110           HN       GLY 110  -0.389  -1.650  -1.650
  795   1HA   GLY 110           HA2      GLY 110  -3.314  -1.580  -1.580
  796   2HA   GLY 110           HA1      GLY 110  -2.373  -2.731  -2.731
  797    H    ASN 111           HN       ASN 111  -4.604  -3.245  -3.245
  798    HA   ASN 111           HA       ASN 111  -3.644  -4.299  -4.299
  799   1HB   ASN 111           HB2      ASN 111  -6.028  -3.880  -3.880
  800   2HB   ASN 111           HB1      ASN 111  -5.923  -5.364  -5.364
  801    HD2  ASN 111          HD22      ASN 111  -5.641  -4.323  -4.323
  802    H    GLY 112           HN       GLY 112  -3.905  -5.773  -5.773
  803   1HA   GLY 112           HA2      GLY 112  -2.011  -7.355  -7.355
  804   2HA   GLY 112           HA1      GLY 112  -2.385  -8.140  -8.140
  805    H    THR 113           HN       THR 113  -2.378  -9.207  -9.207
  806    HA   THR 113           HA       THR 113  -5.250 -10.090 -10.090
  807    HB   THR 113           HB       THR 113  -3.019  -9.858  -9.858
  808    HG1  THR 113           HG1      THR 113  -5.408  -8.383  -8.383
  809   1HG2  THR 113          HG22      THR 113  -5.906 -10.736 -10.736
  810   2HG2  THR 113          HG21      THR 113  -4.839 -10.375 -10.375
  811   3HG2  THR 113          HG23      THR 113  -4.468 -11.728 -11.728
  812    H    GLN 114           HN       GLN 114  -5.518 -12.336 -12.336
  813    HA   GLN 114           HA       GLN 114  -3.145 -13.975 -13.975
  814   1HB   GLN 114           HB2      GLN 114  -5.459 -14.124 -14.124
  815   2HB   GLN 114           HB1      GLN 114  -6.028 -14.858 -14.858
  816   1HG   GLN 114           HG2      GLN 114  -5.459 -16.701 -16.701
  817   2HG   GLN 114           HG1      GLN 114  -4.073 -16.513 -16.513
  818   1HE2  GLN 114          HE22      GLN 114  -2.223 -16.663 -16.663
  819   2HE2  GLN 114          HE21      GLN 114  -2.729 -17.564 -17.564
  820    H    ILE 115           HN       ILE 115  -2.053 -15.179 -15.179
  821    HA   ILE 115           HA       ILE 115  -3.288 -15.227 -15.227
  822    HB   ILE 115           HB       ILE 115  -0.469 -15.729 -15.729
  823   1HG1  ILE 115          HG12      ILE 115  -1.635 -13.565 -13.565
  824   2HG1  ILE 115          HG11      ILE 115  -1.282 -13.372 -13.372
  825   1HG2  ILE 115          HG22      ILE 115  -1.553 -15.853 -15.853
  826   2HG2  ILE 115          HG21      ILE 115   0.162 -15.825 -15.825
  827   3HG2  ILE 115          HG23      ILE 115  -0.843 -17.186 -17.186
  828   1HD1  ILE 115          HD13      ILE 115   1.111 -14.283 -14.283
  829   2HD1  ILE 115          HD12      ILE 115   0.588 -13.548 -13.548
  830   3HD1  ILE 115          HD11      ILE 115   0.701 -12.567 -12.567
  831    H    TYR 116           HN       TYR 116  -4.341 -17.069 -17.069
  832    HA   TYR 116           HA       TYR 116  -3.930 -19.580 -19.580
  833   1HB   TYR 116           HB2      TYR 116  -5.981 -18.509 -18.509
  834   2HB   TYR 116           HB1      TYR 116  -5.985 -20.197 -20.197
  835    HD1  TYR 116           HD1      TYR 116  -4.893 -19.105 -19.105
  836    HD2  TYR 116           HD2      TYR 116  -8.351 -18.440 -18.440
  837    HE1  TYR 116           HE1      TYR 116  -6.275 -18.544 -18.544
  838    HE2  TYR 116           HE2      TYR 116  -9.716 -17.909 -17.909
  839    HH   TYR 116           HH       TYR 116  -8.447 -17.162 -17.162
  840    H    VAL 117           HN       VAL 117  -2.902 -21.332 -21.332
  841    HA   VAL 117           HA       VAL 117  -2.084 -21.208 -21.208
  842    HB   VAL 117           HB       VAL 117  -1.201 -22.945 -22.945
  843   1HG1  VAL 117          HG12      VAL 117  -0.264 -22.816 -22.816
  844   2HG1  VAL 117          HG11      VAL 117   0.645 -23.614 -23.614
  845   3HG1  VAL 117          HG13      VAL 117  -0.952 -24.212 -24.212
  846   1HG2  VAL 117          HG23      VAL 117  -0.058 -20.521 -20.521
  847   2HG2  VAL 117          HG22      VAL 117  -0.333 -20.761 -20.761
  848   3HG2  VAL 117          HG21      VAL 117   0.971 -21.624 -21.624
  849    H    ILE 118           HN       ILE 118  -2.246 -23.350 -23.350
  850    HA   ILE 118           HA       ILE 118  -4.898 -24.577 -24.577
  851    HB   ILE 118           HB       ILE 118  -2.992 -24.609 -24.609
  852   1HG1  ILE 118          HG12      ILE 118  -3.799 -22.358 -22.358
  853   2HG1  ILE 118          HG11      ILE 118  -4.622 -23.015 -23.015
  854   1HG2  ILE 118          HG21      ILE 118  -5.787 -25.668 -25.668
  855   2HG2  ILE 118          HG23      ILE 118  -5.173 -25.256 -25.256
  856   3HG2  ILE 118          HG22      ILE 118  -4.377 -26.506 -26.506
  857   1HD1  ILE 118          HD12      ILE 118  -6.273 -23.813 -23.813
  858   2HD1  ILE 118          HD11      ILE 118  -5.714 -22.246 -22.246
  859   3HD1  ILE 118          HD13      ILE 118  -6.521 -22.368 -22.368
  860    H    ASP 119           HN       ASP 119  -4.832 -26.474 -26.474
  861    HA   ASP 119           HA       ASP 119  -2.733 -28.486 -28.486
  862   1HB   ASP 119           HB2      ASP 119  -2.091 -27.165 -27.165
  863   2HB   ASP 119           HB1      ASP 119  -3.598 -27.648 -27.648
  864    HA   PRO 120           HA       PRO 120  -6.585 -30.817 -30.817
  865   1HB   PRO 120           HB2      PRO 120  -5.508 -33.263 -33.263
  866   2HB   PRO 120           HB1      PRO 120  -5.758 -31.990 -31.990
  867   1HG   PRO 120           HG2      PRO 120  -3.266 -32.774 -32.774
  868   2HG   PRO 120           HG1      PRO 120  -3.496 -32.313 -32.313
  869   1HD   PRO 120           HD2      PRO 120  -2.497 -30.615 -30.615
  870   2HD   PRO 120           HD1      PRO 120  -3.444 -30.065 -30.065
  871    H    GLU 121           HN       GLU 121  -7.618 -32.276 -32.276
  872    HA   GLU 121           HA       GLU 121  -5.937 -33.174 -33.174
  873   1HB   GLU 121           HB2      GLU 121  -8.755 -32.050 -32.050
  874   2HB   GLU 121           HB1      GLU 121  -7.990 -32.668 -32.668
  875   1HG   GLU 121           HG2      GLU 121  -6.896 -30.399 -30.399
  876   2HG   GLU 121           HG1      GLU 121  -7.807 -30.189 -30.189
  877    HA   PRO 122           HA       PRO 122  -7.564 -37.187 -37.187
  878   1HB   PRO 122           HB2      PRO 122  -7.328 -38.379 -38.379
  879   2HB   PRO 122           HB1      PRO 122  -5.946 -38.084 -38.084
  880   1HG   PRO 122           HG2      PRO 122  -6.877 -36.512 -36.512
  881   2HG   PRO 122           HG1      PRO 122  -5.230 -36.946 -36.946
  882   1HD   PRO 122           HD2      PRO 122  -6.273 -34.494 -34.494
  883   2HD   PRO 122           HD1      PRO 122  -5.092 -35.245 -35.245
  884    H    CYS 123           HN       CYS 123  -8.963 -35.109 -35.109
  885    HA   CYS 123           HA       CYS 123 -11.501 -36.706 -36.706
  886   1HB   CYS 123           HB2      CYS 123 -10.256 -35.111 -35.111
  887   2HB   CYS 123           HB1      CYS 123 -11.854 -35.853 -35.853
  888    HG   CYS 123           HG       CYS 123 -10.638 -38.208 -38.208
  889    HA   PRO 124           HA       PRO 124 -13.281 -32.971 -32.971
  890   1HB   PRO 124           HB2      PRO 124 -15.886 -33.301 -33.301
  891   2HB   PRO 124           HB1      PRO 124 -15.152 -34.193 -34.193
  892   1HG   PRO 124           HG2      PRO 124 -15.644 -35.071 -35.071
  893   2HG   PRO 124           HG1      PRO 124 -15.844 -35.968 -35.968
  894   1HD   PRO 124           HD2      PRO 124 -13.706 -36.299 -36.299
  895   2HD   PRO 124           HD1      PRO 124 -13.617 -36.512 -36.512
  896    H    ASP 125           HN       ASP 125 -13.193 -33.720 -33.720
  897    HA   ASP 125           HA       ASP 125 -13.540 -30.843 -30.843
  898   1HB   ASP 125           HB2      ASP 125 -15.185 -31.411 -31.411
  899   2HB   ASP 125           HB1      ASP 125 -15.758 -31.943 -31.943
  900    H    SER 126           HN       SER 126 -13.140 -30.664 -30.664
  901    HA   SER 126           HA       SER 126 -10.925 -32.531 -32.531
  902   1HB   SER 126           HB2      SER 126  -9.667 -30.544 -30.544
  903   2HB   SER 126           HB1      SER 126 -10.104 -30.394 -30.394
  904    HG   SER 126           HG       SER 126 -11.173 -28.673 -28.673
  905    H    ASP 127           HN       ASP 127 -10.499 -32.443 -32.443
  906    HA   ASP 127           HA       ASP 127 -13.014 -32.410 -32.410
  907   1HB   ASP 127           HB2      ASP 127 -11.140 -34.107 -34.107
  908   2HB   ASP 127           HB1      ASP 127 -10.160 -32.855 -32.855
  909    H    GLN 128           HN       GLN 128 -13.757 -30.604 -30.604
  910    HA   GLN 128           HA       GLN 128 -11.984 -28.272 -28.272
  911   1HB   GLN 128           HB2      GLN 128 -14.949 -28.787 -28.787
  912   2HB   GLN 128           HB1      GLN 128 -14.177 -27.213 -27.213
  913   1HG   GLN 128           HG2      GLN 128 -14.762 -26.988 -26.988
  914   2HG   GLN 128           HG1      GLN 128 -13.248 -27.857 -27.857
  915   1HE2  GLN 128          HE22      GLN 128 -15.976 -29.638 -29.638
  916   2HE2  GLN 128          HE21      GLN 128 -15.350 -28.060 -28.060
  917    H    GLU 129           HN       GLU 129 -12.247 -27.107 -27.107
  918    HA   GLU 129           HA       GLU 129 -11.869 -27.115 -27.115
  919   1HB   GLU 129           HB2      GLU 129 -13.912 -29.339 -29.339
  920   2HB   GLU 129           HB1      GLU 129 -13.497 -28.584 -28.584
  921   1HG   GLU 129           HG2      GLU 129 -14.562 -27.095 -27.095
  922   2HG   GLU 129           HG1      GLU 129 -15.535 -27.583 -27.583
  923    HA   PRO 130           HA       PRO 130  -9.318 -31.104 -31.104
  924   1HB   PRO 130           HB2      PRO 130  -6.880 -29.984 -29.984
  925   2HB   PRO 130           HB1      PRO 130  -8.023 -30.481 -30.481
  926   1HG   PRO 130           HG2      PRO 130  -7.489 -27.766 -27.766
  927   2HG   PRO 130           HG1      PRO 130  -7.778 -28.265 -28.265
  928   1HD   PRO 130           HD2      PRO 130  -9.687 -27.109 -27.109
  929   2HD   PRO 130           HD1      PRO 130 -10.060 -28.281 -28.281
  930    H    LYS 131           HN       LYS 131  -7.651 -31.741 -31.741
  931    HA   LYS 131           HA       LYS 131  -6.754 -31.717 -31.717
  932   1HB   LYS 131           HB2      LYS 131  -6.414 -28.823 -28.823
  933   2HB   LYS 131           HB1      LYS 131  -5.603 -29.553 -29.553
  934   1HG   LYS 131           HG2      LYS 131  -4.591 -31.246 -31.246
  935   2HG   LYS 131           HG1      LYS 131  -5.331 -30.416 -30.416
  936   1HD   LYS 131           HD2      LYS 131  -4.095 -28.367 -28.367
  937   2HD   LYS 131           HD1      LYS 131  -3.382 -29.156 -29.156
  938   1HE   LYS 131           HE2      LYS 131  -2.241 -30.779 -30.779
  939   2HE   LYS 131           HE1      LYS 131  -3.017 -30.081 -30.081
  940   1HZ   LYS 131           HZ2      LYS 131  -1.316 -28.569 -28.569
  941   2HZ   LYS 131           HZ1      LYS 131  -0.789 -29.146 -29.146
  942   3HZ   LYS 131           HZ3      LYS 131  -2.005 -27.966 -27.966
  943    H1   NAG 132           H1       NAG 132  -3.981  -6.741  -6.741
  944    H2   NAG 132           H2       NAG 132  -4.065  -4.365  -4.365
  945    H3   NAG 132           H3       NAG 132  -1.929  -6.571  -6.571
  946    H4   NAG 132           H4       NAG 132  -4.106  -6.178  -6.178
  947    H5   NAG 132           H5       NAG 132  -3.863  -8.365  -8.365
  948   1H6   NAG 132           H61      NAG 132  -4.714  -9.053  -9.053
  949   2H6   NAG 132           H62      NAG 132  -6.048  -7.878  -7.878
  950   1H8   NAG 132           H81      NAG 132  -0.153  -2.542  -2.542
  951   2H8   NAG 132           H82      NAG 132  -0.462  -3.729  -3.729
  952   3H8   NAG 132           H83      NAG 132  -1.036  -2.044  -2.044
  953    HN2  NAG 132           HN2      NAG 132  -2.344  -4.987  -4.987
  954    HO3  NAG 132           HO3      NAG 132  -1.227  -5.490  -5.490
  955    H1   NAG 133           H1       NAG 133  -3.818  -8.256  -8.256
  956    H2   NAG 133           H2       NAG 133  -0.782  -7.791  -7.791
  957    H3   NAG 133           H3       NAG 133  -2.752  -8.948  -8.948
  958    H4   NAG 133           H4       NAG 133  -1.357  -6.234  -6.234
  959    H5   NAG 133           H5       NAG 133  -4.325  -6.834  -6.834
  960   1H6   NAG 133           H61      NAG 133  -4.001  -4.324  -4.324
  961   2H6   NAG 133           H62      NAG 133  -2.716  -4.370  -4.370
  962   1H8   NAG 133           H81      NAG 133  -2.748 -12.005 -12.005
  963   2H8   NAG 133           H82      NAG 133  -4.269 -11.285 -11.285
  964   3H8   NAG 133           H83      NAG 133  -3.177 -10.326 -10.326
  965    HN2  NAG 133           HN2      NAG 133  -0.702  -9.965  -9.965
  966    HO3  NAG 133           HO3      NAG 133  -0.984  -9.363  -9.363
  967    HO6  NAG 133           HO6      NAG 133  -4.559  -5.468  -5.468
  968    H1   FUC 134           H1       FUC 134  -4.893 -10.764 -10.764
  969    H2   FUC 134           H2       FUC 134  -7.312 -11.896 -11.896
  970    H3   FUC 134           H3       FUC 134  -8.106  -9.293  -9.293
  971    H4   FUC 134           H4       FUC 134  -9.756 -10.712 -10.712
  972    H5   FUC 134           H5       FUC 134  -7.503 -10.236 -10.236
  973   1H6   FUC 134           H61      FUC 134  -9.236 -11.946 -11.946
  974   2H6   FUC 134           H62      FUC 134  -8.148 -13.189 -13.189
  975   3H6   FUC 134           H63      FUC 134  -7.539 -12.067 -12.067
  976    HO2  FUC 134           HO2      FUC 134  -6.331 -10.754 -10.754
  977    HO3  FUC 134           HO3      FUC 134  -9.164  -9.756  -9.756
  978    HO4  FUC 134           HO4      FUC 134  -9.613 -12.846 -12.846
  979    H1   MAN 135           H1       MAN 135  -0.751  -6.208  -6.208
  980    H2   MAN 135           H2       MAN 135  -2.306  -4.263  -4.263
  981    H3   MAN 135           H3       MAN 135  -0.425  -4.039  -4.039
  982    H4   MAN 135           H4       MAN 135  -2.137  -5.348  -5.348
  983    H5   MAN 135           H5       MAN 135   0.297  -6.491  -6.491
  984   1H6   MAN 135           H61      MAN 135  -1.441  -7.449  -7.449
  985   2H6   MAN 135           H62      MAN 135  -0.675  -8.602  -8.602
  986    HO2  MAN 135           HO2      MAN 135  -4.175  -4.381  -4.381
  987    HO3  MAN 135           HO3      MAN 135  -2.862  -3.276  -3.276
  988    HO4  MAN 135           HO4      MAN 135  -0.682  -4.060  -4.060
  989    HO6  MAN 135           HO6      MAN 135   0.641  -6.613  -6.613
  990    H1   NAG 136           H1       NAG 136   1.882  -6.570  -6.570
  991    H2   NAG 136           H2       NAG 136  -0.493  -7.329  -7.329
  992    H3   NAG 136           H3       NAG 136   2.190  -8.757  -8.757
  993    H4   NAG 136           H4       NAG 136   1.292  -7.169  -7.169
  994    H5   NAG 136           H5       NAG 136   3.372  -6.400  -6.400
  995   1H6   NAG 136           H61      NAG 136   3.999  -4.761  -4.761
  996   2H6   NAG 136           H62      NAG 136   3.346  -5.745  -5.745
  997   1H8   NAG 136           H81      NAG 136  -2.542  -7.338  -7.338
  998   2H8   NAG 136           H82      NAG 136  -3.245  -8.883  -8.883
  999   3H8   NAG 136           H83      NAG 136  -2.074  -8.005  -8.005
 1000    HN2  NAG 136           HN2      NAG 136   0.591  -8.604  -8.604
 1001    HO3  NAG 136           HO3      NAG 136   0.699 -10.209 -10.209
 1002    H1   NAG 137           H1       NAG 137   3.955  -8.163  -8.163
 1003    H2   NAG 137           H2       NAG 137   4.442 -10.294 -10.294
 1004    H3   NAG 137           H3       NAG 137   5.609 -10.175 -10.175
 1005    H4   NAG 137           H4       NAG 137   7.030  -9.764  -9.764
 1006    H5   NAG 137           H5       NAG 137   6.387  -7.650  -7.650
 1007   1H6   NAG 137           H61      NAG 137   8.503  -7.362  -7.362
 1008   2H6   NAG 137           H62      NAG 137   7.294  -6.081  -6.081
 1009   1H8   NAG 137           H81      NAG 137   1.396 -13.262 -13.262
 1010   2H8   NAG 137           H82      NAG 137   3.038 -13.624 -13.624
 1011   3H8   NAG 137           H83      NAG 137   2.832 -12.948 -12.948
 1012    HN2  NAG 137           HN2      NAG 137   3.100 -10.511 -10.511
 1013    HO3  NAG 137           HO3      NAG 137   6.776 -11.957 -11.957
 1014    HO6  NAG 137           HO6      NAG 137   7.644  -8.258  -8.258
 1015    H1   FUC 138           H1       FUC 138   1.809  -4.734  -4.734
 1016    H2   FUC 138           H2       FUC 138   1.232  -1.940  -1.940
 1017    H3   FUC 138           H3       FUC 138   1.090  -2.035  -2.035
 1018    H4   FUC 138           H4       FUC 138   3.099  -0.363  -0.363
 1019    H5   FUC 138           H5       FUC 138   3.940  -2.849  -2.849
 1020   1H6   FUC 138           H61      FUC 138   5.859  -2.628  -2.628
 1021   2H6   FUC 138           H62      FUC 138   5.135  -1.163  -1.163
 1022   3H6   FUC 138           H63      FUC 138   5.642  -1.147  -1.147
 1023    HO2  FUC 138           HO2      FUC 138  -0.325  -3.501  -3.501
 1024    HO3  FUC 138           HO3      FUC 138   0.630  -0.105  -0.105
 1025    HO4  FUC 138           HO4      FUC 138   2.999  -0.856  -0.856
 1026    H1   MAN 139           H1       MAN 139   8.523 -11.243 -11.243
 1027    H2   MAN 139           H2       MAN 139   9.303  -9.134  -9.134
 1028    H3   MAN 139           H3       MAN 139  10.628 -11.087 -11.087
 1029    H4   MAN 139           H4       MAN 139  12.343 -10.411 -10.411
 1030    H5   MAN 139           H5       MAN 139  10.368 -12.737 -12.737
 1031   1H6   MAN 139           H61      MAN 139  10.780 -13.115 -13.115
 1032   2H6   MAN 139           H62      MAN 139  12.229 -13.359 -13.359
 1033    HO2  MAN 139           HO2      MAN 139   9.889  -8.333  -8.333
 1034    HO3  MAN 139           HO3      MAN 139  12.463  -9.990  -9.990
 1035    HO4  MAN 139           HO4      MAN 139  13.620 -11.595 -11.595
 1036    HO6  MAN 139           HO6      MAN 139  12.973 -11.304 -11.304

  Start of MODEL   10
    1   1H    ALA   1           HT2      ALA   1 -10.156  11.163  11.163
    2   2H    ALA   1           HT1      ALA   1 -11.292  10.049  10.049
    3   3H    ALA   1           HT3      ALA   1 -11.615  11.712  11.712
    4    HA   ALA   1           HA       ALA   1  -9.846  12.039  12.039
    5   1HB   ALA   1           HB1      ALA   1 -12.289  11.034  11.034
    6   2HB   ALA   1           HB3      ALA   1 -11.363   9.647   9.647
    7   3HB   ALA   1           HB2      ALA   1 -11.157  11.222  11.222
    8    H    MET   1           HN       MET   1  -9.038  10.151  10.151
    9    HA   MET   1           HA       MET   1  -6.921   8.706   8.706
   10   1HB   MET   1           HB2      MET   1  -7.416   9.303   9.303
   11   2HB   MET   1           HB1      MET   1  -5.977   8.491   8.491
   12   1HG   MET   1           HG2      MET   1  -5.412  10.447  10.447
   13   2HG   MET   1           HG1      MET   1  -6.895  11.256  11.256
   14   1HE   MET   1           HE1      MET   1  -5.511  13.095  13.095
   15   2HE   MET   1           HE3      MET   1  -4.753  13.530  13.530
   16   3HE   MET   1           HE2      MET   1  -3.817  12.709  12.709
   17    H    HIS   2           HN       HIS   2  -8.017   6.853   6.853
   18    HA   HIS   2           HA       HIS   2  -9.297   5.055   5.055
   19   1HB   HIS   2           HB2      HIS   2  -9.459   5.268   5.268
   20   2HB   HIS   2           HB1      HIS   2 -10.327   4.066   4.066
   21    HD1  HIS   2           HD1      HIS   2 -12.109   5.031   5.031
   22    HD2  HIS   2           HD2      HIS   2 -10.665   7.789   7.789
   23    HE1  HIS   2           HE1      HIS   2 -13.689   7.009   7.009
   24    H    VAL   3           HN       VAL   3  -8.280   3.134   3.134
   25    HA   VAL   3           HA       VAL   3  -6.150   2.150   2.150
   26    HB   VAL   3           HB       VAL   3  -6.146   2.263   2.263
   27   1HG1  VAL   3          HG12      VAL   3  -4.953   0.303   0.303
   28   2HG1  VAL   3          HG11      VAL   3  -3.795   1.541   1.541
   29   3HG1  VAL   3          HG13      VAL   3  -4.054   1.197   1.197
   30   1HG2  VAL   3          HG22      VAL   3  -4.675   3.834   3.834
   31   2HG2  VAL   3          HG21      VAL   3  -5.750   4.463   4.463
   32   3HG2  VAL   3          HG23      VAL   3  -4.173   3.807   3.807
   33    H    ALA   4           HN       ALA   4  -6.584   0.066   0.066
   34    HA   ALA   4           HA       ALA   4  -8.391  -1.593  -1.593
   35   1HB   ALA   4           HB1      ALA   4  -9.279  -0.840  -0.840
   36   2HB   ALA   4           HB3      ALA   4  -7.937  -1.668  -1.668
   37   3HB   ALA   4           HB2      ALA   4  -9.140  -2.595  -2.595
   38    H    GLN   5           HN       GLN   5  -7.528  -3.484  -3.484
   39    HA   GLN   5           HA       GLN   5  -5.131  -4.626  -4.626
   40   1HB   GLN   5           HB2      GLN   5  -5.587  -4.242  -4.242
   41   2HB   GLN   5           HB1      GLN   5  -4.164  -4.985  -4.985
   42   1HG   GLN   5           HG2      GLN   5  -3.297  -2.885  -2.885
   43   2HG   GLN   5           HG1      GLN   5  -4.290  -2.614  -2.614
   44   1HE2  GLN   5          HE22      GLN   5  -5.248  -0.746  -0.746
   45   2HE2  GLN   5          HE21      GLN   5  -3.906  -1.780  -1.780
   46    HA   PRO   6           HA       PRO   6  -7.730  -8.270  -8.270
   47   1HB   PRO   6           HB2      PRO   6  -5.971 -10.116 -10.116
   48   2HB   PRO   6           HB1      PRO   6  -6.922  -9.039  -9.039
   49   1HG   PRO   6           HG2      PRO   6  -4.073  -8.850  -8.850
   50   2HG   PRO   6           HG1      PRO   6  -4.836  -8.448  -8.448
   51   1HD   PRO   6           HD2      PRO   6  -4.100  -6.590  -6.590
   52   2HD   PRO   6           HD1      PRO   6  -5.392  -6.341  -6.341
   53    H    ALA   7           HN       ALA   7  -7.931  -9.598  -9.598
   54    HA   ALA   7           HA       ALA   7  -5.865  -9.532  -9.532
   55   1HB   ALA   7           HB1      ALA   7  -8.452  -9.580  -9.580
   56   2HB   ALA   7           HB3      ALA   7  -8.306 -11.313 -11.313
   57   3HB   ALA   7           HB2      ALA   7  -7.540 -10.588 -10.588
   58    H    VAL   8           HN       VAL   8  -6.856 -11.834 -11.834
   59    HA   VAL   8           HA       VAL   8  -4.464 -13.398 -13.398
   60    HB   VAL   8           HB       VAL   8  -6.502 -14.075 -14.075
   61   1HG1  VAL   8          HG11      VAL   8  -7.482 -14.879 -14.879
   62   2HG1  VAL   8          HG13      VAL   8  -7.742 -16.001 -16.001
   63   3HG1  VAL   8          HG12      VAL   8  -8.386 -14.349 -14.349
   64   1HG2  VAL   8          HG22      VAL   8  -4.385 -15.523 -15.523
   65   2HG2  VAL   8          HG21      VAL   8  -5.312 -15.925 -15.925
   66   3HG2  VAL   8          HG23      VAL   8  -5.786 -16.564 -16.564
   67    H    VAL   9           HN       VAL   9  -4.068 -15.029 -15.029
   68    HA   VAL   9           HA       VAL   9  -5.488 -14.676 -14.676
   69    HB   VAL   9           HB       VAL   9  -2.618 -14.199 -14.199
   70   1HG1  VAL   9          HG11      VAL   9  -3.708 -15.255 -15.255
   71   2HG1  VAL   9          HG13      VAL   9  -2.379 -14.095 -14.095
   72   3HG1  VAL   9          HG12      VAL   9  -2.182 -15.637 -15.637
   73   1HG2  VAL   9          HG22      VAL   9  -4.567 -12.472 -12.472
   74   2HG2  VAL   9          HG21      VAL   9  -2.978 -12.131 -12.131
   75   3HG2  VAL   9          HG23      VAL   9  -4.268 -12.750 -12.750
   76    H    LEU  10           HN       LEU  10  -5.342 -16.517 -16.517
   77    HA   LEU  10           HA       LEU  10  -4.295 -18.987 -18.987
   78   1HB   LEU  10           HB2      LEU  10  -6.655 -18.595 -18.595
   79   2HB   LEU  10           HB1      LEU  10  -6.183 -20.123 -20.123
   80    HG   LEU  10           HG       LEU  10  -7.035 -17.628 -17.628
   81   1HD1  LEU  10          HD12      LEU  10  -8.886 -18.767 -18.767
   82   2HD1  LEU  10          HD11      LEU  10  -8.447 -20.282 -20.282
   83   3HD1  LEU  10          HD13      LEU  10  -9.040 -18.928 -18.928
   84   1HD2  LEU  10          HD22      LEU  10  -5.879 -20.256 -20.256
   85   2HD2  LEU  10          HD21      LEU  10  -5.701 -18.668 -18.668
   86   3HD2  LEU  10          HD23      LEU  10  -7.176 -19.599 -19.599
   87    H    ALA  11           HN       ALA  11  -2.579 -19.831 -19.831
   88    HA   ALA  11           HA       ALA  11  -1.873 -18.942 -18.942
   89   1HB   ALA  11           HB2      ALA  11  -0.861 -21.126 -21.126
   90   2HB   ALA  11           HB1      ALA  11  -0.070 -20.685 -20.685
   91   3HB   ALA  11           HB3      ALA  11  -0.178 -19.509 -19.509
   92    H    SER  12           HN       SER  12  -2.264 -20.050 -20.050
   93    HA   SER  12           HA       SER  12  -4.099 -22.410 -22.410
   94   1HB   SER  12           HB2      SER  12  -4.933 -20.325 -20.325
   95   2HB   SER  12           HB1      SER  12  -3.647 -20.410 -20.410
   96    HG   SER  12           HG       SER  12  -5.957 -21.943 -21.943
   97    H    SER  13           HN       SER  13  -1.907 -21.273 -21.273
   98    HA   SER  13           HA       SER  13  -0.953 -24.110 -24.110
   99   1HB   SER  13           HB2      SER  13  -1.386 -21.944 -21.944
  100   2HB   SER  13           HB1      SER  13  -0.782 -23.563 -23.563
  101    HG   SER  13           HG       SER  13  -3.279 -22.790 -22.790
  102    H    ARG  14           HN       ARG  14   1.273 -24.422 -24.422
  103    HA   ARG  14           HA       ARG  14   3.585 -23.940 -23.940
  104   1HB   ARG  14           HB2      ARG  14   2.896 -22.704 -22.704
  105   2HB   ARG  14           HB1      ARG  14   2.531 -21.296 -21.296
  106   1HG   ARG  14           HG2      ARG  14   4.670 -20.640 -20.640
  107   2HG   ARG  14           HG1      ARG  14   5.188 -22.112 -22.112
  108   1HD   ARG  14           HD2      ARG  14   5.093 -23.274 -23.274
  109   2HD   ARG  14           HD1      ARG  14   4.830 -21.678 -21.678
  110    HE   ARG  14           HE       ARG  14   7.093 -21.719 -21.719
  111   1HH1  ARG  14          HH21      ARG  14   6.065 -22.331 -22.331
  112   2HH1  ARG  14          HH22      ARG  14   7.651 -22.094 -22.094
  113   1HH2  ARG  14          HH11      ARG  14   9.128 -21.420 -21.420
  114   2HH2  ARG  14          HH12      ARG  14   9.368 -21.584 -21.584
  115    H    GLY  15           HN       GLY  15   1.617 -23.109 -23.109
  116   1HA   GLY  15           HA2      GLY  15   1.790 -22.030 -22.030
  117   2HA   GLY  15           HA1      GLY  15   3.516 -22.351 -22.351
  118    H    ILE  16           HN       ILE  16   1.419 -20.213 -20.213
  119    HA   ILE  16           HA       ILE  16   3.287 -17.981 -17.981
  120    HB   ILE  16           HB       ILE  16   1.327 -18.203 -18.203
  121   1HG1  ILE  16          HG12      ILE  16   2.783 -20.135 -20.135
  122   2HG1  ILE  16          HG11      ILE  16   3.210 -18.970 -18.970
  123   1HG2  ILE  16          HG22      ILE  16   3.832 -16.591 -16.591
  124   2HG2  ILE  16          HG21      ILE  16   2.919 -16.609 -16.609
  125   3HG2  ILE  16          HG23      ILE  16   2.180 -15.978 -15.978
  126   1HD1  ILE  16          HD12      ILE  16   4.595 -19.078 -19.078
  127   2HD1  ILE  16          HD11      ILE  16   5.139 -20.031 -20.031
  128   3HD1  ILE  16          HD13      ILE  16   5.128 -18.271 -18.271
  129    H    ALA  17           HN       ALA  17   2.366 -16.814 -16.814
  130    HA   ALA  17           HA       ALA  17  -0.595 -16.419 -16.419
  131   1HB   ALA  17           HB3      ALA  17   0.593 -17.278 -17.278
  132   2HB   ALA  17           HB2      ALA  17   1.562 -15.804 -15.804
  133   3HB   ALA  17           HB1      ALA  17  -0.178 -15.722 -15.722
  134    H    SER  18           HN       SER  18  -1.385 -14.483 -14.483
  135    HA   SER  18           HA       SER  18   0.412 -12.086 -12.086
  136   1HB   SER  18           HB2      SER  18   0.340 -13.115 -13.115
  137   2HB   SER  18           HB1      SER  18  -1.418 -13.002 -13.002
  138    HG   SER  18           HG       SER  18   0.081 -11.228 -11.228
  139    H    PHE  19           HN       PHE  19  -0.568 -10.278 -10.278
  140    HA   PHE  19           HA       PHE  19  -3.528 -10.040 -10.040
  141   1HB   PHE  19           HB2      PHE  19  -3.493  -9.521  -9.521
  142   2HB   PHE  19           HB1      PHE  19  -3.005 -11.169 -11.169
  143    HD1  PHE  19           HD1      PHE  19  -0.506 -11.734 -11.734
  144    HD2  PHE  19           HD2      PHE  19  -2.026  -8.010  -8.010
  145    HE1  PHE  19           HE1      PHE  19   1.659 -11.368 -11.368
  146    HE2  PHE  19           HE2      PHE  19   0.144  -7.641  -7.641
  147    HZ   PHE  19           HZ       PHE  19   1.985  -9.326  -9.326
  148    H    VAL  20           HN       VAL  20  -4.204  -7.799  -7.799
  149    HA   VAL  20           HA       VAL  20  -2.025  -5.845  -5.845
  150    HB   VAL  20           HB       VAL  20  -4.955  -5.882  -5.882
  151   1HG1  VAL  20          HG11      VAL  20  -3.999  -3.558  -3.558
  152   2HG1  VAL  20          HG13      VAL  20  -2.886  -3.846  -3.846
  153   3HG1  VAL  20          HG12      VAL  20  -4.627  -3.799  -3.799
  154   1HG2  VAL  20          HG23      VAL  20  -3.371  -7.404  -7.404
  155   2HG2  VAL  20          HG22      VAL  20  -4.173  -6.206  -6.206
  156   3HG2  VAL  20          HG21      VAL  20  -2.497  -5.962  -5.962
  157    H    CYS  21           HN       CYS  21  -1.554  -4.559  -4.559
  158    HA   CYS  21           HA       CYS  21  -3.643  -3.992  -3.992
  159   1HB   CYS  21           HB2      CYS  21  -1.387  -4.906  -4.906
  160   2HB   CYS  21           HB1      CYS  21  -0.646  -3.469  -3.469
  161    H    GLU  22           HN       GLU  22  -4.824  -2.270  -2.270
  162    HA   GLU  22           HA       GLU  22  -3.542  -0.223  -0.223
  163   1HB   GLU  22           HB2      GLU  22  -6.301  -0.358  -0.358
  164   2HB   GLU  22           HB1      GLU  22  -5.787   0.683   0.683
  165   1HG   GLU  22           HG2      GLU  22  -5.213  -1.311  -1.311
  166   2HG   GLU  22           HG1      GLU  22  -5.813  -2.335  -2.335
  167    H    TYR  23           HN       TYR  23  -3.765   2.071   2.071
  168    HA   TYR  23           HA       TYR  23  -3.846   2.847   2.847
  169   1HB   TYR  23           HB2      TYR  23  -1.598   3.780   3.780
  170   2HB   TYR  23           HB1      TYR  23  -1.511   2.105   2.105
  171    HD1  TYR  23           HD2      TYR  23  -1.264   1.560   1.560
  172    HD2  TYR  23           HD1      TYR  23  -1.201   5.641   5.641
  173    HE1  TYR  23           HE2      TYR  23  -0.284   2.305   2.305
  174    HE2  TYR  23           HE1      TYR  23  -0.226   6.393   6.393
  175    HH   TYR  23           HH       TYR  23  -0.348   5.219   5.219
  176    H    ALA  24           HN       ALA  24  -3.399   5.372   5.372
  177    HA   ALA  24           HA       ALA  24  -4.563   6.679   6.679
  178   1HB   ALA  24           HB2      ALA  24  -5.548   6.808   6.808
  179   2HB   ALA  24           HB1      ALA  24  -6.074   7.930   7.930
  180   3HB   ALA  24           HB3      ALA  24  -6.435   6.210   6.210
  181    H    SER  25           HN       SER  25  -3.482   8.583   8.583
  182    HA   SER  25           HA       SER  25  -1.894   9.859   9.859
  183   1HB   SER  25           HB2      SER  25  -0.088  10.139  10.139
  184   2HB   SER  25           HB1      SER  25  -0.533   8.439   8.439
  185    HG   SER  25           HG       SER  25  -1.048   8.523   8.523
  186    HA   PRO  26           HA       PRO  26  -3.890  13.529  13.529
  187   1HB   PRO  26           HB2      PRO  26  -2.236  15.429  15.429
  188   2HB   PRO  26           HB1      PRO  26  -3.392  14.504  14.504
  189   1HG   PRO  26           HG2      PRO  26  -0.458  14.163  14.163
  190   2HG   PRO  26           HG1      PRO  26  -1.490  13.938  13.938
  191   1HD   PRO  26           HD2      PRO  26  -0.511  11.891  11.891
  192   2HD   PRO  26           HD1      PRO  26  -1.960  11.776  11.776
  193    H    GLY  27           HN       GLY  27  -3.688  14.859  14.859
  194   1HA   GLY  27           HA2      GLY  27  -2.761  15.711  15.711
  195   2HA   GLY  27           HA1      GLY  27  -1.263  15.888  15.888
  196    H    LYS  28           HN       LYS  28   0.024  15.189  15.189
  197    HA   LYS  28           HA       LYS  28  -0.141  12.244  12.244
  198   1HB   LYS  28           HB2      LYS  28   0.449  14.560  14.560
  199   2HB   LYS  28           HB1      LYS  28   0.582  12.859  12.859
  200   1HG   LYS  28           HG2      LYS  28  -1.800  12.521  12.521
  201   2HG   LYS  28           HG1      LYS  28  -1.946  14.208  14.208
  202   1HD   LYS  28           HD2      LYS  28  -1.239  14.905  14.905
  203   2HD   LYS  28           HD1      LYS  28  -1.216  13.208  13.208
  204   1HE   LYS  28           HE2      LYS  28  -3.609  12.997  12.997
  205   2HE   LYS  28           HE1      LYS  28  -3.659  14.670  14.670
  206   1HZ   LYS  28           HZ3      LYS  28  -2.788  13.845  13.845
  207   2HZ   LYS  28           HZ2      LYS  28  -4.304  14.516  14.516
  208   3HZ   LYS  28           HZ1      LYS  28  -2.891  15.437  15.437
  209    H    ALA  29           HN       ALA  29   1.847  11.179  11.179
  210    HA   ALA  29           HA       ALA  29   4.353  12.792  12.792
  211   1HB   ALA  29           HB3      ALA  29   3.284  12.372  12.372
  212   2HB   ALA  29           HB2      ALA  29   3.626  10.661  10.661
  213   3HB   ALA  29           HB1      ALA  29   4.951  11.822  11.822
  214    H    THR  30           HN       THR  30   6.169  11.626  11.626
  215    HA   THR  30           HA       THR  30   5.635   9.245   9.245
  216    HB   THR  30           HB       THR  30   8.049   9.467   9.467
  217    HG1  THR  30           HG1      THR  30   9.313  10.628  10.628
  218   1HG2  THR  30          HG23      THR  30   6.126  11.244  11.244
  219   2HG2  THR  30          HG22      THR  30   7.317  12.300  12.300
  220   3HG2  THR  30          HG21      THR  30   7.786  11.276  11.276
  221    H    GLU  31           HN       GLU  31   7.610  10.015  10.015
  222    HA   GLU  31           HA       GLU  31   8.571   7.299   7.299
  223   1HB   GLU  31           HB2      GLU  31   8.644   9.601   9.601
  224   2HB   GLU  31           HB1      GLU  31   9.747   8.238   8.238
  225   1HG   GLU  31           HG2      GLU  31   9.659   9.681   9.681
  226   2HG   GLU  31           HG1      GLU  31  10.130  10.724  10.724
  227    H    VAL  32           HN       VAL  32   7.279   5.727   5.727
  228    HA   VAL  32           HA       VAL  32   5.602   6.250   6.250
  229    HB   VAL  32           HB       VAL  32   5.101   4.472   4.472
  230   1HG1  VAL  32          HG11      VAL  32   3.765   4.690   4.690
  231   2HG1  VAL  32          HG13      VAL  32   2.796   4.292   4.292
  232   3HG1  VAL  32          HG12      VAL  32   4.132   3.245   3.245
  233   1HG2  VAL  32          HG23      VAL  32   3.707   6.948   6.948
  234   2HG2  VAL  32          HG22      VAL  32   4.636   6.827   6.827
  235   3HG2  VAL  32          HG21      VAL  32   3.109   5.960   5.960
  236    H    ARG  33           HN       ARG  33   7.208   5.485   5.485
  237    HA   ARG  33           HA       ARG  33   8.774   3.090   3.090
  238   1HB   ARG  33           HB2      ARG  33   9.475   5.107   5.107
  239   2HB   ARG  33           HB1      ARG  33   8.302   4.645   4.645
  240   1HG   ARG  33           HG2      ARG  33   9.568   2.903   2.903
  241   2HG   ARG  33           HG1      ARG  33  10.183   2.514   2.514
  242   1HD   ARG  33           HD2      ARG  33  11.719   4.434   4.434
  243   2HD   ARG  33           HD1      ARG  33  11.074   4.884   4.884
  244    HE   ARG  33           HE       ARG  33  11.920   2.109   2.109
  245   1HH1  ARG  33          HH21      ARG  33  13.078   5.395   5.395
  246   2HH1  ARG  33          HH22      ARG  33  14.482   4.921   4.921
  247   1HH2  ARG  33          HH11      ARG  33  13.747   1.542   1.542
  248   2HH2  ARG  33          HH12      ARG  33  14.860   2.763   2.763
  249    H    VAL  34           HN       VAL  34   8.095   1.029   1.029
  250    HA   VAL  34           HA       VAL  34   5.966   0.562   0.562
  251    HB   VAL  34           HB       VAL  34   5.264  -1.311  -1.311
  252   1HG1  VAL  34          HG12      VAL  34   5.382   1.476   1.476
  253   2HG1  VAL  34          HG11      VAL  34   4.446   0.179   0.179
  254   3HG1  VAL  34          HG13      VAL  34   4.055   0.726   0.726
  255   1HG2  VAL  34          HG22      VAL  34   7.795  -0.838  -0.838
  256   2HG2  VAL  34          HG21      VAL  34   6.595  -2.048  -2.048
  257   3HG2  VAL  34          HG23      VAL  34   6.577  -0.457  -0.457
  258    H    THR  35           HN       THR  35   6.335  -1.116  -1.116
  259    HA   THR  35           HA       THR  35   8.877  -2.674  -2.674
  260    HB   THR  35           HB       THR  35   7.730  -1.448  -1.448
  261    HG1  THR  35           HG1      THR  35   8.625   0.246   0.246
  262   1HG2  THR  35          HG21      THR  35  10.292  -2.957  -2.957
  263   2HG2  THR  35          HG23      THR  35  10.006  -2.059  -2.059
  264   3HG2  THR  35          HG22      THR  35   8.998  -3.449  -3.449
  265    H    VAL  36           HN       VAL  36   8.566  -4.848  -4.848
  266    HA   VAL  36           HA       VAL  36   5.962  -5.816  -5.816
  267    HB   VAL  36           HB       VAL  36   8.081  -7.061  -7.061
  268   1HG1  VAL  36          HG12      VAL  36   5.502  -8.143  -8.143
  269   2HG1  VAL  36          HG11      VAL  36   6.177  -8.774  -8.774
  270   3HG1  VAL  36          HG13      VAL  36   7.099  -8.893  -8.893
  271   1HG2  VAL  36          HG22      VAL  36   5.478  -5.649  -5.649
  272   2HG2  VAL  36          HG21      VAL  36   6.960  -5.597  -5.597
  273   3HG2  VAL  36          HG23      VAL  36   5.884  -6.989  -6.989
  274    H    LEU  37           HN       LEU  37   5.990  -6.964  -6.964
  275    HA   LEU  37           HA       LEU  37   8.738  -7.792  -7.792
  276   1HB   LEU  37           HB2      LEU  37   6.376  -6.643  -6.643
  277   2HB   LEU  37           HB1      LEU  37   7.917  -7.107  -7.107
  278    HG   LEU  37           HG       LEU  37   7.820  -5.118  -5.118
  279   1HD1  LEU  37          HD11      LEU  37   6.343  -4.681  -4.681
  280   2HD1  LEU  37          HD13      LEU  37   7.917  -4.094  -4.094
  281   3HD1  LEU  37          HD12      LEU  37   7.162  -3.396  -3.396
  282   1HD2  LEU  37          HD23      LEU  37   9.785  -6.225  -6.225
  283   2HD2  LEU  37          HD22      LEU  37  10.042  -5.301  -5.301
  284   3HD2  LEU  37          HD21      LEU  37   9.762  -4.459  -4.459
  285    H    ARG  38           HN       ARG  38   8.577  -9.433  -9.433
  286    HA   ARG  38           HA       ARG  38   6.249 -11.296 -11.296
  287   1HB   ARG  38           HB2      ARG  38   9.218 -11.801 -11.801
  288   2HB   ARG  38           HB1      ARG  38   8.013 -13.077 -13.077
  289   1HG   ARG  38           HG2      ARG  38   7.191 -12.661 -12.661
  290   2HG   ARG  38           HG1      ARG  38   8.351 -11.351 -11.351
  291   1HD   ARG  38           HD2      ARG  38   9.111 -14.241 -14.241
  292   2HD   ARG  38           HD1      ARG  38   9.170 -13.471 -13.471
  293    HE   ARG  38           HE       ARG  38  10.566 -11.806 -11.806
  294   1HH1  ARG  38          HH21      ARG  38  10.877 -14.912 -14.912
  295   2HH1  ARG  38          HH22      ARG  38  12.605 -14.875 -14.875
  296   1HH2  ARG  38          HH11      ARG  38  12.800 -11.802 -11.802
  297   2HH2  ARG  38          HH12      ARG  38  13.684 -13.135 -13.135
  298    H    GLN  39           HN       GLN  39   5.071 -11.264 -11.264
  299    HA   GLN  39           HA       GLN  39   6.265 -10.449 -10.449
  300   1HB   GLN  39           HB2      GLN  39   4.023  -9.768  -9.768
  301   2HB   GLN  39           HB1      GLN  39   3.511 -11.450 -11.450
  302   1HG   GLN  39           HG2      GLN  39   4.172 -11.420 -11.420
  303   2HG   GLN  39           HG1      GLN  39   4.301  -9.665  -9.665
  304   1HE2  GLN  39          HE22      GLN  39   0.579 -11.281 -11.281
  305   2HE2  GLN  39          HE21      GLN  39   1.957 -12.144 -12.144
  306    H    ALA  40           HN       ALA  40   6.383 -11.737 -11.737
  307    HA   ALA  40           HA       ALA  40   6.184 -14.703 -14.703
  308   1HB   ALA  40           HB2      ALA  40   8.485 -13.384 -13.384
  309   2HB   ALA  40           HB1      ALA  40   8.112 -13.433 -13.433
  310   3HB   ALA  40           HB3      ALA  40   8.275 -14.935 -14.935
  311    H    ASP  41           HN       ASP  41   6.688 -15.396 -15.396
  312    HA   ASP  41           HA       ASP  41   4.132 -15.122 -15.122
  313   1HB   ASP  41           HB2      ASP  41   5.929 -16.843 -16.843
  314   2HB   ASP  41           HB1      ASP  41   6.766 -15.620 -15.620
  315    H    SER  42           HN       SER  42   7.183 -13.386 -13.386
  316    HA   SER  42           HA       SER  42   5.544 -11.221 -11.221
  317   1HB   SER  42           HB2      SER  42   7.294 -11.115 -11.115
  318   2HB   SER  42           HB1      SER  42   6.514 -12.693 -12.693
  319    HG   SER  42           HG       SER  42   8.933 -12.558 -12.558
  320    H    GLN  43           HN       GLN  43   7.874 -11.959 -11.959
  321    HA   GLN  43           HA       GLN  43   8.718  -9.091  -9.091
  322   1HB   GLN  43           HB2      GLN  43  10.413 -11.594 -11.594
  323   2HB   GLN  43           HB1      GLN  43  11.002  -9.985  -9.985
  324   1HG   GLN  43           HG2      GLN  43  10.551  -9.187  -9.187
  325   2HG   GLN  43           HG1      GLN  43   9.853 -10.746 -10.746
  326   1HE2  GLN  43          HE22      GLN  43  13.107 -11.517 -11.517
  327   2HE2  GLN  43          HE21      GLN  43  11.509 -11.146 -11.146
  328    H    VAL  44           HN       VAL  44   9.482  -8.440  -8.440
  329    HA   VAL  44           HA       VAL  44   8.408 -10.152 -10.152
  330    HB   VAL  44           HB       VAL  44   8.339  -7.135  -7.135
  331   1HG1  VAL  44          HG11      VAL  44   8.600  -7.939  -7.939
  332   2HG1  VAL  44          HG13      VAL  44   7.073  -8.802  -8.802
  333   3HG1  VAL  44          HG12      VAL  44   7.111  -7.043  -7.043
  334   1HG2  VAL  44          HG23      VAL  44   6.674  -9.059  -9.059
  335   2HG2  VAL  44          HG22      VAL  44   6.248  -7.370  -7.370
  336   3HG2  VAL  44          HG21      VAL  44   5.804  -8.586  -8.586
  337    H    THR  45           HN       THR  45   9.605  -9.901  -9.901
  338    HA   THR  45           HA       THR  45  12.351  -8.732  -8.732
  339    HB   THR  45           HB       THR  45  13.152 -10.632 -10.632
  340    HG1  THR  45           HG1      THR  45  11.368 -10.980 -10.980
  341   1HG2  THR  45          HG23      THR  45  12.878 -10.870 -10.870
  342   2HG2  THR  45          HG22      THR  45  11.308 -11.619 -11.619
  343   3HG2  THR  45          HG21      THR  45  12.779 -12.400 -12.400
  344    H    GLU  46           HN       GLU  46  13.346  -7.943  -7.943
  345    HA   GLU  46           HA       GLU  46  11.392  -6.733  -6.733
  346   1HB   GLU  46           HB2      GLU  46  14.369  -6.498  -6.498
  347   2HB   GLU  46           HB1      GLU  46  13.537  -5.627  -5.627
  348   1HG   GLU  46           HG2      GLU  46  12.086  -4.526  -4.526
  349   2HG   GLU  46           HG1      GLU  46  12.810  -5.455  -5.455
  350    H    VAL  47           HN       VAL  47  11.217  -7.154  -7.154
  351    HA   VAL  47           HA       VAL  47  12.703  -9.550  -9.550
  352    HB   VAL  47           HB       VAL  47   9.934  -8.439  -8.439
  353   1HG1  VAL  47          HG12      VAL  47  11.489 -10.640 -10.640
  354   2HG1  VAL  47          HG11      VAL  47   9.737 -10.777 -10.777
  355   3HG1  VAL  47          HG13      VAL  47  10.434  -9.433  -9.433
  356   1HG2  VAL  47          HG22      VAL  47  11.065 -10.549 -10.549
  357   2HG2  VAL  47          HG21      VAL  47   9.629  -9.550  -9.550
  358   3HG2  VAL  47          HG23      VAL  47   9.567 -10.954 -10.954
  359    H    CYS  48           HN       CYS  48  10.785  -6.944  -6.944
  360    HA   CYS  48           HA       CYS  48  13.207  -6.148  -6.148
  361   1HB   CYS  48           HB2      CYS  48  10.475  -6.725  -6.725
  362   2HB   CYS  48           HB1      CYS  48  11.967  -6.389  -6.389
  363    H    ALA  49           HN       ALA  49  13.074  -3.975  -3.975
  364    HA   ALA  49           HA       ALA  49  10.691  -2.332  -2.332
  365   1HB   ALA  49           HB2      ALA  49  12.549  -2.748  -2.748
  366   2HB   ALA  49           HB1      ALA  49  13.118  -1.243  -1.243
  367   3HB   ALA  49           HB3      ALA  49  11.475  -1.351  -1.351
  368    H    ALA  50           HN       ALA  50  10.601  -0.640  -0.640
  369    HA   ALA  50           HA       ALA  50  12.947   0.731   0.731
  370   1HB   ALA  50           HB3      ALA  50  12.494  -1.737  -1.737
  371   2HB   ALA  50           HB2      ALA  50  11.584  -0.706  -0.706
  372   3HB   ALA  50           HB1      ALA  50  13.307  -0.421  -0.421
  373    H    THR  51           HN       THR  51  12.318   2.505   2.505
  374    HA   THR  51           HA       THR  51   9.413   3.191   3.191
  375    HB   THR  51           HB       THR  51  11.663   5.013   5.013
  376    HG1  THR  51           HG1      THR  51  12.364   4.156   4.156
  377   1HG2  THR  51          HG21      THR  51   8.856   5.262   5.262
  378   2HG2  THR  51          HG23      THR  51   9.915   6.366   6.366
  379   3HG2  THR  51          HG22      THR  51   9.881   6.384   6.384
  380    H    TYR  52           HN       TYR  52   8.184   3.198   3.198
  381    HA   TYR  52           HA       TYR  52   9.690   2.917   2.917
  382   1HB   TYR  52           HB2      TYR  52   7.659   1.802   1.802
  383   2HB   TYR  52           HB1      TYR  52   8.243   1.023   1.023
  384    HD1  TYR  52           HD2      TYR  52   5.591   3.168   3.168
  385    HD2  TYR  52           HD1      TYR  52   6.995   1.181   1.181
  386    HE1  TYR  52           HE2      TYR  52   3.353   3.493   3.493
  387    HE2  TYR  52           HE1      TYR  52   4.752   1.509   1.509
  388    HH   TYR  52           HH       TYR  52   2.347   3.578   3.578
  389    H    MET  53           HN       MET  53   9.273   4.310   4.310
  390    HA   MET  53           HA       MET  53   7.938   6.840   6.840
  391   1HB   MET  53           HB2      MET  53   9.030   5.646   5.646
  392   2HB   MET  53           HB1      MET  53   8.613   7.341   7.341
  393   1HG   MET  53           HG2      MET  53  11.108   6.175   6.175
  394   2HG   MET  53           HG1      MET  53  10.589   7.771   7.771
  395   1HE   MET  53           HE3      MET  53   9.191   8.164   8.164
  396   2HE   MET  53           HE2      MET  53  10.102   7.642   7.642
  397   3HE   MET  53           HE1      MET  53  10.938   8.447   8.447
  398    H    MET  54           HN       MET  54   6.049   7.548   7.548
  399    HA   MET  54           HA       MET  54   4.038   5.451   5.451
  400   1HB   MET  54           HB2      MET  54   4.177   8.275   8.275
  401   2HB   MET  54           HB1      MET  54   2.706   7.301   7.301
  402   1HG   MET  54           HG2      MET  54   3.245   8.984   8.984
  403   2HG   MET  54           HG1      MET  54   2.576   7.393   7.393
  404   1HE   MET  54           HE1      MET  54   3.483   5.593   5.593
  405   2HE   MET  54           HE3      MET  54   5.174   5.173   5.173
  406   3HE   MET  54           HE2      MET  54   4.201   5.910   5.910
  407    H    GLY  55           HN       GLY  55   5.288   3.944   3.944
  408   1HA   GLY  55           HA2      GLY  55   4.478   3.741   3.741
  409   2HA   GLY  55           HA1      GLY  55   6.089   4.471   4.471
  410    H    ASN  56           HN       ASN  56   7.457   2.776   2.776
  411    HA   ASN  56           HA       ASN  56   7.047   0.140   0.140
  412   1HB   ASN  56           HB2      ASN  56   8.867   1.001   1.001
  413   2HB   ASN  56           HB1      ASN  56   8.641  -0.652  -0.652
  414   1HD2  ASN  56          HD22      ASN  56   5.156  -0.696  -0.696
  415   2HD2  ASN  56          HD21      ASN  56   5.994  -1.053  -1.053
  416    H    GLU  57           HN       GLU  57   8.438  -0.611  -0.611
  417    HA   GLU  57           HA       GLU  57  11.202   0.117   0.117
  418   1HB   GLU  57           HB2      GLU  57   9.945   2.258   2.258
  419   2HB   GLU  57           HB1      GLU  57   9.309   1.359   1.359
  420   1HG   GLU  57           HG2      GLU  57  11.431   1.121   1.121
  421   2HG   GLU  57           HG1      GLU  57  12.273   1.451   1.451
  422    H    LEU  58           HN       LEU  58  11.928  -0.688  -0.688
  423    HA   LEU  58           HA       LEU  58  10.294  -3.114  -3.114
  424   1HB   LEU  58           HB2      LEU  58  13.233  -2.436  -2.436
  425   2HB   LEU  58           HB1      LEU  58  12.520  -3.900  -3.900
  426    HG   LEU  58           HG       LEU  58  12.361  -3.114  -3.114
  427   1HD1  LEU  58          HD11      LEU  58  14.208  -4.961  -4.961
  428   2HD1  LEU  58          HD13      LEU  58  13.918  -5.151  -5.151
  429   3HD1  LEU  58          HD12      LEU  58  14.641  -3.664  -3.664
  430   1HD2  LEU  58          HD23      LEU  58  11.232  -5.294  -5.294
  431   2HD2  LEU  58          HD22      LEU  58  10.594  -4.571  -4.571
  432   3HD2  LEU  58          HD21      LEU  58  11.875  -5.778  -5.778
  433    H    THR  59           HN       THR  59   9.547  -3.380  -3.380
  434    HA   THR  59           HA       THR  59   9.793  -1.160  -1.160
  435    HB   THR  59           HB       THR  59   7.984  -2.431  -2.431
  436    HG1  THR  59           HG1      THR  59   8.016  -4.250  -4.250
  437   1HG2  THR  59          HG23      THR  59   7.710  -0.918  -0.918
  438   2HG2  THR  59          HG22      THR  59   7.298  -2.443  -2.443
  439   3HG2  THR  59          HG21      THR  59   6.341  -1.866  -1.866
  440    H    PHE  60           HN       PHE  60  11.776  -3.712  -3.712
  441    HA   PHE  60           HA       PHE  60  12.418  -4.106  -4.106
  442   1HB   PHE  60           HB2      PHE  60  12.590  -6.207  -6.207
  443   2HB   PHE  60           HB1      PHE  60  12.779  -6.465  -6.465
  444    HD1  PHE  60           HD1      PHE  60  10.620  -4.943  -4.943
  445    HD2  PHE  60           HD2      PHE  60  10.596  -7.269  -7.269
  446    HE1  PHE  60           HE1      PHE  60   8.166  -5.163  -5.163
  447    HE2  PHE  60           HE2      PHE  60   8.118  -7.511  -7.511
  448    HZ   PHE  60           HZ       PHE  60   6.891  -6.468  -6.468
  449    H    LEU  61           HN       LEU  61  14.381  -3.126  -3.126
  450    HA   LEU  61           HA       LEU  61  16.295  -2.616  -2.616
  451   1HB   LEU  61           HB2      LEU  61  16.420  -2.658  -2.658
  452   2HB   LEU  61           HB1      LEU  61  17.755  -2.098  -2.098
  453    HG   LEU  61           HG       LEU  61  14.944  -0.966  -0.966
  454   1HD1  LEU  61          HD13      LEU  61  17.471   0.142   0.142
  455   2HD1  LEU  61          HD12      LEU  61  15.927   0.988   0.988
  456   3HD1  LEU  61          HD11      LEU  61  16.065  -0.461  -0.461
  457   1HD2  LEU  61          HD23      LEU  61  17.550  -0.333  -0.333
  458   2HD2  LEU  61          HD22      LEU  61  15.955  -0.565  -0.565
  459   3HD2  LEU  61          HD21      LEU  61  16.307   0.902   0.902
  460    H    ASP  62           HN       ASP  62  15.920  -5.175  -5.175
  461    HA   ASP  62           HA       ASP  62  17.926  -6.825  -6.825
  462   1HB   ASP  62           HB2      ASP  62  18.966  -7.407  -7.407
  463   2HB   ASP  62           HB1      ASP  62  19.032  -5.668  -5.668
  464    H    ASP  63           HN       ASP  63  17.842  -9.103  -9.103
  465    HA   ASP  63           HA       ASP  63  16.524 -11.031 -11.031
  466   1HB   ASP  63           HB2      ASP  63  14.697  -8.835  -8.835
  467   2HB   ASP  63           HB1      ASP  63  14.461 -10.551 -10.551
  468    H    SER  64           HN       SER  64  16.492 -10.526 -10.526
  469    HA   SER  64           HA       SER  64  14.236  -9.729  -9.729
  470   1HB   SER  64           HB2      SER  64  16.402 -10.431 -10.431
  471   2HB   SER  64           HB1      SER  64  16.061 -12.101 -12.101
  472    HG   SER  64           HG       SER  64  15.441 -11.862 -11.862
  473    H    ILE  67           HN       ILE  67  14.506 -12.587 -12.587
  474    HA   ILE  67           HA       ILE  67  12.652 -14.379 -14.379
  475    HB   ILE  67           HB       ILE  67  13.171 -13.536 -13.536
  476   1HG1  ILE  67          HG12      ILE  67  14.191 -15.854 -15.854
  477   2HG1  ILE  67          HG11      ILE  67  15.101 -14.381 -14.381
  478   1HG2  ILE  67          HG21      ILE  67  11.752 -15.989 -15.989
  479   2HG2  ILE  67          HG23      ILE  67  12.281 -15.811 -15.811
  480   3HG2  ILE  67          HG22      ILE  67  11.040 -14.740 -14.740
  481   1HD1  ILE  67          HD11      ILE  67  14.777 -14.867 -14.867
  482   2HD1  ILE  67          HD13      ILE  67  14.173 -16.450 -16.450
  483   3HD1  ILE  67          HD12      ILE  67  15.832 -15.988 -15.988
  484    H    CYS  68           HN       CYS  68  12.010 -11.248 -11.248
  485    HA   CYS  68           HA       CYS  68   9.075 -11.741 -11.741
  486   1HB   CYS  68           HB2      CYS  68   9.185  -9.357  -9.357
  487   2HB   CYS  68           HB1      CYS  68   9.954 -10.636 -10.636
  488    H    THR  69           HN       THR  69   7.800 -11.042 -11.042
  489    HA   THR  69           HA       THR  69   8.809  -8.868  -8.868
  490    HB   THR  69           HB       THR  69   9.381 -11.066 -11.066
  491    HG1  THR  69           HG1      THR  69   8.775  -9.479  -9.479
  492   1HG2  THR  69          HG21      THR  69   7.589 -12.348 -12.348
  493   2HG2  THR  69          HG23      THR  69   6.402 -11.615 -11.615
  494   3HG2  THR  69          HG22      THR  69   7.645 -12.682 -12.682
  495    H    GLY  70           HN       GLY  70   7.100  -7.614  -7.614
  496   1HA   GLY  70           HA2      GLY  70   4.330  -8.389  -8.389
  497   2HA   GLY  70           HA1      GLY  70   4.740  -7.287  -7.287
  498    H    THR  71           HN       THR  71   2.999  -6.113  -6.113
  499    HA   THR  71           HA       THR  71   4.347  -4.334  -4.334
  500    HB   THR  71           HB       THR  71   1.558  -5.439  -5.439
  501    HG1  THR  71           HG1      THR  71   3.797  -5.950  -5.950
  502   1HG2  THR  71          HG23      THR  71   2.914  -3.394  -3.394
  503   2HG2  THR  71          HG22      THR  71   1.699  -4.442  -4.442
  504   3HG2  THR  71          HG21      THR  71   1.268  -3.414  -3.414
  505    H    SER  72           HN       SER  72   3.269  -2.200  -2.200
  506    HA   SER  72           HA       SER  72   1.591  -1.405  -1.405
  507   1HB   SER  72           HB2      SER  72   4.305  -0.231  -0.231
  508   2HB   SER  72           HB1      SER  72   3.222   0.401   0.401
  509    HG   SER  72           HG       SER  72   3.969  -1.069  -1.069
  510    H    SER  73           HN       SER  73   0.006  -0.030  -0.030
  511    HA   SER  73           HA       SER  73   0.696   1.907   1.907
  512   1HB   SER  73           HB2      SER  73   0.233  -0.149  -0.149
  513   2HB   SER  73           HB1      SER  73  -1.270  -0.379  -0.379
  514    HG   SER  73           HG       SER  73  -1.855   0.605   0.605
  515    H    GLY  74           HN       GLY  74  -0.641   3.702   3.702
  516   1HA   GLY  74           HA2      GLY  74  -2.247   5.168   5.168
  517   2HA   GLY  74           HA1      GLY  74  -3.338   3.783   3.783
  518    H    ASN  75           HN       ASN  75  -4.236   3.456   3.456
  519    HA   ASN  75           HA       ASN  75  -2.654   4.080   4.080
  520   1HB   ASN  75           HB2      ASN  75  -5.622   3.811   3.811
  521   2HB   ASN  75           HB1      ASN  75  -4.945   4.174   4.174
  522   1HD2  ASN  75          HD22      ASN  75  -5.763   7.341   7.341
  523   2HD2  ASN  75          HD21      ASN  75  -6.665   5.923   5.923
  524    H    GLN  76           HN       GLN  76  -2.903   1.440   1.440
  525    HA   GLN  76           HA       GLN  76  -3.581  -0.389  -0.389
  526   1HB   GLN  76           HB2      GLN  76  -3.745  -0.782  -0.782
  527   2HB   GLN  76           HB1      GLN  76  -4.198  -1.984  -1.984
  528   1HG   GLN  76           HG2      GLN  76  -5.873  -0.355  -0.355
  529   2HG   GLN  76           HG1      GLN  76  -5.496   0.715   0.715
  530   1HE2  GLN  76          HE22      GLN  76  -6.701  -2.083  -2.083
  531   2HE2  GLN  76          HE21      GLN  76  -5.159  -1.438  -1.438
  532    H    VAL  77           HN       VAL  77  -1.708  -1.382  -1.382
  533    HA   VAL  77           HA       VAL  77   0.546  -1.749  -1.749
  534    HB   VAL  77           HB       VAL  77   1.972  -1.683  -1.683
  535   1HG1  VAL  77          HG11      VAL  77  -0.293   0.208   0.208
  536   2HG1  VAL  77          HG13      VAL  77   1.293   0.321   0.321
  537   3HG1  VAL  77          HG12      VAL  77   1.131   0.522   0.522
  538   1HG2  VAL  77          HG21      VAL  77  -0.319  -2.701  -2.701
  539   2HG2  VAL  77          HG23      VAL  77   1.397  -3.004  -3.004
  540   3HG2  VAL  77          HG22      VAL  77   0.661  -1.534  -1.534
  541    H    ASN  78           HN       ASN  78   0.872  -3.786  -3.786
  542    HA   ASN  78           HA       ASN  78  -0.556  -6.048  -6.048
  543   1HB   ASN  78           HB2      ASN  78  -0.928  -5.413  -5.413
  544   2HB   ASN  78           HB1      ASN  78   0.762  -5.794  -5.794
  545    HD2  ASN  78          HD22      ASN  78  -2.163  -7.344  -7.344
  546    H    LEU  79           HN       LEU  79   0.745  -7.148  -7.148
  547    HA   LEU  79           HA       LEU  79   3.640  -7.544  -7.544
  548   1HB   LEU  79           HB2      LEU  79   1.954  -7.897  -7.897
  549   2HB   LEU  79           HB1      LEU  79   3.648  -8.376  -8.376
  550    HG   LEU  79           HG       LEU  79   2.624  -5.565  -5.565
  551   1HD1  LEU  79          HD13      LEU  79   3.897  -6.859  -6.859
  552   2HD1  LEU  79          HD12      LEU  79   3.864  -5.113  -5.113
  553   3HD1  LEU  79          HD11      LEU  79   2.353  -6.009  -6.009
  554   1HD2  LEU  79          HD21      LEU  79   5.388  -6.807  -6.807
  555   2HD2  LEU  79          HD23      LEU  79   4.668  -5.969  -5.969
  556   3HD2  LEU  79          HD22      LEU  79   5.106  -5.065  -5.065
  557    H    THR  80           HN       THR  80   4.371  -9.612  -9.612
  558    HA   THR  80           HA       THR  80   2.467 -11.904 -11.904
  559    HB   THR  80           HB       THR  80   4.062 -11.108 -11.108
  560    HG1  THR  80           HG1      THR  80   2.056 -10.632 -10.632
  561   1HG2  THR  80          HG23      THR  80   2.569 -13.559 -13.559
  562   2HG2  THR  80          HG22      THR  80   2.334 -12.978 -12.978
  563   3HG2  THR  80          HG21      THR  80   3.953 -13.379 -13.379
  564    H    ILE  81           HN       ILE  81   3.470 -13.882 -13.882
  565    HA   ILE  81           HA       ILE  81   6.459 -13.842 -13.842
  566    HB   ILE  81           HB       ILE  81   4.287 -15.250 -15.250
  567   1HG1  ILE  81          HG12      ILE  81   6.285 -13.177 -13.177
  568   2HG1  ILE  81          HG11      ILE  81   4.679 -12.748 -12.748
  569   1HG2  ILE  81          HG21      ILE  81   7.311 -15.322 -15.322
  570   2HG2  ILE  81          HG23      ILE  81   6.193 -15.952 -15.952
  571   3HG2  ILE  81          HG22      ILE  81   6.258 -16.685 -16.685
  572   1HD1  ILE  81          HD11      ILE  81   3.817 -14.502 -14.502
  573   2HD1  ILE  81          HD13      ILE  81   5.415 -14.357 -14.357
  574   3HD1  ILE  81          HD12      ILE  81   4.365 -12.944 -12.944
  575    H    GLN  82           HN       GLN  82   7.521 -15.416 -15.416
  576    HA   GLN  82           HA       GLN  82   5.856 -17.617 -17.617
  577   1HB   GLN  82           HB2      GLN  82   8.386 -16.290 -16.290
  578   2HB   GLN  82           HB1      GLN  82   7.599 -17.665 -17.665
  579   1HG   GLN  82           HG2      GLN  82   5.573 -16.356 -16.356
  580   2HG   GLN  82           HG1      GLN  82   6.265 -14.989 -14.989
  581   1HE2  GLN  82          HE22      GLN  82   6.806 -14.606 -14.606
  582   2HE2  GLN  82          HE21      GLN  82   5.419 -14.938 -14.938
  583    H    GLY  83           HN       GLY  83   6.241 -19.500 -19.500
  584   1HA   GLY  83           HA2      GLY  83   7.821 -21.366 -21.366
  585   2HA   GLY  83           HA1      GLY  83   9.013 -20.171 -20.171
  586    H    LEU  84           HN       LEU  84   5.582 -20.604 -20.604
  587    HA   LEU  84           HA       LEU  84   6.293 -20.239 -20.239
  588   1HB   LEU  84           HB2      LEU  84   3.728 -20.534 -20.534
  589   2HB   LEU  84           HB1      LEU  84   3.760 -20.337 -20.337
  590    HG   LEU  84           HG       LEU  84   5.138 -18.414 -18.414
  591   1HD1  LEU  84          HD12      LEU  84   2.707 -18.460 -18.460
  592   2HD1  LEU  84          HD11      LEU  84   2.384 -18.203 -18.203
  593   3HD1  LEU  84          HD13      LEU  84   3.187 -16.948 -16.948
  594   1HD2  LEU  84          HD21      LEU  84   4.616 -18.630 -18.630
  595   2HD2  LEU  84          HD23      LEU  84   6.026 -17.992 -17.992
  596   3HD2  LEU  84          HD22      LEU  84   4.560 -17.020 -17.020
  597    H    ARG  85           HN       ARG  85   6.505 -21.866 -21.866
  598    HA   ARG  85           HA       ARG  85   5.487 -24.593 -24.593
  599   1HB   ARG  85           HB2      ARG  85   7.921 -23.682 -23.682
  600   2HB   ARG  85           HB1      ARG  85   7.434 -25.365 -25.365
  601   1HG   ARG  85           HG2      ARG  85   7.497 -24.861 -24.861
  602   2HG   ARG  85           HG1      ARG  85   8.439 -23.440 -23.440
  603   1HD   ARG  85           HD2      ARG  85  10.109 -24.850 -24.850
  604   2HD   ARG  85           HD1      ARG  85   9.142 -26.298 -26.298
  605    HE   ARG  85           HE       ARG  85   9.683 -24.736 -24.736
  606   1HH1  ARG  85          HH21      ARG  85  10.976 -27.160 -27.160
  607   2HH1  ARG  85          HH22      ARG  85  12.016 -27.828 -27.828
  608   1HH2  ARG  85          HH11      ARG  85  11.044 -25.634 -25.634
  609   2HH2  ARG  85          HH12      ARG  85  12.056 -26.976 -26.976
  610    H    ALA  86           HN       ALA  86   5.383 -25.870 -25.870
  611    HA   ALA  86           HA       ALA  86   3.265 -24.795 -24.795
  612   1HB   ALA  86           HB2      ALA  86   4.208 -27.181 -27.181
  613   2HB   ALA  86           HB1      ALA  86   5.417 -26.684 -26.684
  614   3HB   ALA  86           HB3      ALA  86   3.704 -26.684 -26.684
  615    H    MET  87           HN       MET  87   6.753 -24.826 -24.826
  616    HA   MET  87           HA       MET  87   6.738 -23.556 -23.556
  617   1HB   MET  87           HB2      MET  87   8.742 -23.824 -23.824
  618   2HB   MET  87           HB1      MET  87   9.165 -23.162 -23.162
  619   1HG   MET  87           HG2      MET  87   7.944 -25.899 -25.899
  620   2HG   MET  87           HG1      MET  87   9.657 -25.600 -25.600
  621   1HE   MET  87           HE1      MET  87   6.187 -25.506 -25.506
  622   2HE   MET  87           HE3      MET  87   6.593 -26.883 -26.883
  623   3HE   MET  87           HE2      MET  87   6.067 -25.363 -25.363
  624    H    ASP  88           HN       ASP  88   6.795 -22.214 -22.214
  625    HA   ASP  88           HA       ASP  88   7.521 -19.519 -19.519
  626   1HB   ASP  88           HB2      ASP  88   5.980 -20.676 -20.676
  627   2HB   ASP  88           HB1      ASP  88   6.615 -19.034 -19.034
  628    H    THR  89           HN       THR  89   4.497 -21.244 -21.244
  629    HA   THR  89           HA       THR  89   2.557 -19.282 -19.282
  630    HB   THR  89           HB       THR  89   2.720 -21.375 -21.375
  631    HG1  THR  89           HG1      THR  89   2.129 -22.807 -22.807
  632   1HG2  THR  89          HG23      THR  89   0.818 -19.550 -19.550
  633   2HG2  THR  89          HG22      THR  89   0.236 -20.650 -20.650
  634   3HG2  THR  89          HG21      THR  89   0.432 -21.221 -21.221
  635    H    GLY  90           HN       GLY  90   1.946 -17.533 -17.533
  636   1HA   GLY  90           HA2      GLY  90   2.242 -17.107 -17.107
  637   2HA   GLY  90           HA1      GLY  90   3.749 -16.535 -16.535
  638    H    LEU  91           HN       LEU  91   3.141 -14.381 -14.381
  639    HA   LEU  91           HA       LEU  91   0.918 -13.093 -13.093
  640   1HB   LEU  91           HB2      LEU  91   0.824 -13.067 -13.067
  641   2HB   LEU  91           HB1      LEU  91   2.419 -12.316 -12.316
  642    HG   LEU  91           HG       LEU  91   1.514 -10.403 -10.403
  643   1HD1  LEU  91          HD13      LEU  91  -0.794 -12.193 -12.193
  644   2HD1  LEU  91          HD12      LEU  91  -1.223 -10.557 -10.557
  645   3HD1  LEU  91          HD11      LEU  91  -0.383 -10.816 -10.816
  646   1HD2  LEU  91          HD22      LEU  91   0.079 -11.024 -11.024
  647   2HD2  LEU  91          HD21      LEU  91   1.649 -10.233 -10.233
  648   3HD2  LEU  91          HD23      LEU  91   0.189  -9.424  -9.424
  649    H    TYR  92           HN       TYR  92   1.401 -11.533 -11.533
  650    HA   TYR  92           HA       TYR  92   4.189 -10.442 -10.442
  651   1HB   TYR  92           HB2      TYR  92   2.213 -11.237 -11.237
  652   2HB   TYR  92           HB1      TYR  92   3.526 -10.114 -10.114
  653    HD1  TYR  92           HD2      TYR  92   5.926 -10.807 -10.807
  654    HD2  TYR  92           HD1      TYR  92   2.623 -13.604 -13.604
  655    HE1  TYR  92           HE2      TYR  92   7.534 -12.710 -12.710
  656    HE2  TYR  92           HE1      TYR  92   4.230 -15.512 -15.512
  657    HH   TYR  92           HH       TYR  92   7.133 -15.375 -15.375
  658    H    ILE  93           HN       ILE  93   4.307  -8.255  -8.255
  659    HA   ILE  93           HA       ILE  93   1.792  -6.712  -6.712
  660    HB   ILE  93           HB       ILE  93   4.679  -6.171  -6.171
  661   1HG1  ILE  93          HG12      ILE  93   3.531  -6.283  -6.283
  662   2HG1  ILE  93          HG11      ILE  93   2.251  -7.142  -7.142
  663   1HG2  ILE  93          HG23      ILE  93   2.261  -4.438  -4.438
  664   2HG2  ILE  93          HG22      ILE  93   3.248  -4.414  -4.414
  665   3HG2  ILE  93          HG21      ILE  93   3.964  -3.990  -3.990
  666   1HD1  ILE  93          HD12      ILE  93   5.004  -8.070  -8.070
  667   2HD1  ILE  93          HD11      ILE  93   4.442  -8.361  -8.361
  668   3HD1  ILE  93          HD13      ILE  93   3.536  -9.005  -9.005
  669    H    CYS  94           HN       CYS  94   1.133  -5.324  -5.324
  670    HA   CYS  94           HA       CYS  94   2.996  -4.570  -4.570
  671   1HB   CYS  94           HB2      CYS  94   0.895  -3.787  -3.787
  672   2HB   CYS  94           HB1      CYS  94   0.675  -5.427  -5.427
  673    H    LYS  95           HN       LYS  95   4.221  -2.742  -2.742
  674    HA   LYS  95           HA       LYS  95   2.956  -0.657  -0.657
  675   1HB   LYS  95           HB2      LYS  95   5.805  -1.377  -1.377
  676   2HB   LYS  95           HB1      LYS  95   5.377   0.058   0.058
  677   1HG   LYS  95           HG2      LYS  95   3.991  -2.143  -2.143
  678   2HG   LYS  95           HG1      LYS  95   5.665  -2.646  -2.646
  679   1HD   LYS  95           HD2      LYS  95   6.429  -0.554  -0.554
  680   2HD   LYS  95           HD1      LYS  95   4.744  -0.129  -0.129
  681   1HE   LYS  95           HE2      LYS  95   4.671  -1.455  -1.455
  682   2HE   LYS  95           HE1      LYS  95   5.324  -2.832  -2.832
  683   1HZ   LYS  95           HZ3      LYS  95   7.527  -1.603  -1.603
  684   2HZ   LYS  95           HZ2      LYS  95   6.807  -0.616  -0.616
  685   3HZ   LYS  95           HZ1      LYS  95   6.973  -2.284  -2.284
  686    H    VAL  96           HN       VAL  96   2.895   1.504   1.504
  687    HA   VAL  96           HA       VAL  96   3.855   2.050   2.050
  688    HB   VAL  96           HB       VAL  96   1.088   2.663   2.663
  689   1HG1  VAL  96          HG12      VAL  96   2.547   3.242   3.242
  690   2HG1  VAL  96          HG11      VAL  96   0.882   2.694   2.694
  691   3HG1  VAL  96          HG13      VAL  96   1.232   4.129   4.129
  692   1HG2  VAL  96          HG21      VAL  96   2.153   0.307   0.307
  693   2HG2  VAL  96          HG23      VAL  96   1.022   0.331   0.331
  694   3HG2  VAL  96          HG22      VAL  96   0.487   0.839   0.839
  695    H    GLU  97           HN       GLU  97   5.336   3.701   3.701
  696    HA   GLU  97           HA       GLU  97   4.249   5.993   5.993
  697   1HB   GLU  97           HB2      GLU  97   6.970   4.666   4.666
  698   2HB   GLU  97           HB1      GLU  97   6.575   6.145   6.145
  699   1HG   GLU  97           HG2      GLU  97   4.768   4.918   4.918
  700   2HG   GLU  97           HG1      GLU  97   5.200   3.450   3.450
  701    H    LEU  98           HN       LEU  98   4.400   7.919   7.919
  702    HA   LEU  98           HA       LEU  98   5.982   8.238   8.238
  703   1HB   LEU  98           HB2      LEU  98   4.261   9.938   9.938
  704   2HB   LEU  98           HB1      LEU  98   5.135  10.668  10.668
  705    HG   LEU  98           HG       LEU  98   2.680   9.992   9.992
  706   1HD1  LEU  98          HD13      LEU  98   4.272  10.641  10.641
  707   2HD1  LEU  98          HD12      LEU  98   4.790   8.960   8.960
  708   3HD1  LEU  98          HD11      LEU  98   3.138   9.411   9.411
  709   1HD2  LEU  98          HD23      LEU  98   2.987   7.673   7.673
  710   2HD2  LEU  98          HD22      LEU  98   2.176   7.727   7.727
  711   3HD2  LEU  98          HD21      LEU  98   3.873   7.257   7.257
  712    H    MET  99           HN       MET  99   8.072   7.674   7.674
  713    HA   MET  99           HA       MET  99   8.980   9.156   9.156
  714   1HB   MET  99           HB2      MET  99  10.324   7.289   7.289
  715   2HB   MET  99           HB1      MET  99  11.080   7.860   7.860
  716   1HG   MET  99           HG2      MET  99   8.691   6.065   6.065
  717   2HG   MET  99           HG1      MET  99  10.115   5.827   5.827
  718   1HE   MET  99           HE3      MET  99   9.730   5.532   5.532
  719   2HE   MET  99           HE2      MET  99  10.488   7.099   7.099
  720   3HE   MET  99           HE1      MET  99   9.031   6.662   6.662
  721    H    TYR 100           HN       TYR 100  10.095   9.083   9.083
  722    HA   TYR 100           HA       TYR 100  12.070  11.133  11.133
  723   1HB   TYR 100           HB2      TYR 100  10.576   9.922   9.922
  724   2HB   TYR 100           HB1      TYR 100  11.836  11.142  11.142
  725    HD1  TYR 100           HD1      TYR 100  11.102   7.717   7.717
  726    HD2  TYR 100           HD2      TYR 100  14.171  10.688  10.688
  727    HE1  TYR 100           HE1      TYR 100  12.863   5.971   5.971
  728    HE2  TYR 100           HE2      TYR 100  15.936   8.943   8.943
  729    HH   TYR 100           HH       TYR 100  15.667   5.969   5.969
  730    HA   PRO 101           HA       PRO 101   8.965  14.215  14.215
  731   1HB   PRO 101           HB2      PRO 101   6.326  13.649  13.649
  732   2HB   PRO 101           HB1      PRO 101   7.508  13.241  13.241
  733   1HG   PRO 101           HG2      PRO 101   6.130  11.483  11.483
  734   2HG   PRO 101           HG1      PRO 101   6.848  11.112  11.112
  735   1HD   PRO 101           HD2      PRO 101   7.967  10.610  10.610
  736   2HD   PRO 101           HD1      PRO 101   8.715  10.349  10.349
  737    HA   PRO 102           HA       PRO 102   7.613  14.963  14.963
  738   1HB   PRO 102           HB2      PRO 102   8.626  17.533  17.533
  739   2HB   PRO 102           HB1      PRO 102   9.669  16.069  16.069
  740   1HG   PRO 102           HG2      PRO 102   9.367  18.029  18.029
  741   2HG   PRO 102           HG1      PRO 102  10.759  17.036  17.036
  742   1HD   PRO 102           HD2      PRO 102   8.986  16.575  16.575
  743   2HD   PRO 102           HD1      PRO 102  10.197  15.468  15.468
  744    HA   PRO 103           HA       PRO 103   7.219  16.205  16.205
  745   1HB   PRO 103           HB2      PRO 103   5.474  15.847  15.847
  746   2HB   PRO 103           HB1      PRO 103   6.546  17.222  17.222
  747   1HG   PRO 103           HG2      PRO 103   3.800  17.458  17.458
  748   2HG   PRO 103           HG1      PRO 103   4.924  18.579  18.579
  749   1HD   PRO 103           HD2      PRO 103   3.870  16.105  16.105
  750   2HD   PRO 103           HD1      PRO 103   3.447  17.764  17.764
  751    H    TYR 104           HN       TYR 104   6.767  14.116  14.116
  752    HA   TYR 104           HA       TYR 104   5.607  12.030  12.030
  753   1HB   TYR 104           HB2      TYR 104   7.725  11.501  11.501
  754   2HB   TYR 104           HB1      TYR 104   7.351  12.244  12.244
  755    HD1  TYR 104           HD2      TYR 104   5.294   9.750   9.750
  756    HD2  TYR 104           HD1      TYR 104   7.756  10.480  10.480
  757    HE1  TYR 104           HE2      TYR 104   4.711   7.478   7.478
  758    HE2  TYR 104           HE1      TYR 104   7.191   8.188   8.188
  759    HH   TYR 104           HH       TYR 104   6.222   6.089   6.089
  760    H    TYR 105           HN       TYR 105   3.469  11.224  11.224
  761    HA   TYR 105           HA       TYR 105   2.358  10.951  10.951
  762   1HB   TYR 105           HB2      TYR 105   1.910  13.297  13.297
  763   2HB   TYR 105           HB1      TYR 105   1.083  12.720  12.720
  764    HD1  TYR 105           HD1      TYR 105  -0.988  11.362  11.362
  765    HD2  TYR 105           HD2      TYR 105   0.850  13.295  13.295
  766    HE1  TYR 105           HE1      TYR 105  -3.140  11.148  11.148
  767    HE2  TYR 105           HE2      TYR 105  -1.279  13.079  13.079
  768    HH   TYR 105           HH       TYR 105  -3.608  11.099  11.099
  769    H    LEU 106           HN       LEU 106   1.710   8.828   8.828
  770    HA   LEU 106           HA       LEU 106  -0.298   8.190   8.190
  771   1HB   LEU 106           HB2      LEU 106   2.418   7.843   7.843
  772   2HB   LEU 106           HB1      LEU 106   1.892   6.236   6.236
  773    HG   LEU 106           HG       LEU 106   1.598   6.458   6.458
  774   1HD1  LEU 106          HD12      LEU 106  -1.011   6.601   6.601
  775   2HD1  LEU 106          HD11      LEU 106  -0.926   6.243   6.243
  776   3HD1  LEU 106          HD13      LEU 106  -0.166   5.160   5.160
  777   1HD2  LEU 106          HD21      LEU 106   1.462   9.030   9.030
  778   2HD2  LEU 106          HD23      LEU 106   0.460   8.270   8.270
  779   3HD2  LEU 106          HD22      LEU 106  -0.261   8.788   8.788
  780    H    GLY 108           HN       GLY 108   0.365   5.233   5.233
  781   1HA   GLY 108           HA2      GLY 108  -0.147   4.829   4.829
  782   2HA   GLY 108           HA1      GLY 108  -1.462   4.383   4.383
  783    H    ILE 109           HN       ILE 109  -0.538   2.322   2.322
  784    HA   ILE 109           HA       ILE 109   1.286   0.828   0.828
  785    HB   ILE 109           HB       ILE 109   0.906   0.636   0.636
  786   1HG1  ILE 109          HG12      ILE 109   1.993   2.749   2.749
  787   2HG1  ILE 109          HG11      ILE 109   3.145   1.653   1.653
  788   1HG2  ILE 109          HG22      ILE 109   2.869  -0.673  -0.673
  789   2HG2  ILE 109          HG21      ILE 109   2.937  -0.754  -0.754
  790   3HG2  ILE 109          HG23      ILE 109   1.575  -1.462  -1.462
  791   1HD1  ILE 109          HD11      ILE 109   3.195   1.113   1.113
  792   2HD1  ILE 109          HD13      ILE 109   3.275   2.861   2.861
  793   3HD1  ILE 109          HD12      ILE 109   4.465   1.833   1.833
  794    H    GLY 110           HN       GLY 110   0.872  -1.574  -1.574
  795   1HA   GLY 110           HA2      GLY 110  -2.046  -2.085  -2.085
  796   2HA   GLY 110           HA1      GLY 110  -0.844  -3.108  -3.108
  797    H    ASN 111           HN       ASN 111  -2.963  -3.547  -3.547
  798    HA   ASN 111           HA       ASN 111  -1.716  -4.149  -4.149
  799   1HB   ASN 111           HB2      ASN 111  -4.087  -5.312  -5.312
  800   2HB   ASN 111           HB1      ASN 111  -3.715  -5.718  -5.718
  801    HD2  ASN 111          HD22      ASN 111  -3.135  -2.114  -2.114
  802    H    GLY 112           HN       GLY 112  -1.724  -5.883  -5.883
  803   1HA   GLY 112           HA2      GLY 112   0.102  -7.467  -7.467
  804   2HA   GLY 112           HA1      GLY 112  -0.040  -8.007  -8.007
  805    H    THR 113           HN       THR 113  -0.397  -9.257  -9.257
  806    HA   THR 113           HA       THR 113  -3.126 -10.440 -10.440
  807    HB   THR 113           HB       THR 113  -1.192 -10.419 -10.419
  808    HG1  THR 113           HG1      THR 113  -3.590  -8.994  -8.994
  809   1HG2  THR 113          HG21      THR 113  -3.960 -11.568 -11.568
  810   2HG2  THR 113          HG23      THR 113  -3.349 -11.137 -11.137
  811   3HG2  THR 113          HG22      THR 113  -2.520 -12.376 -12.376
  812    H    GLN 114           HN       GLN 114  -3.212 -12.550 -12.550
  813    HA   GLN 114           HA       GLN 114  -0.716 -14.061 -14.061
  814   1HB   GLN 114           HB2      GLN 114  -2.811 -14.047 -14.047
  815   2HB   GLN 114           HB1      GLN 114  -3.598 -15.011 -15.011
  816   1HG   GLN 114           HG2      GLN 114  -2.751 -16.620 -16.620
  817   2HG   GLN 114           HG1      GLN 114  -1.561 -16.584 -16.584
  818   1HE2  GLN 114          HE22      GLN 114   0.747 -16.254 -16.254
  819   2HE2  GLN 114          HE21      GLN 114   0.057 -17.360 -17.360
  820    H    ILE 115           HN       ILE 115  -0.126 -15.926 -15.926
  821    HA   ILE 115           HA       ILE 115  -1.735 -16.242 -16.242
  822    HB   ILE 115           HB       ILE 115   1.252 -16.478 -16.478
  823   1HG1  ILE 115          HG12      ILE 115  -0.412 -14.684 -14.684
  824   2HG1  ILE 115          HG11      ILE 115   0.418 -14.191 -14.191
  825   1HG2  ILE 115          HG22      ILE 115   0.494 -18.291 -18.291
  826   2HG2  ILE 115          HG21      ILE 115  -0.252 -17.083 -17.083
  827   3HG2  ILE 115          HG23      ILE 115   1.500 -17.112 -17.112
  828   1HD1  ILE 115          HD12      ILE 115   2.587 -14.891 -14.891
  829   2HD1  ILE 115          HD11      ILE 115   1.697 -15.176 -15.176
  830   3HD1  ILE 115          HD13      ILE 115   1.794 -13.545 -13.545
  831    H    TYR 116           HN       TYR 116  -2.568 -18.328 -18.328
  832    HA   TYR 116           HA       TYR 116  -1.625 -20.461 -20.461
  833   1HB   TYR 116           HB2      TYR 116  -4.218 -19.852 -19.852
  834   2HB   TYR 116           HB1      TYR 116  -3.924 -21.431 -21.431
  835    HD1  TYR 116           HD2      TYR 116  -2.576 -20.999 -20.999
  836    HD2  TYR 116           HD1      TYR 116  -5.638 -18.528 -18.528
  837    HE1  TYR 116           HE2      TYR 116  -3.220 -20.107 -20.107
  838    HE2  TYR 116           HE1      TYR 116  -6.267 -17.644 -17.644
  839    HH   TYR 116           HH       TYR 116  -5.246 -19.078 -19.078
  840    H    VAL 117           HN       VAL 117  -0.925 -22.424 -22.424
  841    HA   VAL 117           HA       VAL 117  -0.673 -22.636 -22.636
  842    HB   VAL 117           HB       VAL 117   0.533 -24.235 -24.235
  843   1HG1  VAL 117          HG11      VAL 117   0.216 -25.005 -25.005
  844   2HG1  VAL 117          HG13      VAL 117   1.864 -24.370 -24.370
  845   3HG1  VAL 117          HG12      VAL 117   1.376 -25.679 -25.679
  846   1HG2  VAL 117          HG21      VAL 117   1.707 -22.112 -22.112
  847   2HG2  VAL 117          HG23      VAL 117   1.357 -21.919 -21.919
  848   3HG2  VAL 117          HG22      VAL 117   2.614 -23.039 -23.039
  849    H    ILE 118           HN       ILE 118  -1.562 -24.412 -24.412
  850    HA   ILE 118           HA       ILE 118  -3.968 -25.563 -25.563
  851    HB   ILE 118           HB       ILE 118  -2.480 -25.975 -25.975
  852   1HG1  ILE 118          HG12      ILE 118  -3.132 -23.666 -23.666
  853   2HG1  ILE 118          HG11      ILE 118  -4.246 -24.432 -24.432
  854   1HG2  ILE 118          HG23      ILE 118  -5.217 -26.838 -26.838
  855   2HG2  ILE 118          HG22      ILE 118  -4.845 -26.651 -26.651
  856   3HG2  ILE 118          HG21      ILE 118  -3.956 -27.823 -27.823
  857   1HD1  ILE 118          HD13      ILE 118  -5.525 -24.890 -24.890
  858   2HD1  ILE 118          HD12      ILE 118  -4.747 -23.347 -23.347
  859   3HD1  ILE 118          HD11      ILE 118  -5.841 -23.489 -23.489
  860    H    ASP 119           HN       ASP 119  -4.125 -27.542 -27.542
  861    HA   ASP 119           HA       ASP 119  -1.708 -29.268 -29.268
  862   1HB   ASP 119           HB2      ASP 119  -2.888 -28.464 -28.464
  863   2HB   ASP 119           HB1      ASP 119  -4.342 -29.304 -29.304
  864    HA   PRO 120           HA       PRO 120  -3.788 -31.927 -31.927
  865   1HB   PRO 120           HB2      PRO 120  -2.000 -34.002 -34.002
  866   2HB   PRO 120           HB1      PRO 120  -1.707 -32.498 -32.498
  867   1HG   PRO 120           HG2      PRO 120  -0.685 -33.336 -33.336
  868   2HG   PRO 120           HG1      PRO 120   0.151 -32.493 -32.493
  869   1HD   PRO 120           HD2      PRO 120  -0.799 -31.216 -31.216
  870   2HD   PRO 120           HD1      PRO 120  -0.696 -30.443 -30.443
  871    H    GLU 121           HN       GLU 121  -5.062 -33.860 -33.860
  872    HA   GLU 121           HA       GLU 121  -5.258 -35.045 -35.045
  873   1HB   GLU 121           HB2      GLU 121  -7.362 -34.459 -34.459
  874   2HB   GLU 121           HB1      GLU 121  -7.686 -35.282 -35.282
  875   1HG   GLU 121           HG2      GLU 121  -6.945 -33.323 -33.323
  876   2HG   GLU 121           HG1      GLU 121  -6.503 -32.500 -32.500
  877    HA   PRO 122           HA       PRO 122  -4.486 -38.934 -38.934
  878   1HB   PRO 122           HB2      PRO 122  -5.802 -40.628 -40.628
  879   2HB   PRO 122           HB1      PRO 122  -4.253 -39.858 -39.858
  880   1HG   PRO 122           HG2      PRO 122  -7.014 -39.089 -39.089
  881   2HG   PRO 122           HG1      PRO 122  -5.518 -39.102 -39.102
  882   1HD   PRO 122           HD2      PRO 122  -6.574 -36.834 -36.834
  883   2HD   PRO 122           HD1      PRO 122  -4.825 -37.068 -37.068
  884    H    CYS 123           HN       CYS 123  -7.648 -37.618 -37.618
  885    HA   CYS 123           HA       CYS 123  -9.050 -39.839 -39.839
  886   1HB   CYS 123           HB2      CYS 123 -10.058 -38.355 -38.355
  887   2HB   CYS 123           HB1      CYS 123  -9.870 -36.986 -36.986
  888    HG   CYS 123           HG       CYS 123 -11.804 -39.388 -39.388
  889    HA   PRO 124           HA       PRO 124  -7.891 -38.316 -38.316
  890   1HB   PRO 124           HB2      PRO 124  -9.647 -39.798 -39.798
  891   2HB   PRO 124           HB1      PRO 124  -8.152 -40.464 -40.464
  892   1HG   PRO 124           HG2      PRO 124 -10.951 -40.657 -40.657
  893   2HG   PRO 124           HG1      PRO 124  -9.690 -41.900 -41.900
  894   1HD   PRO 124           HD2      PRO 124 -10.296 -40.587 -40.587
  895   2HD   PRO 124           HD1      PRO 124  -8.647 -41.143 -41.143
  896    H    ASP 125           HN       ASP 125 -10.988 -37.977 -37.977
  897    HA   ASP 125           HA       ASP 125 -12.308 -36.542 -36.542
  898   1HB   ASP 125           HB2      ASP 125 -13.989 -36.125 -36.125
  899   2HB   ASP 125           HB1      ASP 125 -13.472 -37.808 -37.808
  900    H    SER 126           HN       SER 126 -13.053 -34.205 -34.205
  901    HA   SER 126           HA       SER 126 -10.739 -32.492 -32.492
  902   1HB   SER 126           HB2      SER 126 -12.401 -30.725 -30.725
  903   2HB   SER 126           HB1      SER 126 -12.678 -32.078 -32.078
  904    HG   SER 126           HG       SER 126 -14.604 -32.121 -32.121
  905    H    ASP 127           HN       ASP 127 -10.574 -30.757 -30.757
  906    HA   ASP 127           HA       ASP 127 -10.878 -31.659 -31.659
  907   1HB   ASP 127           HB2      ASP 127  -9.259 -29.960 -29.960
  908   2HB   ASP 127           HB1      ASP 127 -10.593 -28.809 -28.809
  909    H    GLN 128           HN       GLN 128 -12.876 -29.550 -29.550
  910    HA   GLN 128           HA       GLN 128 -15.074 -29.774 -29.774
  911   1HB   GLN 128           HB2      GLN 128 -13.673 -27.662 -27.662
  912   2HB   GLN 128           HB1      GLN 128 -14.239 -27.191 -27.191
  913   1HG   GLN 128           HG2      GLN 128 -16.589 -27.386 -27.386
  914   2HG   GLN 128           HG1      GLN 128 -15.972 -27.740 -27.740
  915   1HE2  GLN 128          HE22      GLN 128 -16.195 -24.234 -24.234
  916   2HE2  GLN 128          HE21      GLN 128 -16.861 -25.749 -25.749
  917    H    GLU 129           HN       GLU 129 -17.206 -29.224 -29.224
  918    HA   GLU 129           HA       GLU 129 -18.804 -29.499 -29.499
  919   1HB   GLU 129           HB2      GLU 129 -16.510 -28.210 -28.210
  920   2HB   GLU 129           HB1      GLU 129 -18.153 -28.353 -28.353
  921   1HG   GLU 129           HG2      GLU 129 -17.399 -26.938 -26.938
  922   2HG   GLU 129           HG1      GLU 129 -17.721 -26.130 -26.130
  923    HA   PRO 130           HA       PRO 130 -16.241 -33.122 -33.122
  924   1HB   PRO 130           HB2      PRO 130 -17.263 -35.135 -35.135
  925   2HB   PRO 130           HB1      PRO 130 -15.806 -34.221 -34.221
  926   1HG   PRO 130           HG2      PRO 130 -18.603 -33.907 -33.907
  927   2HG   PRO 130           HG1      PRO 130 -17.078 -33.815 -33.815
  928   1HD   PRO 130           HD2      PRO 130 -18.471 -31.617 -31.617
  929   2HD   PRO 130           HD1      PRO 130 -16.701 -31.632 -31.632
  930    H    LYS 131           HN       LYS 131 -17.205 -34.798 -34.798
  931    HA   LYS 131           HA       LYS 131 -19.873 -34.127 -34.127
  932   1HB   LYS 131           HB2      LYS 131 -17.912 -36.361 -36.361
  933   2HB   LYS 131           HB1      LYS 131 -19.362 -36.022 -36.022
  934   1HG   LYS 131           HG2      LYS 131 -18.516 -33.712 -33.712
  935   2HG   LYS 131           HG1      LYS 131 -17.033 -34.133 -34.133
  936   1HD   LYS 131           HD2      LYS 131 -18.045 -35.691 -35.691
  937   2HD   LYS 131           HD1      LYS 131 -16.921 -34.339 -34.339
  938   1HE   LYS 131           HE2      LYS 131 -16.371 -36.706 -36.706
  939   2HE   LYS 131           HE1      LYS 131 -15.823 -36.643 -36.643
  940   1HZ   LYS 131           HZ1      LYS 131 -14.904 -34.379 -34.379
  941   2HZ   LYS 131           HZ3      LYS 131 -15.165 -34.762 -34.762
  942   3HZ   LYS 131           HZ2      LYS 131 -14.093 -35.696 -35.696
  943    H1   NAG 132           H1       NAG 132  -3.567  -3.611  -3.611
  944    H2   NAG 132           H2       NAG 132  -2.359  -0.830  -0.830
  945    H3   NAG 132           H3       NAG 132  -2.128  -2.570  -2.570
  946    H4   NAG 132           H4       NAG 132  -3.709   0.025   0.025
  947    H5   NAG 132           H5       NAG 132  -4.786  -2.830  -2.830
  948   1H6   NAG 132           H61      NAG 132  -5.922  -0.193  -0.193
  949   2H6   NAG 132           H62      NAG 132  -6.707  -1.032  -1.032
  950   1H8   NAG 132           H81      NAG 132   0.718  -3.341  -3.341
  951   2H8   NAG 132           H82      NAG 132  -0.005  -1.916  -1.916
  952   3H8   NAG 132           H83      NAG 132   1.584  -1.775  -1.775
  953    HN2  NAG 132           HN2      NAG 132  -1.147  -3.483  -3.483
  954    HO3  NAG 132           HO3      NAG 132  -1.064  -0.767  -0.767
  955    H1   NAG 133           H1       NAG 133  -4.269   0.745   0.745
  956    H2   NAG 133           H2       NAG 133  -1.768  -0.711  -0.711
  957    H3   NAG 133           H3       NAG 133  -3.102   1.802   1.802
  958    H4   NAG 133           H4       NAG 133  -0.428   1.593   1.593
  959    H5   NAG 133           H5       NAG 133  -3.052   2.856   2.856
  960   1H6   NAG 133           H61      NAG 133  -0.340   2.527   2.527
  961   2H6   NAG 133           H62      NAG 133  -1.141   4.040   4.040
  962   1H8   NAG 133           H81      NAG 133  -6.711  -1.025  -1.025
  963   2H8   NAG 133           H82      NAG 133  -6.369  -0.140  -0.140
  964   3H8   NAG 133           H83      NAG 133  -5.724  -1.792  -1.792
  965    HN2  NAG 133           HN2      NAG 133  -3.317  -1.687  -1.687
  966    HO3  NAG 133           HO3      NAG 133  -0.675   0.421   0.421
  967    HO6  NAG 133           HO6      NAG 133  -1.700   2.338   2.338
  968    H1   FUC 134           H1       FUC 134  -7.910  -2.153  -2.153
  969    H2   FUC 134           H2       FUC 134  -7.206  -4.499  -4.499
  970    H3   FUC 134           H3       FUC 134  -9.820  -4.732  -4.732
  971    H4   FUC 134           H4       FUC 134  -8.602  -6.507  -6.507
  972    H5   FUC 134           H5       FUC 134  -8.348  -4.080  -4.080
  973   1H6   FUC 134           H61      FUC 134  -7.037  -4.992  -4.992
  974   2H6   FUC 134           H62      FUC 134  -6.500  -6.269  -6.269
  975   3H6   FUC 134           H63      FUC 134  -5.650  -4.695  -4.695
  976    HO2  FUC 134           HO2      FUC 134  -9.597  -2.963  -2.963
  977    HO3  FUC 134           HO3      FUC 134 -10.106  -6.178  -6.178
  978    HO4  FUC 134           HO4      FUC 134  -7.064  -7.379  -7.379
  979    H1   MAN 135           H1       MAN 135   0.748   2.776   2.776
  980    H2   MAN 135           H2       MAN 135   0.722   3.825   3.825
  981    H3   MAN 135           H3       MAN 135   2.805   4.071   4.071
  982    H4   MAN 135           H4       MAN 135   1.694   6.660   6.660
  983    H5   MAN 135           H5       MAN 135   2.206   3.970   3.970
  984   1H6   MAN 135           H61      MAN 135   1.168   6.651   6.651
  985   2H6   MAN 135           H62      MAN 135   0.882   5.131   5.131
  986    HO2  MAN 135           HO2      MAN 135  -0.076   6.202   6.202
  987    HO3  MAN 135           HO3      MAN 135   3.007   5.261   5.261
  988    HO4  MAN 135           HO4      MAN 135   4.119   5.210   5.210
  989    HO6  MAN 135           HO6      MAN 135   3.384   6.378   6.378
  990    H1   NAG 136           H1       NAG 136  -0.147  -9.434  -9.434
  991    H2   NAG 136           H2       NAG 136  -3.078  -9.150  -9.150
  992    H3   NAG 136           H3       NAG 136  -1.216 -11.578 -11.578
  993    H4   NAG 136           H4       NAG 136  -2.161  -9.661  -9.661
  994    H5   NAG 136           H5       NAG 136   0.585  -9.824  -9.824
  995   1H6   NAG 136           H61      NAG 136   1.261  -8.500  -8.500
  996   2H6   NAG 136           H62      NAG 136  -0.098  -9.181  -9.181
  997   1H8   NAG 136           H81      NAG 136  -5.329 -11.411 -11.411
  998   2H8   NAG 136           H82      NAG 136  -3.932 -12.151 -12.151
  999   3H8   NAG 136           H83      NAG 136  -4.980 -10.989 -10.989
 1000    HN2  NAG 136           HN2      NAG 136  -1.921 -11.049 -11.049
 1001    HO3  NAG 136           HO3      NAG 136  -2.947 -12.472 -12.472
 1002    H1   NAG 137           H1       NAG 137   0.789 -10.894 -10.894
 1003    H2   NAG 137           H2       NAG 137  -0.269 -13.627 -13.627
 1004    H3   NAG 137           H3       NAG 137   2.644 -12.789 -12.789
 1005    H4   NAG 137           H4       NAG 137   1.314 -13.478 -13.478
 1006    H5   NAG 137           H5       NAG 137   2.205 -10.719 -10.719
 1007   1H6   NAG 137           H61      NAG 137   0.987 -11.740 -11.740
 1008   2H6   NAG 137           H62      NAG 137   2.446 -10.746 -10.746
 1009   1H8   NAG 137           H81      NAG 137   1.159 -15.712 -15.712
 1010   2H8   NAG 137           H82      NAG 137   0.429 -16.029 -16.029
 1011   3H8   NAG 137           H83      NAG 137  -0.531 -16.285 -16.285
 1012    HN2  NAG 137           HN2      NAG 137   1.128 -12.787 -12.787
 1013    HO3  NAG 137           HO3      NAG 137   1.489 -15.173 -15.173
 1014    HO6  NAG 137           HO6      NAG 137   1.221  -9.014  -9.014
 1015    H1   FUC 138           H1       FUC 138  -1.730  -7.730  -7.730
 1016    H2   FUC 138           H2       FUC 138  -1.532  -5.014  -5.014
 1017    H3   FUC 138           H3       FUC 138  -0.188  -4.872  -4.872
 1018    H4   FUC 138           H4       FUC 138   1.799  -4.288  -4.288
 1019    H5   FUC 138           H5       FUC 138   1.599  -6.887  -6.887
 1020   1H6   FUC 138           H61      FUC 138   2.464  -7.626  -7.626
 1021   2H6   FUC 138           H62      FUC 138   3.221  -6.051  -6.051
 1022   3H6   FUC 138           H63      FUC 138   1.900  -6.134  -6.134
 1023    HO2  FUC 138           HO2      FUC 138  -3.339  -5.886  -5.886
 1024    HO3  FUC 138           HO3      FUC 138  -1.551  -3.188  -3.188
 1025    HO4  FUC 138           HO4      FUC 138   1.494  -3.876  -3.876
 1026    H1   MAN 139           H1       MAN 139   2.558 -12.951 -12.951
 1027    H2   MAN 139           H2       MAN 139   4.352 -11.199 -11.199
 1028    H3   MAN 139           H3       MAN 139   4.116 -12.219 -12.219
 1029    H4   MAN 139           H4       MAN 139   6.124 -14.318 -14.318
 1030    H5   MAN 139           H5       MAN 139   3.123 -14.636 -14.636
 1031   1H6   MAN 139           H61      MAN 139   5.289 -16.447 -16.447
 1032   2H6   MAN 139           H62      MAN 139   3.713 -16.779 -16.779
 1033    HO2  MAN 139           HO2      MAN 139   6.190 -13.327 -13.327
 1034    HO3  MAN 139           HO3      MAN 139   6.797 -11.902 -11.902
 1035    HO4  MAN 139           HO4      MAN 139   5.839 -13.580 -13.580
 1036    HO6  MAN 139           HO6      MAN 139   4.247 -16.486 -16.486

  Start of MODEL   11
    1   1H    ALA   1           HT3      ALA   1  -5.841  10.265  10.265
    2   2H    ALA   1           HT2      ALA   1  -7.218  11.130  11.130
    3   3H    ALA   1           HT1      ALA   1  -6.913   9.583   9.583
    4    HA   ALA   1           HA       ALA   1  -8.663   9.505   9.505
    5   1HB   ALA   1           HB2      ALA   1  -6.553  11.129  11.129
    6   2HB   ALA   1           HB1      ALA   1  -7.339   9.964   9.964
    7   3HB   ALA   1           HB3      ALA   1  -8.302  11.179  11.179
    8    H    MET   1           HN       MET   1  -5.450   8.973   8.973
    9    HA   MET   1           HA       MET   1  -4.402   6.983   6.983
   10   1HB   MET   1           HB2      MET   1  -5.802   6.084   6.084
   11   2HB   MET   1           HB1      MET   1  -4.531   5.169   5.169
   12   1HG   MET   1           HG2      MET   1  -4.222   8.005   8.005
   13   2HG   MET   1           HG1      MET   1  -3.649   6.564   6.564
   14   1HE   MET   1           HE1      MET   1  -1.893   8.293   8.293
   15   2HE   MET   1           HE3      MET   1  -0.655   7.061   7.061
   16   3HE   MET   1           HE2      MET   1  -0.656   8.545   8.545
   17    H    HIS   2           HN       HIS   2  -5.873   6.874   6.874
   18    HA   HIS   2           HA       HIS   2  -8.024   4.802   4.802
   19   1HB   HIS   2           HB2      HIS   2  -7.491   7.010   7.010
   20   2HB   HIS   2           HB1      HIS   2  -8.841   5.879   5.879
   21    HD1  HIS   2           HD1      HIS   2 -10.594   5.973   5.973
   22    HD2  HIS   2           HD2      HIS   2  -7.885   9.138   9.138
   23    HE1  HIS   2           HE1      HIS   2 -11.523   7.784   7.784
   24    H    VAL   3           HN       VAL   3  -7.680   2.865   2.865
   25    HA   VAL   3           HA       VAL   3  -5.841   2.694   2.694
   26    HB   VAL   3           HB       VAL   3  -5.572   1.160   1.160
   27   1HG1  VAL   3          HG11      VAL   3  -4.604   0.617   0.617
   28   2HG1  VAL   3          HG13      VAL   3  -3.329   0.615   0.615
   29   3HG1  VAL   3          HG12      VAL   3  -4.715  -0.461  -0.461
   30   1HG2  VAL   3          HG22      VAL   3  -3.969   3.340   3.340
   31   2HG2  VAL   3          HG21      VAL   3  -4.601   3.304   3.304
   32   3HG2  VAL   3          HG23      VAL   3  -3.242   2.273   2.273
   33    H    ALA   4           HN       ALA   4  -6.282   0.804   0.804
   34    HA   ALA   4           HA       ALA   4  -8.693  -0.785  -0.785
   35   1HB   ALA   4           HB3      ALA   4  -8.647   1.187   1.187
   36   2HB   ALA   4           HB2      ALA   4  -8.335  -0.239  -0.239
   37   3HB   ALA   4           HB1      ALA   4  -9.793  -0.154  -0.154
   38    H    GLN   5           HN       GLN   5  -8.490  -2.960  -2.960
   39    HA   GLN   5           HA       GLN   5  -6.566  -4.092  -4.092
   40   1HB   GLN   5           HB2      GLN   5  -6.473  -4.396  -4.396
   41   2HB   GLN   5           HB1      GLN   5  -5.673  -5.531  -5.531
   42   1HG   GLN   5           HG2      GLN   5  -4.510  -3.528  -3.528
   43   2HG   GLN   5           HG1      GLN   5  -5.131  -2.577  -2.577
   44   1HE2  GLN   5          HE22      GLN   5  -2.026  -5.139  -5.139
   45   2HE2  GLN   5          HE21      GLN   5  -2.783  -5.018  -5.018
   46    HA   PRO   6           HA       PRO   6  -9.755  -7.206  -7.206
   47   1HB   PRO   6           HB2      PRO   6  -8.327  -9.287  -9.287
   48   2HB   PRO   6           HB1      PRO   6  -8.890  -7.914  -7.914
   49   1HG   PRO   6           HG2      PRO   6  -6.192  -8.450  -8.450
   50   2HG   PRO   6           HG1      PRO   6  -6.642  -7.761  -7.761
   51   1HD   PRO   6           HD2      PRO   6  -5.781  -6.259  -6.259
   52   2HD   PRO   6           HD1      PRO   6  -6.892  -5.649  -5.649
   53    H    ALA   7           HN       ALA   7 -10.416  -8.755  -8.755
   54    HA   ALA   7           HA       ALA   7  -8.801  -9.159  -9.159
   55   1HB   ALA   7           HB2      ALA   7 -11.315 -10.470 -10.470
   56   2HB   ALA   7           HB1      ALA   7 -10.680 -10.787 -10.787
   57   3HB   ALA   7           HB3      ALA   7 -11.218  -9.164  -9.164
   58    H    VAL   8           HN       VAL   8  -8.954 -10.931 -10.931
   59    HA   VAL   8           HA       VAL   8  -6.877 -12.701 -12.701
   60    HB   VAL   8           HB       VAL   8  -9.270 -13.485 -13.485
   61   1HG1  VAL   8          HG12      VAL   8  -9.490 -13.487 -13.487
   62   2HG1  VAL   8          HG11      VAL   8  -9.710 -15.126 -15.126
   63   3HG1  VAL   8          HG13      VAL   8 -10.726 -13.797 -13.797
   64   1HG2  VAL   8          HG23      VAL   8  -6.948 -14.774 -14.774
   65   2HG2  VAL   8          HG22      VAL   8  -8.439 -15.548 -15.548
   66   3HG2  VAL   8          HG21      VAL   8  -7.882 -15.657 -15.657
   67    H    VAL   9           HN       VAL   9  -6.056 -14.112 -14.112
   68    HA   VAL   9           HA       VAL   9  -6.631 -13.139 -13.139
   69    HB   VAL   9           HB       VAL   9  -4.020 -13.182 -13.182
   70   1HG1  VAL   9          HG12      VAL   9  -4.479 -13.326 -13.326
   71   2HG1  VAL   9          HG11      VAL   9  -3.063 -12.493 -12.493
   72   3HG1  VAL   9          HG13      VAL   9  -3.303 -14.208 -14.208
   73   1HG2  VAL   9          HG21      VAL   9  -5.699 -11.174 -11.174
   74   2HG2  VAL   9          HG23      VAL   9  -3.961 -10.908 -10.908
   75   3HG2  VAL   9          HG22      VAL   9  -4.953 -11.058 -11.058
   76    H    LEU  10           HN       LEU  10  -6.056 -14.678 -14.678
   77    HA   LEU  10           HA       LEU  10  -5.809 -17.480 -17.480
   78   1HB   LEU  10           HB2      LEU  10  -6.994 -16.313 -16.313
   79   2HB   LEU  10           HB1      LEU  10  -6.930 -18.038 -18.038
   80    HG   LEU  10           HG       LEU  10  -8.304 -15.955 -15.955
   81   1HD1  LEU  10          HD13      LEU  10  -9.453 -18.023 -18.023
   82   2HD1  LEU  10          HD12      LEU  10 -10.394 -16.989 -16.989
   83   3HD1  LEU  10          HD11      LEU  10  -9.468 -16.276 -16.276
   84   1HD2  LEU  10          HD21      LEU  10  -8.149 -18.983 -18.983
   85   2HD2  LEU  10          HD23      LEU  10  -7.561 -17.840 -17.840
   86   3HD2  LEU  10          HD22      LEU  10  -9.294 -18.025 -18.025
   87    H    ALA  11           HN       ALA  11  -3.959 -18.571 -18.571
   88    HA   ALA  11           HA       ALA  11  -2.065 -17.270 -17.270
   89   1HB   ALA  11           HB1      ALA  11  -1.388 -17.802 -17.802
   90   2HB   ALA  11           HB3      ALA  11  -1.723 -19.506 -19.506
   91   3HB   ALA  11           HB2      ALA  11  -0.423 -18.693 -18.693
   92    H    SER  12           HN       SER  12  -1.602 -18.198 -18.198
   93    HA   SER  12           HA       SER  12  -3.077 -20.493 -20.493
   94   1HB   SER  12           HB2      SER  12  -1.807 -20.064 -20.064
   95   2HB   SER  12           HB1      SER  12  -2.200 -18.505 -18.505
   96    HG   SER  12           HG       SER  12  -0.097 -18.273 -18.273
   97    H    SER  13           HN       SER  13  -1.697 -22.345 -22.345
   98    HA   SER  13           HA       SER  13  -0.417 -23.889 -23.889
   99   1HB   SER  13           HB2      SER  13   0.161 -25.353 -25.353
  100   2HB   SER  13           HB1      SER  13  -1.474 -24.729 -24.729
  101    HG   SER  13           HG       SER  13  -0.112 -24.579 -24.579
  102    H    ARG  14           HN       ARG  14   0.897 -21.690 -21.690
  103    HA   ARG  14           HA       ARG  14   3.673 -22.298 -22.298
  104   1HB   ARG  14           HB2      ARG  14   2.597 -20.899 -20.899
  105   2HB   ARG  14           HB1      ARG  14   2.312 -19.643 -19.643
  106   1HG   ARG  14           HG2      ARG  14   4.330 -18.977 -18.977
  107   2HG   ARG  14           HG1      ARG  14   4.858 -19.779 -19.779
  108   1HD   ARG  14           HD2      ARG  14   5.261 -21.863 -21.863
  109   2HD   ARG  14           HD1      ARG  14   4.721 -21.075 -21.075
  110    HE   ARG  14           HE       ARG  14   6.738 -19.457 -19.457
  111   1HH1  ARG  14          HH21      ARG  14   6.361 -22.474 -22.474
  112   2HH1  ARG  14          HH22      ARG  14   7.969 -22.425 -22.425
  113   1HH2  ARG  14          HH11      ARG  14   8.808 -19.436 -19.436
  114   2HH2  ARG  14          HH12      ARG  14   9.341 -20.725 -20.725
  115    H    GLY  15           HN       GLY  15   1.513 -20.291 -20.291
  116   1HA   GLY  15           HA2      GLY  15   1.931 -19.865 -19.865
  117   2HA   GLY  15           HA1      GLY  15   3.660 -20.040 -20.040
  118    H    ILE  16           HN       ILE  16   1.466 -18.155 -18.155
  119    HA   ILE  16           HA       ILE  16   3.029 -15.715 -15.715
  120    HB   ILE  16           HB       ILE  16   1.504 -16.713 -16.713
  121   1HG1  ILE  16          HG12      ILE  16   3.560 -16.320 -16.320
  122   2HG1  ILE  16          HG11      ILE  16   4.226 -15.387 -15.387
  123   1HG2  ILE  16          HG21      ILE  16   2.002 -13.875 -13.875
  124   2HG2  ILE  16          HG23      ILE  16   2.260 -14.298 -14.298
  125   3HG2  ILE  16          HG22      ILE  16   0.683 -14.559 -14.559
  126   1HD1  ILE  16          HD11      ILE  16   3.500 -18.297 -18.297
  127   2HD1  ILE  16          HD13      ILE  16   5.062 -17.815 -17.815
  128   3HD1  ILE  16          HD12      ILE  16   4.608 -17.310 -17.310
  129    H    ALA  17           HN       ALA  17   1.922 -14.834 -14.834
  130    HA   ALA  17           HA       ALA  17  -1.042 -14.461 -14.461
  131   1HB   ALA  17           HB1      ALA  17   0.868 -14.302 -14.302
  132   2HB   ALA  17           HB3      ALA  17  -0.873 -14.046 -14.046
  133   3HB   ALA  17           HB2      ALA  17  -0.240 -15.629 -15.629
  134    H    SER  18           HN       SER  18  -1.656 -12.414 -12.414
  135    HA   SER  18           HA       SER  18   0.140 -10.136 -10.136
  136   1HB   SER  18           HB2      SER  18   0.410 -10.828 -10.828
  137   2HB   SER  18           HB1      SER  18  -1.312 -10.572 -10.572
  138    HG   SER  18           HG       SER  18   0.655  -8.799  -8.799
  139    H    PHE  19           HN       PHE  19  -0.895  -8.485  -8.485
  140    HA   PHE  19           HA       PHE  19  -3.775  -7.997  -7.997
  141   1HB   PHE  19           HB2      PHE  19  -4.154  -7.853  -7.853
  142   2HB   PHE  19           HB1      PHE  19  -3.780  -9.470  -9.470
  143    HD1  PHE  19           HD2      PHE  19  -1.502 -10.451 -10.451
  144    HD2  PHE  19           HD1      PHE  19  -2.666  -6.649  -6.649
  145    HE1  PHE  19           HE2      PHE  19   0.422 -10.583 -10.583
  146    HE2  PHE  19           HE1      PHE  19  -0.740  -6.782  -6.782
  147    HZ   PHE  19           HZ       PHE  19   0.799  -8.757  -8.757
  148    H    VAL  20           HN       VAL  20  -4.409  -5.809  -5.809
  149    HA   VAL  20           HA       VAL  20  -2.038  -3.984  -3.984
  150    HB   VAL  20           HB       VAL  20  -4.802  -3.630  -3.630
  151   1HG1  VAL  20          HG11      VAL  20  -3.843  -1.501  -1.501
  152   2HG1  VAL  20          HG13      VAL  20  -2.395  -1.789  -1.789
  153   3HG1  VAL  20          HG12      VAL  20  -3.946  -1.517  -1.517
  154   1HG2  VAL  20          HG21      VAL  20  -3.206  -5.183  -5.183
  155   2HG2  VAL  20          HG23      VAL  20  -3.715  -3.789  -3.789
  156   3HG2  VAL  20          HG22      VAL  20  -2.121  -3.807  -3.807
  157    H    CYS  21           HN       CYS  21  -1.813  -2.798  -2.798
  158    HA   CYS  21           HA       CYS  21  -4.165  -2.424  -2.424
  159   1HB   CYS  21           HB2      CYS  21  -2.087  -3.629  -3.629
  160   2HB   CYS  21           HB1      CYS  21  -1.174  -2.153  -2.153
  161    H    GLU  22           HN       GLU  22  -5.093  -0.444  -0.444
  162    HA   GLU  22           HA       GLU  22  -3.430   1.730   1.730
  163   1HB   GLU  22           HB2      GLU  22  -5.545   2.827   2.827
  164   2HB   GLU  22           HB1      GLU  22  -5.733   1.127   1.127
  165   1HG   GLU  22           HG2      GLU  22  -6.638   0.714   0.714
  166   2HG   GLU  22           HG1      GLU  22  -6.576   2.446   2.446
  167    H    TYR  23           HN       TYR  23  -3.141   3.788   3.788
  168    HA   TYR  23           HA       TYR  23  -3.788   3.956   3.956
  169   1HB   TYR  23           HB2      TYR  23  -1.458   4.462   4.462
  170   2HB   TYR  23           HB1      TYR  23  -1.493   2.973   2.973
  171    HD1  TYR  23           HD1      TYR  23  -0.786   2.953   2.953
  172    HD2  TYR  23           HD2      TYR  23  -0.518   6.527   6.527
  173    HE1  TYR  23           HE1      TYR  23   0.729   3.993   3.993
  174    HE2  TYR  23           HE2      TYR  23   0.996   7.567   7.567
  175    HH   TYR  23           HH       TYR  23   2.703   6.343   6.343
  176    H    ALA  24           HN       ALA  24  -3.005   6.317   6.317
  177    HA   ALA  24           HA       ALA  24  -3.693   8.261   8.261
  178   1HB   ALA  24           HB1      ALA  24  -4.729   8.035   8.035
  179   2HB   ALA  24           HB3      ALA  24  -4.994   9.454   9.454
  180   3HB   ALA  24           HB2      ALA  24  -5.660   7.893   7.893
  181    H    SER  25           HN       SER  25  -2.176   9.865   9.865
  182    HA   SER  25           HA       SER  25  -0.651  10.662  10.662
  183   1HB   SER  25           HB2      SER  25   1.423  10.506  10.506
  184   2HB   SER  25           HB1      SER  25   0.592   8.953   8.953
  185    HG   SER  25           HG       SER  25  -0.251   9.489   9.489
  186    HA   PRO  26           HA       PRO  26  -1.502  14.678  14.678
  187   1HB   PRO  26           HB2      PRO  26   0.408  16.152  16.152
  188   2HB   PRO  26           HB1      PRO  26  -1.046  15.536  15.536
  189   1HG   PRO  26           HG2      PRO  26   1.737  14.496  14.496
  190   2HG   PRO  26           HG1      PRO  26   0.529  14.563  14.563
  191   1HD   PRO  26           HD2      PRO  26   1.135  12.298  12.298
  192   2HD   PRO  26           HD1      PRO  26  -0.426  12.586  12.586
  193    H    GLY  27           HN       GLY  27  -0.814  15.840  15.840
  194   1HA   GLY  27           HA2      GLY  27   0.482  16.375  16.375
  195   2HA   GLY  27           HA1      GLY  27   1.844  16.407  16.407
  196    H    LYS  28           HN       LYS  28   3.155  15.484  15.484
  197    HA   LYS  28           HA       LYS  28   2.762  12.522  12.522
  198   1HB   LYS  28           HB2      LYS  28   3.648  14.580  14.580
  199   2HB   LYS  28           HB1      LYS  28   3.656  12.838  12.838
  200   1HG   LYS  28           HG2      LYS  28   1.235  12.741  12.741
  201   2HG   LYS  28           HG1      LYS  28   1.201  14.467  14.467
  202   1HD   LYS  28           HD2      LYS  28   0.528  14.167  14.167
  203   2HD   LYS  28           HD1      LYS  28   2.135  14.896  14.896
  204   1HE   LYS  28           HE2      LYS  28   3.166  12.692  12.692
  205   2HE   LYS  28           HE1      LYS  28   1.562  11.931  11.931
  206   1HZ   LYS  28           HZ2      LYS  28   0.888  13.413  13.413
  207   2HZ   LYS  28           HZ1      LYS  28   2.454  14.070  14.070
  208   3HZ   LYS  28           HZ3      LYS  28   2.203  12.443  12.443
  209    H    ALA  29           HN       ALA  29   4.722  11.304  11.304
  210    HA   ALA  29           HA       ALA  29   7.302  12.748  12.748
  211   1HB   ALA  29           HB1      ALA  29   5.947  10.989  10.989
  212   2HB   ALA  29           HB3      ALA  29   7.673  11.347  11.347
  213   3HB   ALA  29           HB2      ALA  29   6.497  12.653  12.653
  214    H    THR  30           HN       THR  30   9.140  11.304  11.304
  215    HA   THR  30           HA       THR  30   8.585   9.067   9.067
  216    HB   THR  30           HB       THR  30  11.055   8.941   8.941
  217    HG1  THR  30           HG1      THR  30  12.236  10.203  10.203
  218   1HG2  THR  30          HG23      THR  30   9.546  11.370  11.370
  219   2HG2  THR  30          HG22      THR  30  11.248  11.679  11.679
  220   3HG2  THR  30          HG21      THR  30  10.798  10.587  10.587
  221    H    GLU  31           HN       GLU  31  10.002   9.477   9.477
  222    HA   GLU  31           HA       GLU  31  10.522   6.645   6.645
  223   1HB   GLU  31           HB2      GLU  31  10.462   8.942   8.942
  224   2HB   GLU  31           HB1      GLU  31  11.260   7.392   7.392
  225   1HG   GLU  31           HG2      GLU  31  11.999   9.028   9.028
  226   2HG   GLU  31           HG1      GLU  31  12.634   9.500   9.500
  227    H    VAL  32           HN       VAL  32   8.905   5.233   5.233
  228    HA   VAL  32           HA       VAL  32   6.841   5.948   5.948
  229    HB   VAL  32           HB       VAL  32   6.512   4.369   4.369
  230   1HG1  VAL  32          HG11      VAL  32   5.173   3.746   3.746
  231   2HG1  VAL  32          HG13      VAL  32   4.252   5.197   5.197
  232   3HG1  VAL  32          HG12      VAL  32   4.326   3.861   3.861
  233   1HG2  VAL  32          HG23      VAL  32   5.916   7.166   7.166
  234   2HG2  VAL  32          HG22      VAL  32   6.377   6.551   6.551
  235   3HG2  VAL  32          HG21      VAL  32   4.718   6.363   6.363
  236    H    ARG  33           HN       ARG  33   8.250   4.880   4.880
  237    HA   ARG  33           HA       ARG  33   9.456   2.336   2.336
  238   1HB   ARG  33           HB2      ARG  33   9.792   4.099   4.099
  239   2HB   ARG  33           HB1      ARG  33   8.309   3.495   3.495
  240   1HG   ARG  33           HG2      ARG  33   9.261   1.298   1.298
  241   2HG   ARG  33           HG1      ARG  33  10.681   1.733   1.733
  242   1HD   ARG  33           HD2      ARG  33  11.269   3.452   3.452
  243   2HD   ARG  33           HD1      ARG  33   9.896   2.895   2.895
  244    HE   ARG  33           HE       ARG  33  11.093   0.915   0.915
  245   1HH1  ARG  33          HH21      ARG  33  12.596   2.602   2.602
  246   2HH1  ARG  33          HH22      ARG  33  13.983   1.570   1.570
  247   1HH2  ARG  33          HH11      ARG  33  12.906  -0.395  -0.395
  248   2HH2  ARG  33          HH12      ARG  33  14.158  -0.109  -0.109
  249    H    VAL  34           HN       VAL  34   8.345   0.536   0.536
  250    HA   VAL  34           HA       VAL  34   5.713   0.003   0.003
  251    HB   VAL  34           HB       VAL  34   5.281  -1.381  -1.381
  252   1HG1  VAL  34          HG11      VAL  34   5.810   1.538   1.538
  253   2HG1  VAL  34          HG13      VAL  34   5.546   0.765   0.765
  254   3HG1  VAL  34          HG12      VAL  34   4.314   0.658   0.658
  255   1HG2  VAL  34          HG23      VAL  34   7.654  -1.887  -1.887
  256   2HG2  VAL  34          HG22      VAL  34   6.779  -1.218  -1.218
  257   3HG2  VAL  34          HG21      VAL  34   7.887  -0.201  -0.201
  258    H    THR  35           HN       THR  35   5.649  -1.690  -1.690
  259    HA   THR  35           HA       THR  35   7.724  -3.835  -3.835
  260    HB   THR  35           HB       THR  35   6.652  -2.545  -2.545
  261    HG1  THR  35           HG1      THR  35   9.127  -2.416  -2.416
  262   1HG2  THR  35          HG21      THR  35   8.180  -5.014  -5.014
  263   2HG2  THR  35          HG23      THR  35   8.844  -3.982  -3.982
  264   3HG2  THR  35          HG22      THR  35   7.190  -4.584  -4.584
  265    H    VAL  36           HN       VAL  36   6.943  -5.904  -5.904
  266    HA   VAL  36           HA       VAL  36   4.004  -6.210  -6.210
  267    HB   VAL  36           HB       VAL  36   6.075  -7.864  -7.864
  268   1HG1  VAL  36          HG13      VAL  36   3.080  -8.265  -8.265
  269   2HG1  VAL  36          HG12      VAL  36   4.126  -9.185  -9.185
  270   3HG1  VAL  36          HG11      VAL  36   4.333  -9.313  -9.313
  271   1HG2  VAL  36          HG23      VAL  36   4.014  -5.830  -5.830
  272   2HG2  VAL  36          HG22      VAL  36   5.638  -6.075  -6.075
  273   3HG2  VAL  36          HG21      VAL  36   4.334  -7.162  -7.162
  274    H    LEU  37           HN       LEU  37   3.336  -7.566  -7.566
  275    HA   LEU  37           HA       LEU  37   5.623  -8.889  -8.889
  276   1HB   LEU  37           HB2      LEU  37   3.087  -7.581  -7.581
  277   2HB   LEU  37           HB1      LEU  37   4.306  -8.348  -8.348
  278    HG   LEU  37           HG       LEU  37   5.139  -6.201  -6.201
  279   1HD1  LEU  37          HD13      LEU  37   3.055  -5.663  -5.663
  280   2HD1  LEU  37          HD12      LEU  37   4.392  -5.397  -5.397
  281   3HD1  LEU  37          HD11      LEU  37   4.311  -4.474  -4.474
  282   1HD2  LEU  37          HD21      LEU  37   6.246  -7.724  -7.724
  283   2HD2  LEU  37          HD23      LEU  37   7.075  -6.699  -6.699
  284   3HD2  LEU  37          HD22      LEU  37   6.389  -5.987  -5.987
  285    H    ARG  38           HN       ARG  38   5.029 -10.781 -10.781
  286    HA   ARG  38           HA       ARG  38   2.600 -12.196 -12.196
  287   1HB   ARG  38           HB2      ARG  38   4.830 -13.015 -13.015
  288   2HB   ARG  38           HB1      ARG  38   5.277 -13.346 -13.346
  289   1HG   ARG  38           HG2      ARG  38   3.209 -14.808 -14.808
  290   2HG   ARG  38           HG1      ARG  38   3.042 -14.625 -14.625
  291   1HD   ARG  38           HD2      ARG  38   4.272 -16.681 -16.681
  292   2HD   ARG  38           HD1      ARG  38   5.434 -15.486 -15.486
  293    HE   ARG  38           HE       ARG  38   5.468 -15.093 -15.093
  294   1HH1  ARG  38          HH21      ARG  38   5.957 -17.859 -17.859
  295   2HH1  ARG  38          HH22      ARG  38   7.037 -18.628 -18.628
  296   1HH2  ARG  38          HH11      ARG  38   6.868 -16.125 -16.125
  297   2HH2  ARG  38          HH12      ARG  38   7.549 -17.660 -17.660
  298    H    GLN  39           HN       GLN  39   1.124 -12.416 -12.416
  299    HA   GLN  39           HA       GLN  39   2.133 -12.446 -12.446
  300   1HB   GLN  39           HB2      GLN  39  -0.537 -11.969 -11.969
  301   2HB   GLN  39           HB1      GLN  39  -0.368 -12.096 -12.096
  302   1HG   GLN  39           HG2      GLN  39   1.215 -10.236 -10.236
  303   2HG   GLN  39           HG1      GLN  39   1.153 -10.146 -10.146
  304   1HE2  GLN  39          HE22      GLN  39  -1.367  -7.713  -7.713
  305   2HE2  GLN  39          HE21      GLN  39   0.233  -8.011  -8.011
  306    H    ALA  40           HN       ALA  40   2.052 -14.245 -14.245
  307    HA   ALA  40           HA       ALA  40   0.446 -16.591 -16.591
  308   1HB   ALA  40           HB3      ALA  40   3.312 -16.223 -16.223
  309   2HB   ALA  40           HB2      ALA  40   2.577 -17.666 -17.666
  310   3HB   ALA  40           HB1      ALA  40   2.546 -17.417 -17.417
  311    H    ASP  41           HN       ASP  41  -0.151 -18.065 -18.065
  312    HA   ASP  41           HA       ASP  41  -1.288 -16.715 -16.715
  313   1HB   ASP  41           HB2      ASP  41  -0.564 -19.573 -19.573
  314   2HB   ASP  41           HB1      ASP  41  -1.465 -19.103 -19.103
  315    H    SER  42           HN       SER  42   1.766 -18.536 -18.536
  316    HA   SER  42           HA       SER  42   2.476 -18.308 -18.308
  317   1HB   SER  42           HB2      SER  42   4.086 -18.790 -18.790
  318   2HB   SER  42           HB1      SER  42   4.714 -19.010 -19.010
  319    HG   SER  42           HG       SER  42   3.240 -20.628 -20.628
  320    H    GLN  43           HN       GLN  43   3.850 -16.626 -16.626
  321    HA   GLN  43           HA       GLN  43   4.109 -14.126 -14.126
  322   1HB   GLN  43           HB2      GLN  43   6.410 -15.811 -15.811
  323   2HB   GLN  43           HB1      GLN  43   6.598 -14.109 -14.109
  324   1HG   GLN  43           HG2      GLN  43   5.625 -14.674 -14.674
  325   2HG   GLN  43           HG1      GLN  43   5.769 -16.374 -16.374
  326   1HE2  GLN  43          HE22      GLN  43   9.011 -16.159 -16.159
  327   2HE2  GLN  43          HE21      GLN  43   7.435 -16.759 -16.759
  328    H    VAL  44           HN       VAL  44   5.075 -12.363 -12.363
  329    HA   VAL  44           HA       VAL  44   4.287 -12.794 -12.794
  330    HB   VAL  44           HB       VAL  44   4.204 -10.320 -10.320
  331   1HG1  VAL  44          HG12      VAL  44   4.643  -9.874  -9.874
  332   2HG1  VAL  44          HG11      VAL  44   3.141 -10.713 -10.713
  333   3HG1  VAL  44          HG13      VAL  44   3.102  -9.224  -9.224
  334   1HG2  VAL  44          HG22      VAL  44   2.490 -12.361 -12.361
  335   2HG2  VAL  44          HG21      VAL  44   1.937 -10.689 -10.689
  336   3HG2  VAL  44          HG23      VAL  44   1.781 -11.581 -11.581
  337    H    THR  45           HN       THR  45   5.844 -12.247 -12.247
  338    HA   THR  45           HA       THR  45   8.324 -10.854 -10.854
  339    HB   THR  45           HB       THR  45   9.594 -12.509 -12.509
  340    HG1  THR  45           HG1      THR  45   8.212 -13.178 -13.178
  341   1HG2  THR  45          HG23      THR  45   8.983 -12.894 -12.894
  342   2HG2  THR  45          HG22      THR  45   7.686 -13.939 -13.939
  343   3HG2  THR  45          HG21      THR  45   9.367 -14.348 -14.348
  344    H    GLU  46           HN       GLU  46   9.582  -9.882  -9.882
  345    HA   GLU  46           HA       GLU  46   7.860  -8.574  -8.574
  346   1HB   GLU  46           HB2      GLU  46   9.800  -7.566  -7.566
  347   2HB   GLU  46           HB1      GLU  46  10.871  -8.517  -8.517
  348   1HG   GLU  46           HG2      GLU  46   9.694  -7.426  -7.426
  349   2HG   GLU  46           HG1      GLU  46   8.994  -6.303  -6.303
  350    H    VAL  47           HN       VAL  47   8.281  -8.656  -8.656
  351    HA   VAL  47           HA       VAL  47   9.462 -11.267 -11.267
  352    HB   VAL  47           HB       VAL  47   7.108  -9.665  -9.665
  353   1HG1  VAL  47          HG12      VAL  47   8.517 -12.090 -12.090
  354   2HG1  VAL  47          HG11      VAL  47   6.775 -11.921 -11.921
  355   3HG1  VAL  47          HG13      VAL  47   7.874 -10.711 -10.711
  356   1HG2  VAL  47          HG22      VAL  47   7.422 -12.068 -12.068
  357   2HG2  VAL  47          HG21      VAL  47   6.293 -10.721 -10.721
  358   3HG2  VAL  47          HG23      VAL  47   6.021 -11.971 -11.971
  359    H    CYS  48           HN       CYS  48   8.367  -8.532  -8.532
  360    HA   CYS  48           HA       CYS  48  11.204  -8.199  -8.199
  361   1HB   CYS  48           HB2      CYS  48   8.537  -8.137  -8.137
  362   2HB   CYS  48           HB1      CYS  48  10.041  -7.604  -7.604
  363    H    ALA  49           HN       ALA  49  11.833  -5.966  -5.966
  364    HA   ALA  49           HA       ALA  49   9.906  -3.802  -3.802
  365   1HB   ALA  49           HB3      ALA  49  11.825  -4.895  -4.895
  366   2HB   ALA  49           HB2      ALA  49  11.868  -3.136  -3.136
  367   3HB   ALA  49           HB1      ALA  49  10.359  -3.951  -3.951
  368    H    ALA  50           HN       ALA  50  10.438  -2.028  -2.028
  369    HA   ALA  50           HA       ALA  50  13.125  -1.043  -1.043
  370   1HB   ALA  50           HB2      ALA  50  12.947  -3.119  -3.119
  371   2HB   ALA  50           HB1      ALA  50  11.750  -2.226  -2.226
  372   3HB   ALA  50           HB3      ALA  50  13.405  -1.629  -1.629
  373    H    THR  51           HN       THR  51  13.026   1.008   1.008
  374    HA   THR  51           HA       THR  51  10.323   2.226   2.226
  375    HB   THR  51           HB       THR  51  12.867   3.611   3.611
  376    HG1  THR  51           HG1      THR  51  12.038   3.042   3.042
  377   1HG2  THR  51          HG22      THR  51  10.295   4.352   4.352
  378   2HG2  THR  51          HG21      THR  51  11.718   5.390   5.390
  379   3HG2  THR  51          HG23      THR  51  10.987   5.029   5.029
  380    H    TYR  52           HN       TYR  52   9.086   1.878   1.878
  381    HA   TYR  52           HA       TYR  52  10.219   1.427   1.427
  382   1HB   TYR  52           HB2      TYR  52   8.039   0.544   0.544
  383   2HB   TYR  52           HB1      TYR  52   7.413   2.193   2.193
  384    HD1  TYR  52           HD2      TYR  52   7.418   3.538   3.538
  385    HD2  TYR  52           HD1      TYR  52   8.008  -0.745  -0.745
  386    HE1  TYR  52           HE2      TYR  52   6.834   3.344   3.344
  387    HE2  TYR  52           HE1      TYR  52   7.426  -0.943  -0.943
  388    HH   TYR  52           HH       TYR  52   7.330   1.683   1.683
  389    H    MET  53           HN       MET  53  10.950   3.018   3.018
  390    HA   MET  53           HA       MET  53  10.392   5.845   5.845
  391   1HB   MET  53           HB2      MET  53  11.964   4.516   4.516
  392   2HB   MET  53           HB1      MET  53  12.015   6.230   6.230
  393   1HG   MET  53           HG2      MET  53  12.542   4.517   4.517
  394   2HG   MET  53           HG1      MET  53  13.699   4.254   4.254
  395   1HE   MET  53           HE2      MET  53  12.317   6.504   6.504
  396   2HE   MET  53           HE1      MET  53  12.816   8.138   8.138
  397   3HE   MET  53           HE3      MET  53  11.607   7.286   7.286
  398    H    MET  54           HN       MET  54   9.077   7.171   7.171
  399    HA   MET  54           HA       MET  54   6.908   5.939   5.939
  400   1HB   MET  54           HB2      MET  54   8.141   8.706   8.706
  401   2HB   MET  54           HB1      MET  54   6.615   8.305   8.305
  402   1HG   MET  54           HG2      MET  54   7.117   7.795   7.795
  403   2HG   MET  54           HG1      MET  54   6.400   9.291   9.291
  404   1HE   MET  54           HE1      MET  54   6.470   5.776   5.776
  405   2HE   MET  54           HE3      MET  54   5.065   5.924   5.924
  406   3HE   MET  54           HE2      MET  54   4.932   5.051   5.051
  407    H    GLY  55           HN       GLY  55  10.110   6.872   6.872
  408   1HA   GLY  55           HA2      GLY  55   9.317   6.260   6.260
  409   2HA   GLY  55           HA1      GLY  55  10.781   7.117   7.117
  410    H    ASN  56           HN       ASN  56  11.184   4.985   4.985
  411    HA   ASN  56           HA       ASN  56  12.131   2.776   2.776
  412   1HB   ASN  56           HB2      ASN  56  13.550   4.190   4.190
  413   2HB   ASN  56           HB1      ASN  56  14.183   2.773   2.773
  414   1HD2  ASN  56          HD22      ASN  56  15.371   6.042   6.042
  415   2HD2  ASN  56          HD21      ASN  56  15.301   5.566   5.566
  416    H    GLU  57           HN       GLU  57  12.411   0.701   0.701
  417    HA   GLU  57           HA       GLU  57  10.697   0.381   0.381
  418   1HB   GLU  57           HB2      GLU  57   9.903  -0.624  -0.624
  419   2HB   GLU  57           HB1      GLU  57  11.388  -1.572  -1.572
  420   1HG   GLU  57           HG2      GLU  57  10.831  -2.690  -2.690
  421   2HG   GLU  57           HG1      GLU  57   9.390  -1.689  -1.689
  422    H    LEU  58           HN       LEU  58  11.655  -0.567  -0.567
  423    HA   LEU  58           HA       LEU  58  14.543  -1.238  -1.238
  424   1HB   LEU  58           HB2      LEU  58  12.531  -0.598  -0.598
  425   2HB   LEU  58           HB1      LEU  58  14.087  -1.309  -1.309
  426    HG   LEU  58           HG       LEU  58  15.181   0.546   0.546
  427   1HD1  LEU  58          HD12      LEU  58  12.301   1.312   1.312
  428   2HD1  LEU  58          HD11      LEU  58  13.493   2.601   2.601
  429   3HD1  LEU  58          HD13      LEU  58  13.600   1.476   1.476
  430   1HD2  LEU  58          HD22      LEU  58  13.678   0.783   0.783
  431   2HD2  LEU  58          HD21      LEU  58  15.396   1.028   1.028
  432   3HD2  LEU  58          HD23      LEU  58  14.238   2.303   2.303
  433    H    THR  59           HN       THR  59  15.288  -3.119  -3.119
  434    HA   THR  59           HA       THR  59  13.472  -5.461  -5.461
  435    HB   THR  59           HB       THR  59  15.625  -6.642  -6.642
  436    HG1  THR  59           HG1      THR  59  17.490  -5.634  -5.634
  437   1HG2  THR  59          HG22      THR  59  14.398  -5.526  -5.526
  438   2HG2  THR  59          HG21      THR  59  15.626  -4.264  -4.264
  439   3HG2  THR  59          HG23      THR  59  16.096  -5.923  -5.923
  440    H    PHE  60           HN       PHE  60  13.760  -7.093  -7.093
  441    HA   PHE  60           HA       PHE  60  14.347  -5.834  -5.834
  442   1HB   PHE  60           HB2      PHE  60  13.005  -8.438  -8.438
  443   2HB   PHE  60           HB1      PHE  60  13.052  -7.780  -7.780
  444    HD1  PHE  60           HD1      PHE  60  12.534  -4.969  -4.969
  445    HD2  PHE  60           HD2      PHE  60  10.874  -8.152  -8.152
  446    HE1  PHE  60           HE1      PHE  60  10.573  -3.517  -3.517
  447    HE2  PHE  60           HE2      PHE  60   8.903  -6.713  -6.713
  448    HZ   PHE  60           HZ       PHE  60   8.755  -4.395  -4.395
  449    H    LEU  61           HN       LEU  61  16.284  -6.254  -6.254
  450    HA   LEU  61           HA       LEU  61  18.356  -7.781  -7.781
  451   1HB   LEU  61           HB2      LEU  61  18.584  -5.919  -5.919
  452   2HB   LEU  61           HB1      LEU  61  17.963  -6.961  -6.961
  453    HG   LEU  61           HG       LEU  61  19.857  -8.533  -8.533
  454   1HD1  LEU  61          HD12      LEU  61  20.559  -6.408  -6.408
  455   2HD1  LEU  61          HD11      LEU  61  21.797  -7.457  -7.457
  456   3HD1  LEU  61          HD13      LEU  61  20.465  -8.154  -8.154
  457   1HD2  LEU  61          HD22      LEU  61  19.985  -6.718  -6.718
  458   2HD2  LEU  61          HD21      LEU  61  21.565  -7.138  -7.138
  459   3HD2  LEU  61          HD23      LEU  61  20.742  -5.675  -5.675
  460    H    ASP  62           HN       ASP  62  16.220  -8.757  -8.757
  461    HA   ASP  62           HA       ASP  62  16.999 -11.587 -11.587
  462   1HB   ASP  62           HB2      ASP  62  17.484 -11.905 -11.905
  463   2HB   ASP  62           HB1      ASP  62  18.519 -10.660 -10.660
  464    H    ASP  63           HN       ASP  63  15.736 -12.836 -12.836
  465    HA   ASP  63           HA       ASP  63  13.625 -13.651 -13.651
  466   1HB   ASP  63           HB2      ASP  63  13.100 -10.671 -10.671
  467   2HB   ASP  63           HB1      ASP  63  12.022 -11.828 -11.828
  468    H    SER  64           HN       SER  64  13.948 -14.239 -14.239
  469    HA   SER  64           HA       SER  64  12.875 -14.713 -14.713
  470   1HB   SER  64           HB2      SER  64  10.528 -13.857 -13.857
  471   2HB   SER  64           HB1      SER  64  10.370 -14.653 -14.653
  472    HG   SER  64           HG       SER  64  10.938 -15.694 -15.694
  473    H    ILE  67           HN       ILE  67  13.558 -13.260 -13.260
  474    HA   ILE  67           HA       ILE  67  13.115 -10.439 -10.439
  475    HB   ILE  67           HB       ILE  67  13.714 -12.395 -12.395
  476   1HG1  ILE  67          HG12      ILE  67  15.495 -10.592 -10.592
  477   2HG1  ILE  67          HG11      ILE  67  15.300 -12.326 -12.326
  478   1HG2  ILE  67          HG22      ILE  67  13.928  -9.366  -9.366
  479   2HG2  ILE  67          HG21      ILE  67  14.669 -10.360 -10.360
  480   3HG2  ILE  67          HG23      ILE  67  12.913 -10.307 -10.307
  481   1HD1  ILE  67          HD11      ILE  67  16.009 -12.632 -12.632
  482   2HD1  ILE  67          HD13      ILE  67  16.468 -10.931 -10.931
  483   3HD1  ILE  67          HD12      ILE  67  17.269 -12.070 -12.070
  484    H    CYS  68           HN       CYS  68  10.848 -10.049 -10.049
  485    HA   CYS  68           HA       CYS  68   8.745 -11.196 -11.196
  486   1HB   CYS  68           HB2      CYS  68   8.869  -8.640  -8.640
  487   2HB   CYS  68           HB1      CYS  68   7.396  -9.434  -9.434
  488    H    THR  69           HN       THR  69   7.418  -9.862  -9.862
  489    HA   THR  69           HA       THR  69   8.922  -7.649  -7.649
  490    HB   THR  69           HB       THR  69   9.393  -9.812  -9.812
  491    HG1  THR  69           HG1      THR  69   9.226  -8.859  -8.859
  492   1HG2  THR  69          HG23      THR  69   6.801 -10.462 -10.462
  493   2HG2  THR  69          HG22      THR  69   6.669 -10.125 -10.125
  494   3HG2  THR  69          HG21      THR  69   7.801 -11.349 -11.349
  495    H    GLY  70           HN       GLY  70   7.492  -6.122  -6.122
  496   1HA   GLY  70           HA2      GLY  70   4.679  -6.570  -6.570
  497   2HA   GLY  70           HA1      GLY  70   4.969  -5.730  -5.730
  498    H    THR  71           HN       THR  71   3.555  -4.217  -4.217
  499    HA   THR  71           HA       THR  71   5.325  -2.275  -2.275
  500    HB   THR  71           HB       THR  71   2.512  -3.142  -3.142
  501    HG1  THR  71           HG1      THR  71   3.995  -4.645  -4.645
  502   1HG2  THR  71          HG22      THR  71   4.227  -0.966  -0.966
  503   2HG2  THR  71          HG21      THR  71   3.017  -1.751  -1.751
  504   3HG2  THR  71          HG23      THR  71   2.523  -0.920  -0.920
  505    H    SER  72           HN       SER  72   4.339  -0.054  -0.054
  506    HA   SER  72           HA       SER  72   2.357   0.479   0.479
  507   1HB   SER  72           HB2      SER  72   5.260   1.348   1.348
  508   2HB   SER  72           HB1      SER  72   4.025   2.039   2.039
  509    HG   SER  72           HG       SER  72   4.305   0.369   0.369
  510    H    SER  73           HN       SER  73   1.026   2.046   2.046
  511    HA   SER  73           HA       SER  73   2.258   4.292   4.292
  512   1HB   SER  73           HB2      SER  73   0.704   3.871   3.871
  513   2HB   SER  73           HB1      SER  73   1.777   2.499   2.499
  514    HG   SER  73           HG       SER  73   0.138   1.370   1.370
  515    H    GLY  74           HN       GLY  74   0.946   6.176   6.176
  516   1HA   GLY  74           HA2      GLY  74  -0.618   7.645   7.645
  517   2HA   GLY  74           HA1      GLY  74  -1.788   6.373   6.373
  518    H    ASN  75           HN       ASN  75  -2.932   5.913   5.913
  519    HA   ASN  75           HA       ASN  75  -1.565   6.007   6.007
  520   1HB   ASN  75           HB2      ASN  75  -4.472   6.168   6.168
  521   2HB   ASN  75           HB1      ASN  75  -3.927   6.222   6.222
  522   1HD2  ASN  75          HD22      ASN  75  -3.996   9.635   9.635
  523   2HD2  ASN  75          HD21      ASN  75  -4.907   8.256   8.256
  524    H    GLN  76           HN       GLN  76  -1.801   3.698   3.698
  525    HA   GLN  76           HA       GLN  76  -2.882   1.646   1.646
  526   1HB   GLN  76           HB2      GLN  76  -3.006   1.891   1.891
  527   2HB   GLN  76           HB1      GLN  76  -3.435   0.412   0.412
  528   1HG   GLN  76           HG2      GLN  76  -5.102   1.706   1.706
  529   2HG   GLN  76           HG1      GLN  76  -4.727   3.130   3.130
  530   1HE2  GLN  76          HE22      GLN  76  -5.989   1.222   1.222
  531   2HE2  GLN  76          HE21      GLN  76  -4.456   1.793   1.793
  532    H    VAL  77           HN       VAL  77  -1.278   0.279   0.279
  533    HA   VAL  77           HA       VAL  77   1.156  -0.006  -0.006
  534    HB   VAL  77           HB       VAL  77   2.263  -0.519  -0.519
  535   1HG1  VAL  77          HG13      VAL  77   1.072   1.906   1.906
  536   2HG1  VAL  77          HG12      VAL  77   0.560   1.536   1.536
  537   3HG1  VAL  77          HG11      VAL  77   2.278   1.585   1.585
  538   1HG2  VAL  77          HG21      VAL  77  -0.436  -1.187  -1.187
  539   2HG2  VAL  77          HG23      VAL  77   1.117  -1.868  -1.868
  540   3HG2  VAL  77          HG22      VAL  77   0.559  -0.348  -0.348
  541    H    ASN  78           HN       ASN  78   1.361  -1.918  -1.918
  542    HA   ASN  78           HA       ASN  78  -0.409  -4.194  -4.194
  543   1HB   ASN  78           HB2      ASN  78  -0.302  -3.156  -3.156
  544   2HB   ASN  78           HB1      ASN  78   1.355  -3.750  -3.750
  545    HD2  ASN  78          HD22      ASN  78  -1.712  -4.932  -4.932
  546    H    LEU  79           HN       LEU  79   0.536  -5.675  -5.675
  547    HA   LEU  79           HA       LEU  79   3.480  -6.166  -6.166
  548   1HB   LEU  79           HB2      LEU  79   1.349  -6.792  -6.792
  549   2HB   LEU  79           HB1      LEU  79   3.008  -7.369  -7.369
  550    HG   LEU  79           HG       LEU  79   2.211  -4.450  -4.450
  551   1HD1  LEU  79          HD11      LEU  79   2.618  -6.289  -6.289
  552   2HD1  LEU  79          HD13      LEU  79   3.318  -4.676  -4.676
  553   3HD1  LEU  79          HD12      LEU  79   1.586  -4.865  -4.865
  554   1HD2  LEU  79          HD21      LEU  79   4.836  -5.910  -5.910
  555   2HD2  LEU  79          HD23      LEU  79   4.405  -4.672  -4.672
  556   3HD2  LEU  79          HD22      LEU  79   4.654  -4.231  -4.231
  557    H    THR  80           HN       THR  80   4.182  -8.058  -8.058
  558    HA   THR  80           HA       THR  80   2.175 -10.251 -10.251
  559    HB   THR  80           HB       THR  80   4.566  -9.428  -9.428
  560    HG1  THR  80           HG1      THR  80   3.066  -8.505  -8.505
  561   1HG2  THR  80          HG23      THR  80   2.313 -11.381 -11.381
  562   2HG2  THR  80          HG22      THR  80   3.588 -10.956 -10.956
  563   3HG2  THR  80          HG21      THR  80   3.986 -11.813 -11.813
  564    H    ILE  81           HN       ILE  81   2.744 -12.224 -12.224
  565    HA   ILE  81           HA       ILE  81   5.505 -12.544 -12.544
  566    HB   ILE  81           HB       ILE  81   2.810 -13.797 -13.797
  567   1HG1  ILE  81          HG12      ILE  81   4.545 -12.016 -12.016
  568   2HG1  ILE  81          HG11      ILE  81   3.257 -11.394 -11.394
  569   1HG2  ILE  81          HG23      ILE  81   4.675 -15.403 -15.403
  570   2HG2  ILE  81          HG22      ILE  81   5.466 -14.212 -14.212
  571   3HG2  ILE  81          HG21      ILE  81   3.914 -14.903 -14.903
  572   1HD1  ILE  81          HD11      ILE  81   1.819 -13.254 -13.254
  573   2HD1  ILE  81          HD13      ILE  81   3.056 -13.099 -13.099
  574   3HD1  ILE  81          HD12      ILE  81   2.096 -11.696 -11.696
  575    H    GLN  82           HN       GLN  82   6.797 -14.097 -14.097
  576    HA   GLN  82           HA       GLN  82   5.454 -16.197 -16.197
  577   1HB   GLN  82           HB2      GLN  82   8.132 -14.833 -14.833
  578   2HB   GLN  82           HB1      GLN  82   7.458 -16.104 -16.104
  579   1HG   GLN  82           HG2      GLN  82   5.502 -14.650 -14.650
  580   2HG   GLN  82           HG1      GLN  82   6.250 -13.363 -13.363
  581   1HE2  GLN  82          HE22      GLN  82   7.577 -12.333 -12.333
  582   2HE2  GLN  82          HE21      GLN  82   6.392 -12.014 -12.014
  583    H    GLY  83           HN       GLY  83   5.738 -18.139 -18.139
  584   1HA   GLY  83           HA2      GLY  83   7.317 -19.957 -19.957
  585   2HA   GLY  83           HA1      GLY  83   8.254 -18.749 -18.749
  586    H    LEU  84           HN       LEU  84   4.755 -19.334 -19.334
  587    HA   LEU  84           HA       LEU  84   4.564 -19.067 -19.067
  588   1HB   LEU  84           HB2      LEU  84   2.661 -19.682 -19.682
  589   2HB   LEU  84           HB1      LEU  84   2.130 -19.583 -19.583
  590    HG   LEU  84           HG       LEU  84   3.692 -17.374 -17.374
  591   1HD1  LEU  84          HD11      LEU  84   1.374 -17.987 -17.987
  592   2HD1  LEU  84          HD13      LEU  84   0.719 -17.318 -17.318
  593   3HD1  LEU  84          HD12      LEU  84   1.688 -16.305 -16.305
  594   1HD2  LEU  84          HD21      LEU  84   2.333 -17.823 -17.823
  595   2HD2  LEU  84          HD23      LEU  84   3.828 -16.957 -16.957
  596   3HD2  LEU  84          HD22      LEU  84   2.270 -16.199 -16.199
  597    H    ARG  85           HN       ARG  85   4.480 -20.652 -20.652
  598    HA   ARG  85           HA       ARG  85   4.259 -23.503 -23.503
  599   1HB   ARG  85           HB2      ARG  85   5.797 -22.213 -22.213
  600   2HB   ARG  85           HB1      ARG  85   5.722 -23.948 -23.948
  601   1HG   ARG  85           HG2      ARG  85   6.591 -23.405 -23.405
  602   2HG   ARG  85           HG1      ARG  85   6.990 -21.812 -21.812
  603   1HD   ARG  85           HD2      ARG  85   8.343 -22.908 -22.908
  604   2HD   ARG  85           HD1      ARG  85   8.013 -24.478 -24.478
  605    HE   ARG  85           HE       ARG  85   8.962 -22.746 -22.746
  606   1HH1  ARG  85          HH21      ARG  85  10.136 -24.254 -24.254
  607   2HH1  ARG  85          HH22      ARG  85  11.771 -24.299 -24.299
  608   1HH2  ARG  85          HH11      ARG  85  11.089 -22.825 -22.825
  609   2HH2  ARG  85          HH12      ARG  85  12.307 -23.500 -23.500
  610    H    ALA  86           HN       ALA  86   3.322 -24.896 -24.896
  611    HA   ALA  86           HA       ALA  86   0.795 -23.905 -23.905
  612   1HB   ALA  86           HB2      ALA  86   2.598 -26.194 -26.194
  613   2HB   ALA  86           HB1      ALA  86   1.009 -25.966 -25.966
  614   3HB   ALA  86           HB3      ALA  86   1.150 -26.255 -26.255
  615    H    MET  87           HN       MET  87   3.932 -24.120 -24.120
  616    HA   MET  87           HA       MET  87   3.055 -23.248 -23.248
  617   1HB   MET  87           HB2      MET  87   5.155 -24.472 -24.472
  618   2HB   MET  87           HB1      MET  87   5.757 -23.023 -23.023
  619   1HG   MET  87           HG2      MET  87   5.509 -21.768 -21.768
  620   2HG   MET  87           HG1      MET  87   5.018 -23.266 -23.266
  621   1HE   MET  87           HE1      MET  87   6.672 -22.142 -22.142
  622   2HE   MET  87           HE3      MET  87   7.358 -23.731 -23.731
  623   3HE   MET  87           HE2      MET  87   8.417 -22.384 -22.384
  624    H    ASP  88           HN       ASP  88   4.346 -21.501 -21.501
  625    HA   ASP  88           HA       ASP  88   4.630 -18.933 -18.933
  626   1HB   ASP  88           HB2      ASP  88   4.141 -19.769 -19.769
  627   2HB   ASP  88           HB1      ASP  88   4.662 -18.160 -18.160
  628    H    THR  89           HN       THR  89   1.808 -20.599 -20.599
  629    HA   THR  89           HA       THR  89   0.059 -18.561 -18.561
  630    HB   THR  89           HB       THR  89  -0.576 -20.957 -20.957
  631    HG1  THR  89           HG1      THR  89   0.264 -21.991 -21.991
  632   1HG2  THR  89          HG22      THR  89  -2.374 -19.238 -19.238
  633   2HG2  THR  89          HG21      THR  89  -2.194 -19.654 -19.654
  634   3HG2  THR  89          HG23      THR  89  -2.732 -20.874 -20.874
  635    H    GLY  90           HN       GLY  90  -1.034 -16.998 -16.998
  636   1HA   GLY  90           HA2      GLY  90  -1.959 -16.956 -16.956
  637   2HA   GLY  90           HA1      GLY  90  -0.261 -16.525 -16.525
  638    H    LEU  91           HN       LEU  91  -1.243 -14.484 -14.484
  639    HA   LEU  91           HA       LEU  91  -2.577 -12.690 -12.690
  640   1HB   LEU  91           HB2      LEU  91  -3.076 -12.838 -12.838
  641   2HB   LEU  91           HB1      LEU  91  -1.448 -12.258 -12.258
  642    HG   LEU  91           HG       LEU  91  -2.000 -10.218 -10.218
  643   1HD1  LEU  91          HD12      LEU  91  -4.795 -11.346 -11.346
  644   2HD1  LEU  91          HD11      LEU  91  -4.413  -9.754  -9.754
  645   3HD1  LEU  91          HD13      LEU  91  -3.931 -11.208 -11.208
  646   1HD2  LEU  91          HD21      LEU  91  -2.121 -10.485 -10.485
  647   2HD2  LEU  91          HD23      LEU  91  -2.884  -9.074  -9.074
  648   3HD2  LEU  91          HD22      LEU  91  -3.870 -10.451 -10.451
  649    H    TYR  92           HN       TYR  92  -1.640 -11.185 -11.185
  650    HA   TYR  92           HA       TYR  92   1.228 -10.480 -10.480
  651   1HB   TYR  92           HB2      TYR  92  -0.477 -10.740 -10.740
  652   2HB   TYR  92           HB1      TYR  92   1.080  -9.907  -9.907
  653    HD1  TYR  92           HD2      TYR  92   3.186 -11.103 -11.103
  654    HD2  TYR  92           HD1      TYR  92  -0.614 -13.183 -13.183
  655    HE1  TYR  92           HE2      TYR  92   4.389 -13.292 -13.292
  656    HE2  TYR  92           HE1      TYR  92   0.589 -15.375 -15.375
  657    HH   TYR  92           HH       TYR  92   2.879 -16.188 -16.188
  658    H    ILE  93           HN       ILE  93   1.537  -8.381  -8.381
  659    HA   ILE  93           HA       ILE  93  -0.780  -6.500  -6.500
  660    HB   ILE  93           HB       ILE  93   1.697  -6.660  -6.660
  661   1HG1  ILE  93          HG12      ILE  93  -0.196  -6.964  -6.964
  662   2HG1  ILE  93          HG11      ILE  93  -1.178  -7.421  -7.421
  663   1HG2  ILE  93          HG21      ILE  93  -0.459  -4.597  -4.597
  664   2HG2  ILE  93          HG23      ILE  93   0.146  -4.978  -4.978
  665   3HG2  ILE  93          HG22      ILE  93   1.252  -4.388  -4.388
  666   1HD1  ILE  93          HD11      ILE  93   1.505  -8.708  -8.708
  667   2HD1  ILE  93          HD13      ILE  93   0.153  -9.270  -9.270
  668   3HD1  ILE  93          HD12      ILE  93   0.059  -9.348  -9.348
  669    H    CYS  94           HN       CYS  94  -0.602  -4.665  -4.665
  670    HA   CYS  94           HA       CYS  94   1.977  -4.036  -4.036
  671   1HB   CYS  94           HB2      CYS  94   0.411  -1.996  -1.996
  672   2HB   CYS  94           HB1      CYS  94   0.187  -3.589  -3.589
  673    H    LYS  95           HN       LYS  95   3.172  -2.122  -2.122
  674    HA   LYS  95           HA       LYS  95   2.406  -0.605  -0.605
  675   1HB   LYS  95           HB2      LYS  95   3.772  -2.542  -2.542
  676   2HB   LYS  95           HB1      LYS  95   4.957  -2.108  -2.108
  677   1HG   LYS  95           HG2      LYS  95   5.993  -0.714  -0.714
  678   2HG   LYS  95           HG1      LYS  95   4.493   0.182   0.182
  679   1HD   LYS  95           HD2      LYS  95   3.775  -1.402  -1.402
  680   2HD   LYS  95           HD1      LYS  95   5.205  -2.397  -2.397
  681   1HE   LYS  95           HE2      LYS  95   6.677  -0.636  -0.636
  682   2HE   LYS  95           HE1      LYS  95   5.314   0.490   0.490
  683   1HZ   LYS  95           HZ2      LYS  95   5.488  -2.132  -2.132
  684   2HZ   LYS  95           HZ1      LYS  95   5.852  -0.641  -0.641
  685   3HZ   LYS  95           HZ3      LYS  95   4.273  -0.960  -0.960
  686    H    VAL  96           HN       VAL  96   2.038   1.020   1.020
  687    HA   VAL  96           HA       VAL  96   4.395   1.917   1.917
  688    HB   VAL  96           HB       VAL  96   2.337   1.634   1.634
  689   1HG1  VAL  96          HG13      VAL  96   1.160   3.156   3.156
  690   2HG1  VAL  96          HG12      VAL  96   0.371   3.213   3.213
  691   3HG1  VAL  96          HG11      VAL  96   0.617   1.661   1.661
  692   1HG2  VAL  96          HG22      VAL  96   3.611   4.210   4.210
  693   2HG2  VAL  96          HG21      VAL  96   2.888   3.451   3.451
  694   3HG2  VAL  96          HG23      VAL  96   1.897   4.435   4.435
  695    H    GLU  97           HN       GLU  97   5.745   3.286   3.286
  696    HA   GLU  97           HA       GLU  97   4.659   5.466   5.466
  697   1HB   GLU  97           HB2      GLU  97   7.166   3.788   3.788
  698   2HB   GLU  97           HB1      GLU  97   6.698   5.105   5.105
  699   1HG   GLU  97           HG2      GLU  97   4.497   3.809   3.809
  700   2HG   GLU  97           HG1      GLU  97   5.285   2.453   2.453
  701    H    LEU  98           HN       LEU  98   5.367   7.497   7.497
  702    HA   LEU  98           HA       LEU  98   7.404   7.765   7.765
  703   1HB   LEU  98           HB2      LEU  98   6.052   9.884   9.884
  704   2HB   LEU  98           HB1      LEU  98   6.787  10.122  10.122
  705    HG   LEU  98           HG       LEU  98   4.325   8.449   8.449
  706   1HD1  LEU  98          HD12      LEU  98   4.714  11.174  11.174
  707   2HD1  LEU  98          HD11      LEU  98   3.215  10.251  10.251
  708   3HD1  LEU  98          HD13      LEU  98   3.802  10.773  10.773
  709   1HD2  LEU  98          HD22      LEU  98   6.160   8.290   8.290
  710   2HD2  LEU  98          HD21      LEU  98   4.563   7.549   7.549
  711   3HD2  LEU  98          HD23      LEU  98   4.753   9.144   9.144
  712    H    MET  99           HN       MET  99   8.945   6.596   6.596
  713    HA   MET  99           HA       MET  99   9.734   7.752   7.752
  714   1HB   MET  99           HB2      MET  99   9.740   5.331   5.331
  715   2HB   MET  99           HB1      MET  99  11.194   5.700   5.700
  716   1HG   MET  99           HG2      MET  99  12.488   5.729   5.729
  717   2HG   MET  99           HG1      MET  99  11.327   6.714   6.714
  718   1HE   MET  99           HE1      MET  99   9.223   6.008   6.008
  719   2HE   MET  99           HE3      MET  99   8.575   4.679   4.679
  720   3HE   MET  99           HE2      MET  99   8.863   4.458   4.458
  721    H    TYR 100           HN       TYR 100  11.088   7.832   7.832
  722    HA   TYR 100           HA       TYR 100  13.633   8.933   8.933
  723   1HB   TYR 100           HB2      TYR 100  12.061   8.609   8.609
  724   2HB   TYR 100           HB1      TYR 100  13.544   9.560   9.560
  725    HD1  TYR 100           HD1      TYR 100  12.237   6.272   6.272
  726    HD2  TYR 100           HD2      TYR 100  15.576   8.450   8.450
  727    HE1  TYR 100           HE1      TYR 100  13.594   4.171   4.171
  728    HE2  TYR 100           HE2      TYR 100  16.925   6.350   6.350
  729    HH   TYR 100           HH       TYR 100  17.016   4.197   4.197
  730    HA   PRO 101           HA       PRO 101  12.022  13.196  13.196
  731   1HB   PRO 101           HB2      PRO 101   9.370  13.599  13.599
  732   2HB   PRO 101           HB1      PRO 101  10.634  13.299  13.299
  733   1HG   PRO 101           HG2      PRO 101   8.433  11.582  11.582
  734   2HG   PRO 101           HG1      PRO 101   9.593  11.392  11.392
  735   1HD   PRO 101           HD2      PRO 101   9.561  10.088  10.088
  736   2HD   PRO 101           HD1      PRO 101  10.527   9.711   9.711
  737    HA   PRO 102           HA       PRO 102  10.170  13.380  13.380
  738   1HB   PRO 102           HB2      PRO 102  11.838  15.378  15.378
  739   2HB   PRO 102           HB1      PRO 102  12.340  13.675  13.675
  740   1HG   PRO 102           HG2      PRO 102  12.965  15.934  15.934
  741   2HG   PRO 102           HG1      PRO 102  13.991  14.634  14.634
  742   1HD   PRO 102           HD2      PRO 102  12.911  14.640  14.640
  743   2HD   PRO 102           HD1      PRO 102  13.338  13.184  13.184
  744    HA   PRO 103           HA       PRO 103   9.579  14.421  14.421
  745   1HB   PRO 103           HB2      PRO 103   7.665  14.334  14.334
  746   2HB   PRO 103           HB1      PRO 103   9.196  15.236  15.236
  747   1HG   PRO 103           HG2      PRO 103   6.724  16.273  16.273
  748   2HG   PRO 103           HG1      PRO 103   8.269  17.090  17.090
  749   1HD   PRO 103           HD2      PRO 103   6.542  15.629  15.629
  750   2HD   PRO 103           HD1      PRO 103   6.922  17.362  17.362
  751    H    TYR 104           HN       TYR 104   8.479  12.387  12.387
  752    HA   TYR 104           HA       TYR 104   6.935  11.235  11.235
  753   1HB   TYR 104           HB2      TYR 104   8.762   9.917   9.917
  754   2HB   TYR 104           HB1      TYR 104   8.450  10.259  10.259
  755    HD1  TYR 104           HD1      TYR 104   6.226   9.031   9.031
  756    HD2  TYR 104           HD2      TYR 104   7.910   8.305   8.305
  757    HE1  TYR 104           HE1      TYR 104   4.809   6.998   6.998
  758    HE2  TYR 104           HE2      TYR 104   6.504   6.241   6.241
  759    HH   TYR 104           HH       TYR 104   3.925   5.588   5.588
  760    H    TYR 105           HN       TYR 105   4.883  10.682  10.682
  761    HA   TYR 105           HA       TYR 105   3.280  10.136  10.136
  762   1HB   TYR 105           HB2      TYR 105   3.382  12.626  12.626
  763   2HB   TYR 105           HB1      TYR 105   2.655  12.376  12.376
  764    HD1  TYR 105           HD2      TYR 105   0.398  11.409  11.409
  765    HD2  TYR 105           HD1      TYR 105   2.039  12.476  12.476
  766    HE1  TYR 105           HE2      TYR 105  -1.892  11.233  11.233
  767    HE2  TYR 105           HE1      TYR 105  -0.244  12.291  12.291
  768    HH   TYR 105           HH       TYR 105  -2.720  10.751  10.751
  769    H    LEU 106           HN       LEU 106   2.339   8.255   8.255
  770    HA   LEU 106           HA       LEU 106   0.655   8.344   8.344
  771   1HB   LEU 106           HB2      LEU 106   3.313   7.680   7.680
  772   2HB   LEU 106           HB1      LEU 106   2.566   6.091   6.091
  773    HG   LEU 106           HG       LEU 106   0.886   6.801   6.801
  774   1HD1  LEU 106          HD13      LEU 106   2.615   9.251   9.251
  775   2HD1  LEU 106          HD12      LEU 106   1.894   8.787   8.787
  776   3HD1  LEU 106          HD11      LEU 106   0.863   9.130   9.130
  777   1HD2  LEU 106          HD23      LEU 106   3.817   6.488   6.488
  778   2HD2  LEU 106          HD22      LEU 106   2.478   5.456   5.456
  779   3HD2  LEU 106          HD21      LEU 106   2.810   6.941   6.941
  780    H    GLY 108           HN       GLY 108   0.782   5.297   5.297
  781   1HA   GLY 108           HA2      GLY 108  -0.229   4.533   4.533
  782   2HA   GLY 108           HA1      GLY 108  -1.433   4.588   4.588
  783    H    ILE 109           HN       ILE 109  -1.113   2.276   2.276
  784    HA   ILE 109           HA       ILE 109   0.623   0.532   0.532
  785    HB   ILE 109           HB       ILE 109  -0.751   0.104   0.104
  786   1HG1  ILE 109          HG12      ILE 109   0.988   1.815   1.815
  787   2HG1  ILE 109          HG11      ILE 109   1.492   0.326   0.326
  788   1HG2  ILE 109          HG22      ILE 109   1.080  -1.566  -1.566
  789   2HG2  ILE 109          HG21      ILE 109   1.016  -1.782  -1.782
  790   3HG2  ILE 109          HG23      ILE 109  -0.435  -2.020  -2.020
  791   1HD1  ILE 109          HD12      ILE 109   2.364  -0.049  -0.049
  792   2HD1  ILE 109          HD11      ILE 109   2.634   1.674   1.674
  793   3HD1  ILE 109          HD13      ILE 109   3.361   0.501   0.501
  794    H    GLY 110           HN       GLY 110  -0.350  -1.378  -1.378
  795   1HA   GLY 110           HA2      GLY 110  -3.184  -1.065  -1.065
  796   2HA   GLY 110           HA1      GLY 110  -2.122  -2.335  -2.335
  797    H    ASN 111           HN       ASN 111  -4.847  -2.537  -2.537
  798    HA   ASN 111           HA       ASN 111  -4.742  -3.534  -3.534
  799   1HB   ASN 111           HB2      ASN 111  -6.759  -2.918  -2.918
  800   2HB   ASN 111           HB1      ASN 111  -6.559  -4.455  -4.455
  801    HD2  ASN 111          HD22      ASN 111  -6.914  -3.387  -3.387
  802    H    GLY 112           HN       GLY 112  -4.239  -5.167  -5.167
  803   1HA   GLY 112           HA2      GLY 112  -2.541  -6.964  -6.964
  804   2HA   GLY 112           HA1      GLY 112  -3.175  -7.529  -7.529
  805    H    THR 113           HN       THR 113  -2.894  -8.642  -8.642
  806    HA   THR 113           HA       THR 113  -5.714  -9.643  -9.643
  807    HB   THR 113           HB       THR 113  -3.393  -9.221  -9.221
  808    HG1  THR 113           HG1      THR 113  -4.256  -7.311  -7.311
  809   1HG2  THR 113          HG21      THR 113  -6.159 -10.372 -10.372
  810   2HG2  THR 113          HG23      THR 113  -5.098  -9.827  -9.827
  811   3HG2  THR 113          HG22      THR 113  -4.609 -11.182 -11.182
  812    H    GLN 114           HN       GLN 114  -5.893 -11.953 -11.953
  813    HA   GLN 114           HA       GLN 114  -3.423 -13.436 -13.436
  814   1HB   GLN 114           HB2      GLN 114  -5.576 -13.834 -13.834
  815   2HB   GLN 114           HB1      GLN 114  -6.289 -14.418 -14.418
  816   1HG   GLN 114           HG2      GLN 114  -4.976 -16.330 -16.330
  817   2HG   GLN 114           HG1      GLN 114  -3.711 -15.611 -15.611
  818   1HE2  GLN 114          HE22      GLN 114  -5.103 -17.659 -17.659
  819   2HE2  GLN 114          HE21      GLN 114  -3.838 -17.522 -17.522
  820    H    ILE 115           HN       ILE 115  -2.208 -14.422 -14.422
  821    HA   ILE 115           HA       ILE 115  -3.303 -14.666 -14.666
  822    HB   ILE 115           HB       ILE 115  -0.611 -15.217 -15.217
  823   1HG1  ILE 115          HG12      ILE 115  -1.350 -12.821 -12.821
  824   2HG1  ILE 115          HG11      ILE 115   0.142 -13.215 -13.215
  825   1HG2  ILE 115          HG23      ILE 115  -1.554 -15.687 -15.687
  826   2HG2  ILE 115          HG22      ILE 115   0.126 -15.235 -15.235
  827   3HG2  ILE 115          HG21      ILE 115  -0.531 -16.704 -16.704
  828   1HD1  ILE 115          HD13      ILE 115  -2.129 -13.711 -13.711
  829   2HD1  ILE 115          HD12      ILE 115  -2.161 -12.053 -12.053
  830   3HD1  ILE 115          HD11      ILE 115  -0.749 -12.651 -12.651
  831    H    TYR 116           HN       TYR 116  -4.301 -16.614 -16.614
  832    HA   TYR 116           HA       TYR 116  -4.034 -18.957 -18.957
  833   1HB   TYR 116           HB2      TYR 116  -5.890 -18.108 -18.108
  834   2HB   TYR 116           HB1      TYR 116  -5.861 -19.785 -19.785
  835    HD1  TYR 116           HD1      TYR 116  -5.175 -18.661 -18.661
  836    HD2  TYR 116           HD2      TYR 116  -8.328 -18.063 -18.063
  837    HE1  TYR 116           HE1      TYR 116  -6.785 -18.141 -18.141
  838    HE2  TYR 116           HE2      TYR 116  -9.929 -17.579 -17.579
  839    HH   TYR 116           HH       TYR 116  -9.148 -16.705 -16.705
  840    H    VAL 117           HN       VAL 117  -3.467 -21.005 -21.005
  841    HA   VAL 117           HA       VAL 117  -2.254 -21.218 -21.218
  842    HB   VAL 117           HB       VAL 117  -1.125 -22.190 -22.190
  843   1HG1  VAL 117          HG11      VAL 117  -0.190 -22.586 -22.586
  844   2HG1  VAL 117          HG13      VAL 117   0.824 -22.903 -22.903
  845   3HG1  VAL 117          HG12      VAL 117  -0.648 -23.843 -23.843
  846   1HG2  VAL 117          HG21      VAL 117  -0.189 -20.104 -20.104
  847   2HG2  VAL 117          HG23      VAL 117  -0.753 -19.804 -19.804
  848   3HG2  VAL 117          HG22      VAL 117   0.763 -20.664 -20.664
  849    H    ILE 118           HN       ILE 118  -2.060 -23.587 -23.587
  850    HA   ILE 118           HA       ILE 118  -4.491 -25.028 -25.028
  851    HB   ILE 118           HB       ILE 118  -2.584 -25.378 -25.378
  852   1HG1  ILE 118          HG12      ILE 118  -3.638 -23.262 -23.262
  853   2HG1  ILE 118          HG11      ILE 118  -4.506 -24.386 -24.386
  854   1HG2  ILE 118          HG23      ILE 118  -5.240 -26.643 -26.643
  855   2HG2  ILE 118          HG22      ILE 118  -4.598 -26.633 -26.633
  856   3HG2  ILE 118          HG21      ILE 118  -3.712 -27.450 -27.450
  857   1HD1  ILE 118          HD12      ILE 118  -5.910 -24.638 -24.638
  858   2HD1  ILE 118          HD11      ILE 118  -5.430 -22.942 -22.942
  859   3HD1  ILE 118          HD13      ILE 118  -6.351 -23.528 -23.528
  860    H    ASP 119           HN       ASP 119  -4.110 -26.488 -26.488
  861    HA   ASP 119           HA       ASP 119  -1.720 -28.271 -28.271
  862   1HB   ASP 119           HB2      ASP 119  -1.300 -26.353 -26.353
  863   2HB   ASP 119           HB1      ASP 119  -2.709 -26.825 -26.825
  864    HA   PRO 120           HA       PRO 120  -5.075 -31.170 -31.170
  865   1HB   PRO 120           HB2      PRO 120  -3.546 -33.435 -33.435
  866   2HB   PRO 120           HB1      PRO 120  -3.963 -32.705 -32.705
  867   1HG   PRO 120           HG2      PRO 120  -1.449 -32.464 -32.464
  868   2HG   PRO 120           HG1      PRO 120  -1.662 -32.683 -32.683
  869   1HD   PRO 120           HD2      PRO 120  -1.090 -30.283 -30.283
  870   2HD   PRO 120           HD1      PRO 120  -2.106 -30.451 -30.451
  871    H    GLU 121           HN       GLU 121  -5.679 -32.650 -32.650
  872    HA   GLU 121           HA       GLU 121  -4.788 -31.549 -31.549
  873   1HB   GLU 121           HB2      GLU 121  -6.675 -33.789 -33.789
  874   2HB   GLU 121           HB1      GLU 121  -6.514 -33.161 -33.161
  875   1HG   GLU 121           HG2      GLU 121  -7.208 -30.939 -30.939
  876   2HG   GLU 121           HG1      GLU 121  -7.280 -31.494 -31.494
  877    HA   PRO 122           HA       PRO 122  -1.582 -34.658 -34.658
  878   1HB   PRO 122           HB2      PRO 122  -0.888 -34.112 -34.112
  879   2HB   PRO 122           HB1      PRO 122  -0.362 -33.121 -33.121
  880   1HG   PRO 122           HG2      PRO 122  -2.575 -32.645 -32.645
  881   2HG   PRO 122           HG1      PRO 122  -1.414 -31.499 -31.499
  882   1HD   PRO 122           HD2      PRO 122  -3.968 -31.724 -31.724
  883   2HD   PRO 122           HD1      PRO 122  -2.618 -31.243 -31.243
  884    H    CYS 123           HN       CYS 123  -4.506 -34.434 -34.434
  885    HA   CYS 123           HA       CYS 123  -4.001 -37.066 -37.066
  886   1HB   CYS 123           HB2      CYS 123  -6.088 -34.897 -34.897
  887   2HB   CYS 123           HB1      CYS 123  -6.019 -36.380 -36.380
  888    HG   CYS 123           HG       CYS 123  -4.668 -34.315 -34.315
  889    HA   PRO 124           HA       PRO 124  -6.622 -38.653 -38.653
  890   1HB   PRO 124           HB2      PRO 124  -6.553 -41.283 -41.283
  891   2HB   PRO 124           HB1      PRO 124  -5.236 -40.493 -40.493
  892   1HG   PRO 124           HG2      PRO 124  -5.457 -41.100 -41.100
  893   2HG   PRO 124           HG1      PRO 124  -4.054 -41.214 -41.214
  894   1HD   PRO 124           HD2      PRO 124  -4.438 -39.154 -39.154
  895   2HD   PRO 124           HD1      PRO 124  -3.553 -38.988 -38.988
  896    H    ASP 125           HN       ASP 125  -7.198 -38.674 -38.674
  897    HA   ASP 125           HA       ASP 125  -9.717 -40.130 -40.130
  898   1HB   ASP 125           HB2      ASP 125  -9.834 -39.311 -39.311
  899   2HB   ASP 125           HB1      ASP 125  -8.207 -39.882 -39.882
  900    H    SER 126           HN       SER 126 -11.774 -38.965 -38.965
  901    HA   SER 126           HA       SER 126 -12.261 -36.649 -36.649
  902   1HB   SER 126           HB2      SER 126 -14.607 -37.201 -37.201
  903   2HB   SER 126           HB1      SER 126 -13.720 -38.657 -38.657
  904    HG   SER 126           HG       SER 126 -14.660 -37.799 -37.799
  905    H    ASP 127           HN       ASP 127 -11.142 -36.900 -36.900
  906    HA   ASP 127           HA       ASP 127 -12.852 -35.166 -35.166
  907   1HB   ASP 127           HB2      ASP 127 -10.999 -36.699 -36.699
  908   2HB   ASP 127           HB1      ASP 127  -9.844 -35.510 -35.510
  909    H    GLN 128           HN       GLN 128 -12.991 -32.940 -32.940
  910    HA   GLN 128           HA       GLN 128 -11.141 -31.395 -31.395
  911   1HB   GLN 128           HB2      GLN 128 -14.050 -30.988 -30.988
  912   2HB   GLN 128           HB1      GLN 128 -13.124 -29.876 -29.876
  913   1HG   GLN 128           HG2      GLN 128 -13.585 -32.805 -32.805
  914   2HG   GLN 128           HG1      GLN 128 -14.491 -31.467 -31.467
  915   1HE2  GLN 128          HE21      GLN 128 -12.795 -33.311 -33.311
  916   2HE2  GLN 128          HE22      GLN 128 -11.543 -32.388 -32.388
  917    H    GLU 129           HN       GLU 129 -10.233 -29.499 -29.499
  918    HA   GLU 129           HA       GLU 129  -9.415 -28.057 -28.057
  919   1HB   GLU 129           HB2      GLU 129 -12.321 -28.411 -28.411
  920   2HB   GLU 129           HB1      GLU 129 -11.265 -27.143 -27.143
  921   1HG   GLU 129           HG2      GLU 129 -11.897 -27.570 -27.570
  922   2HG   GLU 129           HG1      GLU 129 -12.670 -26.363 -26.363
  923    HA   PRO 130           HA       PRO 130  -9.459 -31.675 -31.675
  924   1HB   PRO 130           HB2      PRO 130  -6.986 -32.726 -32.726
  925   2HB   PRO 130           HB1      PRO 130  -8.469 -33.292 -33.292
  926   1HG   PRO 130           HG2      PRO 130  -6.379 -31.423 -31.423
  927   2HG   PRO 130           HG1      PRO 130  -7.251 -32.707 -32.707
  928   1HD   PRO 130           HD2      PRO 130  -7.884 -30.080 -30.080
  929   2HD   PRO 130           HD1      PRO 130  -9.085 -31.383 -31.383
  930    H    LYS 131           HN       LYS 131  -8.323 -31.508 -31.508
  931    HA   LYS 131           HA       LYS 131  -5.907 -29.877 -29.877
  932   1HB   LYS 131           HB2      LYS 131  -7.729 -28.215 -28.215
  933   2HB   LYS 131           HB1      LYS 131  -8.574 -28.858 -28.858
  934   1HG   LYS 131           HG2      LYS 131  -6.705 -28.245 -28.245
  935   2HG   LYS 131           HG1      LYS 131  -5.777 -27.688 -27.688
  936   1HD   LYS 131           HD2      LYS 131  -7.556 -26.005 -26.005
  937   2HD   LYS 131           HD1      LYS 131  -8.392 -26.519 -26.519
  938   1HE   LYS 131           HE2      LYS 131  -6.476 -25.854 -25.854
  939   2HE   LYS 131           HE1      LYS 131  -5.558 -25.419 -25.419
  940   1HZ   LYS 131           HZ2      LYS 131  -7.300 -23.853 -23.853
  941   2HZ   LYS 131           HZ1      LYS 131  -8.171 -24.254 -24.254
  942   3HZ   LYS 131           HZ3      LYS 131  -6.669 -23.478 -23.478
  943    H1   NAG 132           H1       NAG 132  -5.919  -6.139  -6.139
  944    H2   NAG 132           H2       NAG 132  -5.717  -3.825  -3.825
  945    H3   NAG 132           H3       NAG 132  -4.253  -6.522  -6.522
  946    H4   NAG 132           H4       NAG 132  -6.488  -5.608  -5.608
  947    H5   NAG 132           H5       NAG 132  -6.602  -7.722  -7.722
  948   1H6   NAG 132           H61      NAG 132  -8.750  -8.150  -8.150
  949   2H6   NAG 132           H62      NAG 132  -8.002  -7.872  -7.872
  950   1H8   NAG 132           H81      NAG 132  -2.634  -2.150  -2.150
  951   2H8   NAG 132           H82      NAG 132  -1.583  -2.138  -2.138
  952   3H8   NAG 132           H83      NAG 132  -1.763  -3.635  -3.635
  953    HN2  NAG 132           HN2      NAG 132  -3.868  -4.754  -4.754
  954    HO3  NAG 132           HO3      NAG 132  -3.077  -5.439  -5.439
  955    H1   NAG 133           H1       NAG 133  -6.578  -7.221  -7.221
  956    H2   NAG 133           H2       NAG 133  -3.716  -8.340  -8.340
  957    H3   NAG 133           H3       NAG 133  -5.555  -8.132  -8.132
  958    H4   NAG 133           H4       NAG 133  -3.033  -6.510  -6.510
  959    H5   NAG 133           H5       NAG 133  -5.957  -5.564  -5.564
  960   1H6   NAG 133           H61      NAG 133  -3.414  -4.136  -4.136
  961   2H6   NAG 133           H62      NAG 133  -4.269  -3.934  -3.934
  962   1H8   NAG 133           H81      NAG 133  -8.252  -8.803  -8.803
  963   2H8   NAG 133           H82      NAG 133  -7.343  -9.761  -9.761
  964   3H8   NAG 133           H83      NAG 133  -8.386 -10.586 -10.586
  965    HN2  NAG 133           HN2      NAG 133  -4.865 -10.301 -10.301
  966    HO3  NAG 133           HO3      NAG 133  -3.909  -9.835  -9.835
  967    HO6  NAG 133           HO6      NAG 133  -6.181  -3.429  -3.429
  968    H1   FUC 134           H1       FUC 134 -10.511  -7.195  -7.195
  969    H2   FUC 134           H2       FUC 134 -11.726  -7.580  -7.580
  970    H3   FUC 134           H3       FUC 134  -9.094  -6.776  -6.776
  971    H4   FUC 134           H4       FUC 134 -10.471  -4.778  -4.778
  972    H5   FUC 134           H5       FUC 134  -9.954  -4.325  -4.325
  973   1H6   FUC 134           H61      FUC 134 -11.473  -2.671  -2.671
  974   2H6   FUC 134           H62      FUC 134 -11.990  -3.130  -3.130
  975   3H6   FUC 134           H63      FUC 134 -12.851  -3.792  -3.792
  976    HO2  FUC 134           HO2      FUC 134 -10.289  -9.370  -9.370
  977    HO3  FUC 134           HO3      FUC 134  -9.612  -7.550  -7.550
  978    HO4  FUC 134           HO4      FUC 134 -12.204  -5.563  -5.563
  979    H1   MAN 135           H1       MAN 135  -2.130  -6.643  -6.643
  980    H2   MAN 135           H2       MAN 135  -2.467  -4.184  -4.184
  981    H3   MAN 135           H3       MAN 135  -0.469  -4.821  -4.821
  982    H4   MAN 135           H4       MAN 135  -2.127  -4.780  -4.780
  983    H5   MAN 135           H5       MAN 135  -0.955  -7.194  -7.194
  984   1H6   MAN 135           H61      MAN 135  -1.956  -8.547  -8.547
  985   2H6   MAN 135           H62      MAN 135  -1.079  -7.291  -7.291
  986    HO2  MAN 135           HO2      MAN 135  -4.019  -3.290  -3.290
  987    HO3  MAN 135           HO3      MAN 135  -1.247  -2.561  -2.561
  988    HO4  MAN 135           HO4      MAN 135   0.571  -5.386  -5.386
  989    HO6  MAN 135           HO6      MAN 135  -3.161  -6.154  -6.154
  990    H1   NAG 136           H1       NAG 136   0.548  -6.662  -6.662
  991    H2   NAG 136           H2       NAG 136  -2.287  -6.375  -6.375
  992    H3   NAG 136           H3       NAG 136  -0.113  -8.425  -8.425
  993    H4   NAG 136           H4       NAG 136  -1.064  -6.105  -6.105
  994    H5   NAG 136           H5       NAG 136   1.537  -6.302  -6.302
  995   1H6   NAG 136           H61      NAG 136   1.985  -4.172  -4.172
  996   2H6   NAG 136           H62      NAG 136   1.371  -5.117  -5.117
  997   1H8   NAG 136           H81      NAG 136  -2.721  -7.987  -7.987
  998   2H8   NAG 136           H82      NAG 136  -4.212  -7.193  -7.193
  999   3H8   NAG 136           H83      NAG 136  -4.151  -8.974  -8.974
 1000    HN2  NAG 136           HN2      NAG 136  -1.118  -8.406  -8.406
 1001    HO3  NAG 136           HO3      NAG 136  -2.606  -7.865  -7.865
 1002    H1   NAG 137           H1       NAG 137   1.840  -7.683  -7.683
 1003    H2   NAG 137           H2       NAG 137   1.023  -9.590  -9.590
 1004    H3   NAG 137           H3       NAG 137   3.405  -9.848  -9.848
 1005    H4   NAG 137           H4       NAG 137   3.397  -9.227  -9.227
 1006    H5   NAG 137           H5       NAG 137   4.092  -7.353  -7.353
 1007   1H6   NAG 137           H61      NAG 137   3.926  -5.687  -5.687
 1008   2H6   NAG 137           H62      NAG 137   4.143  -7.089  -7.089
 1009   1H8   NAG 137           H81      NAG 137  -1.280 -11.681 -11.681
 1010   2H8   NAG 137           H82      NAG 137  -0.670 -12.978 -12.978
 1011   3H8   NAG 137           H83      NAG 137   0.442 -12.154 -12.154
 1012    HN2  NAG 137           HN2      NAG 137   1.018  -9.896  -9.896
 1013    HO3  NAG 137           HO3      NAG 137   3.792 -11.653 -11.653
 1014    HO6  NAG 137           HO6      NAG 137   6.029  -5.754  -5.754
 1015    H1   FUC 138           H1       FUC 138  -0.143  -4.072  -4.072
 1016    H2   FUC 138           H2       FUC 138  -1.137  -1.332  -1.332
 1017    H3   FUC 138           H3       FUC 138  -1.298  -1.875  -1.875
 1018    H4   FUC 138           H4       FUC 138   0.422   0.106   0.106
 1019    H5   FUC 138           H5       FUC 138   1.655  -2.207  -2.207
 1020   1H6   FUC 138           H61      FUC 138   2.563   0.350   0.350
 1021   2H6   FUC 138           H62      FUC 138   3.526  -1.012  -1.012
 1022   3H6   FUC 138           H63      FUC 138   3.078  -0.978  -0.978
 1023    HO2  FUC 138           HO2      FUC 138  -2.271  -3.738  -3.738
 1024    HO3  FUC 138           HO3      FUC 138  -2.922  -0.671  -0.671
 1025    HO4  FUC 138           HO4      FUC 138  -0.461   1.062   1.062
 1026    H1   MAN 139           H1       MAN 139   5.461  -8.590  -8.590
 1027    H2   MAN 139           H2       MAN 139   7.570  -8.430  -8.430
 1028    H3   MAN 139           H3       MAN 139   7.881  -8.589  -8.589
 1029    H4   MAN 139           H4       MAN 139   7.958 -11.621 -11.621
 1030    H5   MAN 139           H5       MAN 139   5.768  -9.873  -9.873
 1031   1H6   MAN 139           H61      MAN 139   4.511 -11.935 -11.935
 1032   2H6   MAN 139           H62      MAN 139   6.006 -12.023 -12.023
 1033    HO2  MAN 139           HO2      MAN 139   8.176 -10.112 -10.112
 1034    HO3  MAN 139           HO3      MAN 139   9.927  -8.833  -8.833
 1035    HO4  MAN 139           HO4      MAN 139   9.072 -11.144 -11.144
 1036    HO6  MAN 139           HO6      MAN 139   5.309 -13.801 -13.801

  Start of MODEL   12
    1   1H    ALA   1           HT1      ALA   1  -5.075   6.111   6.111
    2   2H    ALA   1           HT3      ALA   1  -4.422   7.648   7.648
    3   3H    ALA   1           HT2      ALA   1  -3.685   6.618   6.618
    4    HA   ALA   1           HA       ALA   1  -5.417   6.865   6.865
    5   1HB   ALA   1           HB2      ALA   1  -4.601   9.374   9.374
    6   2HB   ALA   1           HB1      ALA   1  -5.540   9.447   9.447
    7   3HB   ALA   1           HB3      ALA   1  -3.932   8.723   8.723
    8    H    MET   1           HN       MET   1  -6.316   7.831   7.831
    9    HA   MET   1           HA       MET   1  -9.075   8.528   8.528
   10   1HB   MET   1           HB2      MET   1  -7.572   8.322   8.322
   11   2HB   MET   1           HB1      MET   1  -9.243   8.873   8.873
   12   1HG   MET   1           HG2      MET   1  -8.557  10.716  10.716
   13   2HG   MET   1           HG1      MET   1  -6.891  10.136  10.136
   14   1HE   MET   1           HE1      MET   1  -5.692   9.580   9.580
   15   2HE   MET   1           HE3      MET   1  -6.204   9.682   9.682
   16   3HE   MET   1           HE2      MET   1  -5.206  10.954  10.954
   17    H    HIS   2           HN       HIS   2  -8.120   6.431   6.431
   18    HA   HIS   2           HA       HIS   2 -10.005   4.349   4.349
   19   1HB   HIS   2           HB2      HIS   2  -9.481   5.326   5.326
   20   2HB   HIS   2           HB1      HIS   2 -10.534   3.970   3.970
   21    HD1  HIS   2           HD1      HIS   2 -12.668   4.550   4.550
   22    HD2  HIS   2           HD2      HIS   2 -10.653   7.844   7.844
   23    HE1  HIS   2           HE1      HIS   2 -14.235   6.526   6.526
   24    H    VAL   3           HN       VAL   3  -8.913   2.495   2.495
   25    HA   VAL   3           HA       VAL   3  -6.613   1.704   1.704
   26    HB   VAL   3           HB       VAL   3  -6.909   1.522   1.522
   27   1HG1  VAL   3          HG13      VAL   3  -5.718  -0.436  -0.436
   28   2HG1  VAL   3          HG12      VAL   3  -4.615   0.652   0.652
   29   3HG1  VAL   3          HG11      VAL   3  -4.626   0.601   0.601
   30   1HG2  VAL   3          HG21      VAL   3  -5.118   3.165   3.165
   31   2HG2  VAL   3          HG23      VAL   3  -6.350   3.772   3.772
   32   3HG2  VAL   3          HG22      VAL   3  -4.882   3.026   3.026
   33    H    ALA   4           HN       ALA   4  -7.005  -0.283  -0.283
   34    HA   ALA   4           HA       ALA   4  -8.930  -2.130  -2.130
   35   1HB   ALA   4           HB2      ALA   4  -9.375  -0.840  -0.840
   36   2HB   ALA   4           HB1      ALA   4  -8.497  -2.227  -2.227
   37   3HB   ALA   4           HB3      ALA   4  -9.978  -2.472  -2.472
   38    H    GLN   5           HN       GLN   5  -8.246  -4.236  -4.236
   39    HA   GLN   5           HA       GLN   5  -5.924  -5.249  -5.249
   40   1HB   GLN   5           HB2      GLN   5  -4.687  -5.717  -5.717
   41   2HB   GLN   5           HB1      GLN   5  -5.041  -3.993  -3.993
   42   1HG   GLN   5           HG2      GLN   5  -7.252  -4.741  -4.741
   43   2HG   GLN   5           HG1      GLN   5  -6.194  -6.024  -6.024
   44   1HE2  GLN   5          HE22      GLN   5  -5.895  -3.062  -3.062
   45   2HE2  GLN   5          HE21      GLN   5  -7.202  -4.012  -4.012
   46    HA   PRO   6           HA       PRO   6  -8.302  -8.989  -8.989
   47   1HB   PRO   6           HB2      PRO   6  -6.391 -10.819 -10.819
   48   2HB   PRO   6           HB1      PRO   6  -7.223  -9.809  -9.809
   49   1HG   PRO   6           HG2      PRO   6  -4.514  -9.488  -9.488
   50   2HG   PRO   6           HG1      PRO   6  -5.058  -9.210  -9.210
   51   1HD   PRO   6           HD2      PRO   6  -4.647  -7.206  -7.206
   52   2HD   PRO   6           HD1      PRO   6  -5.815  -7.100  -7.100
   53    H    ALA   7           HN       ALA   7  -8.558 -10.580 -10.580
   54    HA   ALA   7           HA       ALA   7  -6.839 -10.261 -10.261
   55   1HB   ALA   7           HB2      ALA   7  -9.360 -10.428 -10.428
   56   2HB   ALA   7           HB1      ALA   7  -9.204 -12.095 -12.095
   57   3HB   ALA   7           HB3      ALA   7  -8.572 -11.627 -11.627
   58    H    VAL   8           HN       VAL   8  -7.286 -12.550 -12.550
   59    HA   VAL   8           HA       VAL   8  -4.897 -13.964 -13.964
   60    HB   VAL   8           HB       VAL   8  -7.090 -14.838 -14.838
   61   1HG1  VAL   8          HG11      VAL   8  -7.808 -15.233 -15.233
   62   2HG1  VAL   8          HG13      VAL   8  -7.640 -16.821 -16.821
   63   3HG1  VAL   8          HG12      VAL   8  -8.739 -15.607 -15.607
   64   1HG2  VAL   8          HG23      VAL   8  -4.717 -15.944 -15.944
   65   2HG2  VAL   8          HG22      VAL   8  -6.046 -16.801 -16.801
   66   3HG2  VAL   8          HG21      VAL   8  -5.679 -17.059 -17.059
   67    H    VAL   9           HN       VAL   9  -4.022 -15.277 -15.277
   68    HA   VAL   9           HA       VAL   9  -5.315 -14.969 -14.969
   69    HB   VAL   9           HB       VAL   9  -2.634 -14.040 -14.040
   70   1HG1  VAL   9          HG13      VAL   9  -3.345 -14.977 -14.977
   71   2HG1  VAL   9          HG12      VAL   9  -2.205 -13.649 -13.649
   72   3HG1  VAL   9          HG11      VAL   9  -1.851 -15.236 -15.236
   73   1HG2  VAL   9          HG23      VAL   9  -4.843 -12.668 -12.668
   74   2HG2  VAL   9          HG22      VAL   9  -3.313 -11.984 -11.984
   75   3HG2  VAL   9          HG21      VAL   9  -4.408 -12.726 -12.726
   76    H    LEU  10           HN       LEU  10  -4.746 -16.593 -16.593
   77    HA   LEU  10           HA       LEU  10  -3.542 -19.041 -19.041
   78   1HB   LEU  10           HB2      LEU  10  -5.325 -18.624 -18.624
   79   2HB   LEU  10           HB1      LEU  10  -4.823 -20.189 -20.189
   80    HG   LEU  10           HG       LEU  10  -6.453 -18.124 -18.124
   81   1HD1  LEU  10          HD12      LEU  10  -7.174 -20.658 -20.658
   82   2HD1  LEU  10          HD11      LEU  10  -8.193 -20.019 -20.019
   83   3HD1  LEU  10          HD13      LEU  10  -7.895 -19.056 -19.056
   84   1HD2  LEU  10          HD23      LEU  10  -5.112 -20.667 -20.667
   85   2HD2  LEU  10          HD22      LEU  10  -5.522 -19.269 -19.269
   86   3HD2  LEU  10          HD21      LEU  10  -6.760 -20.457 -20.457
   87    H    ALA  11           HN       ALA  11  -1.524 -19.599 -19.599
   88    HA   ALA  11           HA       ALA  11  -0.111 -18.031 -18.031
   89   1HB   ALA  11           HB3      ALA  11   0.333 -20.549 -20.549
   90   2HB   ALA  11           HB2      ALA  11   1.463 -20.145 -20.145
   91   3HB   ALA  11           HB1      ALA  11   1.228 -19.029 -19.029
   92    H    SER  12           HN       SER  12   0.647 -18.710 -18.710
   93    HA   SER  12           HA       SER  12  -1.232 -20.519 -20.519
   94   1HB   SER  12           HB2      SER  12   0.882 -18.550 -18.550
   95   2HB   SER  12           HB1      SER  12  -0.249 -19.399 -19.399
   96    HG   SER  12           HG       SER  12  -1.679 -17.955 -17.955
   97    H    SER  13           HN       SER  13   0.053 -21.664 -21.664
   98    HA   SER  13           HA       SER  13   1.614 -23.773 -23.773
   99   1HB   SER  13           HB2      SER  13   1.549 -22.504 -22.504
  100   2HB   SER  13           HB1      SER  13   2.239 -24.088 -24.088
  101    HG   SER  13           HG       SER  13  -0.157 -23.736 -23.736
  102    H    ARG  14           HN       ARG  14   3.936 -24.225 -24.225
  103    HA   ARG  14           HA       ARG  14   6.215 -23.712 -23.712
  104   1HB   ARG  14           HB2      ARG  14   5.140 -21.502 -21.502
  105   2HB   ARG  14           HB1      ARG  14   6.825 -21.486 -21.486
  106   1HG   ARG  14           HG2      ARG  14   6.184 -24.141 -24.141
  107   2HG   ARG  14           HG1      ARG  14   5.628 -23.002 -23.002
  108   1HD   ARG  14           HD2      ARG  14   8.296 -22.359 -22.359
  109   2HD   ARG  14           HD1      ARG  14   8.220 -23.893 -23.893
  110    HE   ARG  14           HE       ARG  14   7.783 -21.226 -21.226
  111   1HH1  ARG  14          HH21      ARG  14   7.130 -24.648 -24.648
  112   2HH1  ARG  14          HH22      ARG  14   6.871 -24.535 -24.535
  113   1HH2  ARG  14          HH11      ARG  14   7.434 -21.128 -21.128
  114   2HH2  ARG  14          HH12      ARG  14   7.039 -22.566 -22.566
  115    H    GLY  15           HN       GLY  15   4.039 -22.479 -22.479
  116   1HA   GLY  15           HA2      GLY  15   4.175 -21.288 -21.288
  117   2HA   GLY  15           HA1      GLY  15   5.917 -21.218 -21.218
  118    H    ILE  16           HN       ILE  16   3.413 -19.868 -19.868
  119    HA   ILE  16           HA       ILE  16   4.704 -17.205 -17.205
  120    HB   ILE  16           HB       ILE  16   2.969 -18.529 -18.529
  121   1HG1  ILE  16          HG12      ILE  16   4.771 -17.967 -17.967
  122   2HG1  ILE  16          HG11      ILE  16   5.530 -16.939 -16.939
  123   1HG2  ILE  16          HG21      ILE  16   3.319 -15.601 -15.601
  124   2HG2  ILE  16          HG23      ILE  16   3.289 -16.138 -16.138
  125   3HG2  ILE  16          HG22      ILE  16   1.911 -16.460 -16.460
  126   1HD1  ILE  16          HD13      ILE  16   5.112 -19.844 -19.844
  127   2HD1  ILE  16          HD12      ILE  16   6.472 -19.347 -19.347
  128   3HD1  ILE  16          HD11      ILE  16   6.329 -18.751 -18.751
  129    H    ALA  17           HN       ALA  17   3.726 -16.358 -16.358
  130    HA   ALA  17           HA       ALA  17   0.735 -16.357 -16.357
  131   1HB   ALA  17           HB1      ALA  17   2.038 -17.200 -17.200
  132   2HB   ALA  17           HB3      ALA  17   2.863 -15.644 -15.644
  133   3HB   ALA  17           HB2      ALA  17   1.130 -15.745 -15.745
  134    H    SER  18           HN       SER  18  -0.260 -14.487 -14.487
  135    HA   SER  18           HA       SER  18   1.259 -11.917 -11.917
  136   1HB   SER  18           HB2      SER  18   0.490 -11.348 -11.348
  137   2HB   SER  18           HB1      SER  18   1.367 -12.873 -12.873
  138    HG   SER  18           HG       SER  18  -0.418 -13.885 -13.885
  139    H    PHE  19           HN       PHE  19  -0.027 -10.088 -10.088
  140    HA   PHE  19           HA       PHE  19  -2.957 -10.260 -10.260
  141   1HB   PHE  19           HB2      PHE  19  -3.053  -9.719  -9.719
  142   2HB   PHE  19           HB1      PHE  19  -2.353 -11.300 -11.300
  143    HD1  PHE  19           HD1      PHE  19   0.161 -11.605 -11.605
  144    HD2  PHE  19           HD2      PHE  19  -1.783  -7.965  -7.965
  145    HE1  PHE  19           HE1      PHE  19   2.227 -10.956 -10.956
  146    HE2  PHE  19           HE2      PHE  19   0.288  -7.314  -7.314
  147    HZ   PHE  19           HZ       PHE  19   2.292  -8.815  -8.815
  148    H    VAL  20           HN       VAL  20  -3.882  -8.079  -8.079
  149    HA   VAL  20           HA       VAL  20  -1.895  -5.912  -5.912
  150    HB   VAL  20           HB       VAL  20  -4.735  -6.232  -6.232
  151   1HG1  VAL  20          HG13      VAL  20  -4.033  -3.862  -3.862
  152   2HG1  VAL  20          HG12      VAL  20  -2.645  -4.154  -4.154
  153   3HG1  VAL  20          HG11      VAL  20  -4.282  -4.254  -4.254
  154   1HG2  VAL  20          HG22      VAL  20  -2.988  -7.766  -7.766
  155   2HG2  VAL  20          HG21      VAL  20  -3.761  -6.686  -6.686
  156   3HG2  VAL  20          HG23      VAL  20  -2.143  -6.323  -6.323
  157    H    CYS  21           HN       CYS  21  -1.713  -4.682  -4.682
  158    HA   CYS  21           HA       CYS  21  -4.093  -4.200  -4.200
  159   1HB   CYS  21           HB2      CYS  21  -1.934  -5.037  -5.037
  160   2HB   CYS  21           HB1      CYS  21  -1.129  -3.597  -3.597
  161    H    GLU  22           HN       GLU  22  -5.233  -2.407  -2.407
  162    HA   GLU  22           HA       GLU  22  -3.856  -0.321  -0.321
  163   1HB   GLU  22           HB2      GLU  22  -6.040   0.446   0.446
  164   2HB   GLU  22           HB1      GLU  22  -6.182  -1.305  -1.305
  165   1HG   GLU  22           HG2      GLU  22  -6.954  -1.084  -1.084
  166   2HG   GLU  22           HG1      GLU  22  -6.853   0.668   0.668
  167    H    TYR  23           HN       TYR  23  -4.101   2.001   2.001
  168    HA   TYR  23           HA       TYR  23  -4.322   2.594   2.594
  169   1HB   TYR  23           HB2      TYR  23  -2.088   3.571   3.571
  170   2HB   TYR  23           HB1      TYR  23  -1.967   1.927   1.927
  171    HD1  TYR  23           HD2      TYR  23  -1.841   5.532   5.532
  172    HD2  TYR  23           HD1      TYR  23  -1.410   1.471   1.471
  173    HE1  TYR  23           HE2      TYR  23  -0.759   6.387   6.387
  174    HE2  TYR  23           HE1      TYR  23  -0.328   2.329   2.329
  175    HH   TYR  23           HH       TYR  23  -0.402   5.617   5.617
  176    H    ALA  24           HN       ALA  24  -3.934   5.138   5.138
  177    HA   ALA  24           HA       ALA  24  -5.361   6.440   6.440
  178   1HB   ALA  24           HB3      ALA  24  -6.636   5.960   5.960
  179   2HB   ALA  24           HB2      ALA  24  -5.593   7.160   7.160
  180   3HB   ALA  24           HB1      ALA  24  -6.666   7.634   7.634
  181    H    SER  25           HN       SER  25  -4.349   8.211   8.211
  182    HA   SER  25           HA       SER  25  -2.440   9.751   9.751
  183   1HB   SER  25           HB2      SER  25  -0.761   9.601   9.601
  184   2HB   SER  25           HB1      SER  25  -1.221   7.987   7.987
  185    HG   SER  25           HG       SER  25  -1.526   9.191   9.191
  186    HA   PRO  26           HA       PRO  26  -4.279  13.212  13.212
  187   1HB   PRO  26           HB2      PRO  26  -2.182  14.953  14.953
  188   2HB   PRO  26           HB1      PRO  26  -2.976  14.600  14.600
  189   1HG   PRO  26           HG2      PRO  26  -0.431  13.518  13.518
  190   2HG   PRO  26           HG1      PRO  26  -0.818  14.021  14.021
  191   1HD   PRO  26           HD2      PRO  26  -0.755  11.424  11.424
  192   2HD   PRO  26           HD1      PRO  26  -1.832  12.027  12.027
  193    H    GLY  27           HN       GLY  27  -1.783  11.436  11.436
  194   1HA   GLY  27           HA2      GLY  27  -1.903  11.003  11.003
  195   2HA   GLY  27           HA1      GLY  27  -2.584  12.617  12.617
  196    H    LYS  28           HN       LYS  28  -0.548  12.197  12.197
  197    HA   LYS  28           HA       LYS  28   1.626  12.895  12.895
  198   1HB   LYS  28           HB2      LYS  28   0.968  14.809  14.809
  199   2HB   LYS  28           HB1      LYS  28   2.246  15.064  15.064
  200   1HG   LYS  28           HG2      LYS  28   0.438  14.806  14.806
  201   2HG   LYS  28           HG1      LYS  28  -0.733  14.957  14.957
  202   1HD   LYS  28           HD2      LYS  28  -0.424  17.165  17.165
  203   2HD   LYS  28           HD1      LYS  28   0.460  17.112  17.112
  204   1HE   LYS  28           HE2      LYS  28   2.571  16.744  16.744
  205   2HE   LYS  28           HE1      LYS  28   1.711  16.687  16.687
  206   1HZ   LYS  28           HZ1      LYS  28   0.829  18.914  18.914
  207   2HZ   LYS  28           HZ3      LYS  28   1.775  18.974  18.974
  208   3HZ   LYS  28           HZ2      LYS  28   2.524  18.911  18.911
  209    H    ALA  29           HN       ALA  29   3.677  13.981  13.981
  210    HA   ALA  29           HA       ALA  29   5.406  13.235  13.235
  211   1HB   ALA  29           HB1      ALA  29   3.056  12.982  12.982
  212   2HB   ALA  29           HB3      ALA  29   3.607  11.307  11.307
  213   3HB   ALA  29           HB2      ALA  29   4.621  12.577  12.577
  214    H    THR  30           HN       THR  30   6.940  11.914  11.914
  215    HA   THR  30           HA       THR  30   6.252   9.441   9.441
  216    HB   THR  30           HB       THR  30   8.653   9.356   9.356
  217    HG1  THR  30           HG1      THR  30   9.983  10.887  10.887
  218   1HG2  THR  30          HG22      THR  30   7.066  11.535  11.535
  219   2HG2  THR  30          HG21      THR  30   8.562  12.243  12.243
  220   3HG2  THR  30          HG23      THR  30   8.618  11.089  11.089
  221    H    GLU  31           HN       GLU  31   7.765  10.326  10.326
  222    HA   GLU  31           HA       GLU  31   8.620   7.624   7.624
  223   1HB   GLU  31           HB2      GLU  31   8.323  10.111  10.111
  224   2HB   GLU  31           HB1      GLU  31   9.276   8.689   8.689
  225   1HG   GLU  31           HG2      GLU  31   9.819  10.089  10.089
  226   2HG   GLU  31           HG1      GLU  31  10.435  10.792  10.792
  227    H    VAL  32           HN       VAL  32   7.345   6.064   6.064
  228    HA   VAL  32           HA       VAL  32   5.159   6.666   6.666
  229    HB   VAL  32           HB       VAL  32   5.122   4.771   4.771
  230   1HG1  VAL  32          HG13      VAL  32   3.846   4.379   4.379
  231   2HG1  VAL  32          HG12      VAL  32   2.635   5.306   5.306
  232   3HG1  VAL  32          HG11      VAL  32   3.244   3.790   3.790
  233   1HG2  VAL  32          HG21      VAL  32   4.045   7.499   7.499
  234   2HG2  VAL  32          HG23      VAL  32   4.592   6.788   6.788
  235   3HG2  VAL  32          HG22      VAL  32   2.996   6.389   6.389
  236    H    ARG  33           HN       ARG  33   6.863   6.071   6.071
  237    HA   ARG  33           HA       ARG  33   8.429   3.725   3.725
  238   1HB   ARG  33           HB2      ARG  33   8.634   5.741   5.741
  239   2HB   ARG  33           HB1      ARG  33   7.292   5.082   5.082
  240   1HG   ARG  33           HG2      ARG  33   8.595   3.523   3.523
  241   2HG   ARG  33           HG1      ARG  33   9.381   3.088   3.088
  242   1HD   ARG  33           HD2      ARG  33  10.812   5.130   5.130
  243   2HD   ARG  33           HD1      ARG  33  10.077   5.457   5.457
  244    HE   ARG  33           HE       ARG  33  10.927   2.755   2.755
  245   1HH1  ARG  33          HH21      ARG  33  12.355   5.941   5.941
  246   2HH1  ARG  33          HH22      ARG  33  13.829   5.440   5.440
  247   1HH2  ARG  33          HH11      ARG  33  12.848   2.152   2.152
  248   2HH2  ARG  33          HH12      ARG  33  14.109   3.318   3.318
  249    H    VAL  34           HN       VAL  34   7.703   1.673   1.673
  250    HA   VAL  34           HA       VAL  34   5.271   0.906   0.906
  251    HB   VAL  34           HB       VAL  34   5.103  -0.941  -0.941
  252   1HG1  VAL  34          HG13      VAL  34   5.117   1.930   1.930
  253   2HG1  VAL  34          HG12      VAL  34   4.912   0.717   0.717
  254   3HG1  VAL  34          HG11      VAL  34   3.773   0.791   0.791
  255   1HG2  VAL  34          HG21      VAL  34   7.793  -0.407  -0.407
  256   2HG2  VAL  34          HG23      VAL  34   6.768  -1.468  -1.468
  257   3HG2  VAL  34          HG22      VAL  34   6.996   0.215   0.215
  258    H    THR  35           HN       THR  35   5.437  -1.095  -1.095
  259    HA   THR  35           HA       THR  35   8.123  -2.343  -2.343
  260    HB   THR  35           HB       THR  35   6.606  -1.140  -1.140
  261    HG1  THR  35           HG1      THR  35   8.996  -0.339  -0.339
  262   1HG2  THR  35          HG21      THR  35   9.122  -2.756  -2.756
  263   2HG2  THR  35          HG23      THR  35   8.981  -1.596  -1.596
  264   3HG2  THR  35          HG22      THR  35   7.831  -2.926  -2.926
  265    H    VAL  36           HN       VAL  36   7.992  -4.501  -4.501
  266    HA   VAL  36           HA       VAL  36   5.271  -5.593  -5.593
  267    HB   VAL  36           HB       VAL  36   7.655  -6.776  -6.776
  268   1HG1  VAL  36          HG13      VAL  36   4.895  -7.873  -7.873
  269   2HG1  VAL  36          HG12      VAL  36   5.964  -8.557  -8.557
  270   3HG1  VAL  36          HG11      VAL  36   6.447  -8.564  -8.564
  271   1HG2  VAL  36          HG23      VAL  36   5.085  -5.471  -5.471
  272   2HG2  VAL  36          HG22      VAL  36   6.717  -5.234  -5.234
  273   3HG2  VAL  36          HG21      VAL  36   5.829  -6.705  -6.705
  274    H    LEU  37           HN       LEU  37   5.107  -6.739  -6.739
  275    HA   LEU  37           HA       LEU  37   7.765  -7.383  -7.383
  276   1HB   LEU  37           HB2      LEU  37   5.120  -6.563  -6.563
  277   2HB   LEU  37           HB1      LEU  37   6.593  -6.907  -6.907
  278    HG   LEU  37           HG       LEU  37   6.623  -4.838  -4.838
  279   1HD1  LEU  37          HD13      LEU  37   4.938  -4.715  -4.715
  280   2HD1  LEU  37          HD12      LEU  37   6.278  -3.598  -3.598
  281   3HD1  LEU  37          HD11      LEU  37   5.266  -3.444  -3.444
  282   1HD2  LEU  37          HD22      LEU  37   8.364  -5.827  -5.827
  283   2HD2  LEU  37          HD21      LEU  37   8.765  -4.834  -4.834
  284   3HD2  LEU  37          HD23      LEU  37   8.165  -4.074  -4.074
  285    H    ARG  38           HN       ARG  38   7.748  -9.181  -9.181
  286    HA   ARG  38           HA       ARG  38   5.653 -11.251 -11.251
  287   1HB   ARG  38           HB2      ARG  38   7.958 -11.707 -11.707
  288   2HB   ARG  38           HB1      ARG  38   8.574 -11.595 -11.595
  289   1HG   ARG  38           HG2      ARG  38   7.175 -13.476 -13.476
  290   2HG   ARG  38           HG1      ARG  38   6.450 -13.554 -13.554
  291   1HD   ARG  38           HD2      ARG  38   8.152 -15.262 -15.262
  292   2HD   ARG  38           HD1      ARG  38   8.821 -13.948 -13.948
  293    HE   ARG  38           HE       ARG  38   9.600 -14.621 -14.621
  294   1HH1  ARG  38          HH21      ARG  38   9.862 -12.393 -12.393
  295   2HH1  ARG  38          HH22      ARG  38  11.292 -11.661 -11.661
  296   1HH2  ARG  38          HH11      ARG  38  11.449 -13.638 -13.638
  297   2HH2  ARG  38          HH12      ARG  38  12.182 -12.352 -12.352
  298    H    GLN  39           HN       GLN  39   4.506 -11.907 -11.907
  299    HA   GLN  39           HA       GLN  39   5.480 -10.923 -10.923
  300   1HB   GLN  39           HB2      GLN  39   3.215 -10.332 -10.332
  301   2HB   GLN  39           HB1      GLN  39   2.791 -12.031 -12.031
  302   1HG   GLN  39           HG2      GLN  39   3.452 -11.858 -11.858
  303   2HG   GLN  39           HG1      GLN  39   3.495 -10.111 -10.111
  304   1HE2  GLN  39          HE22      GLN  39   0.004  -9.771  -9.771
  305   2HE2  GLN  39          HE21      GLN  39   1.526  -9.018  -9.018
  306    H    ALA  40           HN       ALA  40   5.891 -12.282 -12.282
  307    HA   ALA  40           HA       ALA  40   5.395 -15.215 -15.215
  308   1HB   ALA  40           HB3      ALA  40   7.831 -13.977 -13.977
  309   2HB   ALA  40           HB2      ALA  40   7.864 -14.396 -14.396
  310   3HB   ALA  40           HB1      ALA  40   7.632 -15.656 -15.656
  311    H    ASP  41           HN       ASP  41   5.170 -16.338 -16.338
  312    HA   ASP  41           HA       ASP  41   3.728 -14.933 -14.933
  313   1HB   ASP  41           HB2      ASP  41   5.209 -17.542 -17.542
  314   2HB   ASP  41           HB1      ASP  41   4.229 -17.059 -17.059
  315    H    SER  42           HN       SER  42   7.148 -15.955 -15.955
  316    HA   SER  42           HA       SER  42   7.781 -14.915 -14.915
  317   1HB   SER  42           HB2      SER  42  10.083 -15.378 -15.378
  318   2HB   SER  42           HB1      SER  42   9.017 -16.695 -16.695
  319    HG   SER  42           HG       SER  42   9.675 -16.294 -16.294
  320    H    GLN  43           HN       GLN  43   8.269 -13.609 -13.609
  321    HA   GLN  43           HA       GLN  43   8.167 -10.865 -10.865
  322   1HB   GLN  43           HB2      GLN  43  10.433 -11.681 -11.681
  323   2HB   GLN  43           HB1      GLN  43  10.730 -12.069 -12.069
  324   1HG   GLN  43           HG2      GLN  43  10.507  -9.752  -9.752
  325   2HG   GLN  43           HG1      GLN  43  10.018  -9.309  -9.309
  326   1HE2  GLN  43          HE22      GLN  43  13.736  -8.708  -8.708
  327   2HE2  GLN  43          HE21      GLN  43  12.374  -8.234  -8.234
  328    H    VAL  44           HN       VAL  44   8.539  -9.301  -9.301
  329    HA   VAL  44           HA       VAL  44   7.798 -10.527 -10.527
  330    HB   VAL  44           HB       VAL  44   7.067  -7.837  -7.837
  331   1HG1  VAL  44          HG13      VAL  44   7.240  -8.422  -8.422
  332   2HG1  VAL  44          HG12      VAL  44   5.583  -8.928  -8.928
  333   3HG1  VAL  44          HG11      VAL  44   6.085  -7.272  -7.272
  334   1HG2  VAL  44          HG21      VAL  44   5.415 -10.348 -10.348
  335   2HG2  VAL  44          HG23      VAL  44   5.922  -9.702  -9.702
  336   3HG2  VAL  44          HG22      VAL  44   4.780  -8.803  -8.803
  337    H    THR  45           HN       THR  45   9.116  -9.908  -9.908
  338    HA   THR  45           HA       THR  45  11.146  -7.755  -7.755
  339    HB   THR  45           HB       THR  45  12.760  -9.234  -9.234
  340    HG1  THR  45           HG1      THR  45  11.511 -10.464 -10.464
  341   1HG2  THR  45          HG21      THR  45  12.297  -9.339  -9.339
  342   2HG2  THR  45          HG23      THR  45  11.394 -10.815 -10.815
  343   3HG2  THR  45          HG22      THR  45  13.116 -10.728 -10.728
  344    H    GLU  46           HN       GLU  46  12.154  -6.972  -6.972
  345    HA   GLU  46           HA       GLU  46  10.071  -6.334  -6.334
  346   1HB   GLU  46           HB2      GLU  46  13.010  -5.685  -5.685
  347   2HB   GLU  46           HB1      GLU  46  12.019  -5.046  -5.046
  348   1HG   GLU  46           HG2      GLU  46  10.512  -3.986  -3.986
  349   2HG   GLU  46           HG1      GLU  46  11.407  -4.693  -4.693
  350    H    VAL  47           HN       VAL  47  10.185  -6.814  -6.814
  351    HA   VAL  47           HA       VAL  47  11.789  -9.266  -9.266
  352    HB   VAL  47           HB       VAL  47   9.057  -8.318  -8.318
  353   1HG1  VAL  47          HG11      VAL  47  10.834 -10.530 -10.530
  354   2HG1  VAL  47          HG13      VAL  47   9.095 -10.823 -10.823
  355   3HG1  VAL  47          HG12      VAL  47   9.727  -9.520  -9.520
  356   1HG2  VAL  47          HG21      VAL  47   9.983 -10.528 -10.528
  357   2HG2  VAL  47          HG23      VAL  47   8.947  -9.158  -9.158
  358   3HG2  VAL  47          HG22      VAL  47   8.348 -10.432 -10.432
  359    H    CYS  48           HN       CYS  48   9.940  -7.003  -7.003
  360    HA   CYS  48           HA       CYS  48  12.474  -6.367  -6.367
  361   1HB   CYS  48           HB2      CYS  48   9.725  -7.142  -7.142
  362   2HB   CYS  48           HB1      CYS  48  11.050  -6.601  -6.601
  363    H    ALA  49           HN       ALA  49  12.231  -4.321  -4.321
  364    HA   ALA  49           HA       ALA  49  10.004  -2.517  -2.517
  365   1HB   ALA  49           HB1      ALA  49  12.357  -2.666  -2.666
  366   2HB   ALA  49           HB3      ALA  49  12.002  -1.030  -1.030
  367   3HB   ALA  49           HB2      ALA  49  10.773  -1.953  -1.953
  368    H    ALA  50           HN       ALA  50  10.091  -0.642  -0.642
  369    HA   ALA  50           HA       ALA  50  12.454   0.394   0.394
  370   1HB   ALA  50           HB3      ALA  50  11.574  -1.966  -1.966
  371   2HB   ALA  50           HB2      ALA  50  10.680  -0.793  -0.793
  372   3HB   ALA  50           HB1      ALA  50  12.442  -0.730  -0.730
  373    H    THR  51           HN       THR  51  11.924   2.473   2.473
  374    HA   THR  51           HA       THR  51   9.147   3.369   3.369
  375    HB   THR  51           HB       THR  51  11.398   5.001   5.001
  376    HG1  THR  51           HG1      THR  51  12.495   4.516   4.516
  377   1HG2  THR  51          HG21      THR  51   8.837   5.452   5.452
  378   2HG2  THR  51          HG23      THR  51  10.165   6.529   6.529
  379   3HG2  THR  51          HG22      THR  51   9.618   6.422   6.422
  380    H    TYR  52           HN       TYR  52   7.785   2.720   2.720
  381    HA   TYR  52           HA       TYR  52   8.493   2.255   2.255
  382   1HB   TYR  52           HB2      TYR  52   6.430   1.511   1.511
  383   2HB   TYR  52           HB1      TYR  52   5.847   3.177   3.177
  384    HD1  TYR  52           HD2      TYR  52   5.501   4.337   4.337
  385    HD2  TYR  52           HD1      TYR  52   6.254   0.095   0.095
  386    HE1  TYR  52           HE2      TYR  52   4.663   3.983   3.983
  387    HE2  TYR  52           HE1      TYR  52   5.422  -0.267  -0.267
  388    HH   TYR  52           HH       TYR  52   5.131   2.077   2.077
  389    H    MET  53           HN       MET  53   8.967   3.674   3.674
  390    HA   MET  53           HA       MET  53   8.468   6.576   6.576
  391   1HB   MET  53           HB2      MET  53  10.031   5.000   5.000
  392   2HB   MET  53           HB1      MET  53   9.963   6.763   6.763
  393   1HG   MET  53           HG2      MET  53  10.681   5.534   5.534
  394   2HG   MET  53           HG1      MET  53  11.836   5.180   5.180
  395   1HE   MET  53           HE1      MET  53  10.432   7.534   7.534
  396   2HE   MET  53           HE3      MET  53  10.758   9.176   9.176
  397   3HE   MET  53           HE2      MET  53   9.526   8.196   8.196
  398    H    MET  54           HN       MET  54   6.823   7.596   7.596
  399    HA   MET  54           HA       MET  54   4.806   6.110   6.110
  400   1HB   MET  54           HB2      MET  54   5.689   9.001   9.001
  401   2HB   MET  54           HB1      MET  54   4.207   8.405   8.405
  402   1HG   MET  54           HG2      MET  54   4.835   8.025   8.025
  403   2HG   MET  54           HG1      MET  54   3.917   9.399   9.399
  404   1HE   MET  54           HE3      MET  54   4.435   5.909   5.909
  405   2HE   MET  54           HE2      MET  54   3.106   5.998   5.998
  406   3HE   MET  54           HE1      MET  54   2.936   5.018   5.018
  407    H    GLY  55           HN       GLY  55   7.912   7.149   7.149
  408   1HA   GLY  55           HA2      GLY  55   7.046   6.377   6.377
  409   2HA   GLY  55           HA1      GLY  55   8.307   7.564   7.564
  410    H    ASN  56           HN       ASN  56   9.087   5.467   5.467
  411    HA   ASN  56           HA       ASN  56  10.578   3.623   3.623
  412   1HB   ASN  56           HB2      ASN  56  11.557   5.171   5.171
  413   2HB   ASN  56           HB1      ASN  56  12.514   3.968   3.968
  414   1HD2  ASN  56          HD22      ASN  56  12.815   6.052   6.052
  415   2HD2  ASN  56          HD21      ASN  56  12.596   4.428   4.428
  416    H    GLU  57           HN       GLU  57  11.292   1.610   1.610
  417    HA   GLU  57           HA       GLU  57   9.470   0.748   0.748
  418   1HB   GLU  57           HB2      GLU  57   9.270  -0.330  -0.330
  419   2HB   GLU  57           HB1      GLU  57  10.954  -0.838  -0.838
  420   1HG   GLU  57           HG2      GLU  57  10.404  -2.096  -2.096
  421   2HG   GLU  57           HG1      GLU  57   8.712  -1.636  -1.636
  422    H    LEU  58           HN       LEU  58  10.421   0.135   0.135
  423    HA   LEU  58           HA       LEU  58  13.375   0.181   0.181
  424   1HB   LEU  58           HB2      LEU  58  11.069   0.156   0.156
  425   2HB   LEU  58           HB1      LEU  58  12.748   0.062   0.062
  426    HG   LEU  58           HG       LEU  58  12.004   2.368   2.368
  427   1HD1  LEU  58          HD11      LEU  58  14.332   1.698   1.698
  428   2HD1  LEU  58          HD13      LEU  58  13.685   2.284   2.284
  429   3HD1  LEU  58          HD12      LEU  58  13.805   3.374   3.374
  430   1HD2  LEU  58          HD23      LEU  58  10.255   1.948   1.948
  431   2HD2  LEU  58          HD22      LEU  58  10.992   3.544   3.544
  432   3HD2  LEU  58          HD21      LEU  58  11.561   2.401   2.401
  433    H    THR  59           HN       THR  59  14.549  -1.551  -1.551
  434    HA   THR  59           HA       THR  59  13.338  -4.217  -4.217
  435    HB   THR  59           HB       THR  59  15.759  -4.822  -4.822
  436    HG1  THR  59           HG1      THR  59  16.904  -3.431  -3.431
  437   1HG2  THR  59          HG22      THR  59  14.559  -4.143  -4.143
  438   2HG2  THR  59          HG21      THR  59  15.152  -2.502  -2.502
  439   3HG2  THR  59          HG23      THR  59  16.292  -3.814  -3.814
  440    H    PHE  60           HN       PHE  60  13.164  -5.674  -5.674
  441    HA   PHE  60           HA       PHE  60  13.742  -4.750  -4.750
  442   1HB   PHE  60           HB2      PHE  60  12.075  -6.987  -6.987
  443   2HB   PHE  60           HB1      PHE  60  12.183  -6.645  -6.645
  444    HD1  PHE  60           HD1      PHE  60  11.177  -5.179  -5.179
  445    HD2  PHE  60           HD2      PHE  60  10.903  -4.888  -4.888
  446    HE1  PHE  60           HE1      PHE  60   9.407  -3.423  -3.423
  447    HE2  PHE  60           HE2      PHE  60   9.132  -3.139  -3.139
  448    HZ   PHE  60           HZ       PHE  60   8.381  -2.410  -2.410
  449    H    LEU  61           HN       LEU  61  15.809  -5.734  -5.734
  450    HA   LEU  61           HA       LEU  61  16.560  -8.439  -8.439
  451   1HB   LEU  61           HB2      LEU  61  17.442  -6.841  -6.841
  452   2HB   LEU  61           HB1      LEU  61  18.310  -5.996  -5.996
  453    HG   LEU  61           HG       LEU  61  18.700  -8.952  -8.952
  454   1HD1  LEU  61          HD11      LEU  61  19.945  -6.820  -6.820
  455   2HD1  LEU  61          HD13      LEU  61  20.596  -8.450  -8.450
  456   3HD1  LEU  61          HD12      LEU  61  18.994  -8.209  -8.209
  457   1HD2  LEU  61          HD22      LEU  61  20.133  -6.571  -6.571
  458   2HD2  LEU  61          HD21      LEU  61  19.917  -8.175  -8.175
  459   3HD2  LEU  61          HD23      LEU  61  21.109  -7.924  -7.924
  460    H    ASP  62           HN       ASP  62  17.271  -5.558  -5.558
  461    HA   ASP  62           HA       ASP  62  19.267  -6.568  -6.568
  462   1HB   ASP  62           HB2      ASP  62  18.459  -4.883  -4.883
  463   2HB   ASP  62           HB1      ASP  62  18.410  -4.246  -4.246
  464    H    ASP  63           HN       ASP  63  15.954  -7.392  -7.392
  465    HA   ASP  63           HA       ASP  63  16.249  -9.070  -9.070
  466   1HB   ASP  63           HB2      ASP  63  13.783  -8.874  -8.874
  467   2HB   ASP  63           HB1      ASP  63  14.573  -7.296  -7.296
  468    H    SER  64           HN       SER  64  16.610  -9.478  -9.478
  469    HA   SER  64           HA       SER  64  16.426 -11.266 -11.266
  470   1HB   SER  64           HB2      SER  64  17.352 -12.430 -12.430
  471   2HB   SER  64           HB1      SER  64  15.717 -12.736 -12.736
  472    HG   SER  64           HG       SER  64  15.818 -14.443 -14.443
  473    H    ILE  67           HN       ILE  67  14.870 -11.973 -11.973
  474    HA   ILE  67           HA       ILE  67  12.752 -12.345 -12.345
  475    HB   ILE  67           HB       ILE  67  11.987 -13.105 -13.105
  476   1HG1  ILE  67          HG12      ILE  67  13.481 -14.724 -14.724
  477   2HG1  ILE  67          HG11      ILE  67  14.180 -14.118 -14.118
  478   1HG2  ILE  67          HG23      ILE  67  10.473 -13.079 -13.079
  479   2HG2  ILE  67          HG22      ILE  67  11.185 -14.688 -14.688
  480   3HG2  ILE  67          HG21      ILE  67  10.244 -14.235 -14.235
  481   1HD1  ILE  67          HD11      ILE  67  11.839 -16.018 -16.018
  482   2HD1  ILE  67          HD13      ILE  67  13.497 -16.495 -16.495
  483   3HD1  ILE  67          HD12      ILE  67  12.612 -15.461 -15.461
  484    H    CYS  68           HN       CYS  68  10.315 -11.853 -11.853
  485    HA   CYS  68           HA       CYS  68   8.802 -10.096 -10.096
  486   1HB   CYS  68           HB2      CYS  68  11.509  -8.845  -8.845
  487   2HB   CYS  68           HB1      CYS  68   9.996  -7.987  -7.987
  488    H    THR  69           HN       THR  69   8.564 -10.389 -10.389
  489    HA   THR  69           HA       THR  69   9.046  -7.712  -7.712
  490    HB   THR  69           HB       THR  69  10.679  -9.391  -9.391
  491    HG1  THR  69           HG1      THR  69  10.399  -8.838  -8.838
  492   1HG2  THR  69          HG22      THR  69   8.499 -11.163 -11.163
  493   2HG2  THR  69          HG21      THR  69   8.852 -11.061 -11.061
  494   3HG2  THR  69          HG23      THR  69  10.117 -11.538 -11.538
  495    H    GLY  70           HN       GLY  70   7.329  -7.058  -7.058
  496   1HA   GLY  70           HA2      GLY  70   5.176  -8.721  -8.721
  497   2HA   GLY  70           HA1      GLY  70   4.714  -7.955  -7.955
  498    H    THR  71           HN       THR  71   3.209  -6.494  -6.494
  499    HA   THR  71           HA       THR  71   4.170  -4.420  -4.420
  500    HB   THR  71           HB       THR  71   1.432  -5.619  -5.619
  501    HG1  THR  71           HG1      THR  71   2.756  -7.093  -7.093
  502   1HG2  THR  71          HG21      THR  71   2.574  -3.430  -3.430
  503   2HG2  THR  71          HG23      THR  71   1.266  -4.421  -4.421
  504   3HG2  THR  71          HG22      THR  71   1.023  -3.503  -3.503
  505    H    SER  72           HN       SER  72   2.975  -2.362  -2.362
  506    HA   SER  72           HA       SER  72   1.424  -1.791  -1.791
  507   1HB   SER  72           HB2      SER  72   4.361  -1.104  -1.104
  508   2HB   SER  72           HB1      SER  72   3.287  -0.199  -0.199
  509    HG   SER  72           HG       SER  72   3.743  -1.763  -1.763
  510    H    SER  73           HN       SER  73   0.009  -0.231  -0.231
  511    HA   SER  73           HA       SER  73   1.127   2.074   2.074
  512   1HB   SER  73           HB2      SER  73  -0.726   0.022   0.022
  513   2HB   SER  73           HB1      SER  73  -0.333   1.574   1.574
  514    HG   SER  73           HG       SER  73   0.977  -0.377  -0.377
  515    H    GLY  74           HN       GLY  74  -0.405   3.806   3.806
  516   1HA   GLY  74           HA2      GLY  74  -2.191   5.129   5.129
  517   2HA   GLY  74           HA1      GLY  74  -3.171   3.671   3.671
  518    H    ASN  75           HN       ASN  75  -4.201   3.242   3.242
  519    HA   ASN  75           HA       ASN  75  -2.852   3.899   3.899
  520   1HB   ASN  75           HB2      ASN  75  -5.749   3.472   3.472
  521   2HB   ASN  75           HB1      ASN  75  -5.212   3.832   3.832
  522   1HD2  ASN  75          HD22      ASN  75  -3.968   7.157   7.157
  523   2HD2  ASN  75          HD21      ASN  75  -3.258   5.799   5.799
  524    H    GLN  76           HN       GLN  76  -2.938   1.269   1.269
  525    HA   GLN  76           HA       GLN  76  -3.523  -0.617  -0.617
  526   1HB   GLN  76           HB2      GLN  76  -3.862  -0.846  -0.846
  527   2HB   GLN  76           HB1      GLN  76  -4.055  -2.207  -2.207
  528   1HG   GLN  76           HG2      GLN  76  -5.848  -1.045  -1.045
  529   2HG   GLN  76           HG1      GLN  76  -5.620   0.384   0.384
  530   1HE2  GLN  76          HE22      GLN  76  -7.190  -2.965  -2.965
  531   2HE2  GLN  76          HE21      GLN  76  -6.049  -3.164  -3.164
  532    H    VAL  77           HN       VAL  77  -1.658  -1.609  -1.609
  533    HA   VAL  77           HA       VAL  77   0.628  -1.809  -1.809
  534    HB   VAL  77           HB       VAL  77   2.005  -1.726  -1.726
  535   1HG1  VAL  77          HG11      VAL  77   0.358   0.342   0.342
  536   2HG1  VAL  77          HG13      VAL  77   0.016   0.132   0.132
  537   3HG1  VAL  77          HG12      VAL  77   1.668   0.435   0.435
  538   1HG2  VAL  77          HG22      VAL  77  -0.408  -2.640  -2.640
  539   2HG2  VAL  77          HG21      VAL  77   1.281  -3.091  -3.091
  540   3HG2  VAL  77          HG23      VAL  77   0.670  -1.561  -1.561
  541    H    ASN  78           HN       ASN  78   1.061  -3.819  -3.819
  542    HA   ASN  78           HA       ASN  78  -0.155  -6.183  -6.183
  543   1HB   ASN  78           HB2      ASN  78  -0.638  -5.545  -5.545
  544   2HB   ASN  78           HB1      ASN  78   1.054  -5.881  -5.881
  545    HD2  ASN  78          HD22      ASN  78  -1.865  -7.474  -7.474
  546    H    LEU  79           HN       LEU  79   1.273  -7.205  -7.205
  547    HA   LEU  79           HA       LEU  79   4.178  -7.323  -7.323
  548   1HB   LEU  79           HB2      LEU  79   2.628  -7.739  -7.739
  549   2HB   LEU  79           HB1      LEU  79   4.365  -7.996  -7.996
  550    HG   LEU  79           HG       LEU  79   3.012  -5.363  -5.363
  551   1HD1  LEU  79          HD11      LEU  79   3.902  -6.529  -6.529
  552   2HD1  LEU  79          HD13      LEU  79   4.394  -4.864  -4.864
  553   3HD1  LEU  79          HD12      LEU  79   2.684  -5.295  -5.295
  554   1HD2  LEU  79          HD21      LEU  79   5.895  -6.228  -6.228
  555   2HD2  LEU  79          HD23      LEU  79   5.169  -5.633  -5.633
  556   3HD2  LEU  79          HD22      LEU  79   5.387  -4.542  -4.542
  557    H    THR  80           HN       THR  80   4.960  -9.330  -9.330
  558    HA   THR  80           HA       THR  80   3.281 -11.747 -11.747
  559    HB   THR  80           HB       THR  80   4.876 -11.098 -11.098
  560    HG1  THR  80           HG1      THR  80   3.160  -9.930  -9.930
  561   1HG2  THR  80          HG23      THR  80   3.237 -13.442 -13.442
  562   2HG2  THR  80          HG22      THR  80   3.343 -13.051 -13.051
  563   3HG2  THR  80          HG21      THR  80   4.806 -13.426 -13.426
  564    H    ILE  81           HN       ILE  81   4.372 -13.511 -13.511
  565    HA   ILE  81           HA       ILE  81   7.345 -13.276 -13.276
  566    HB   ILE  81           HB       ILE  81   5.175 -14.767 -14.767
  567   1HG1  ILE  81          HG12      ILE  81   6.938 -12.570 -12.570
  568   2HG1  ILE  81          HG11      ILE  81   5.460 -12.185 -12.185
  569   1HG2  ILE  81          HG22      ILE  81   8.165 -14.579 -14.579
  570   2HG2  ILE  81          HG21      ILE  81   7.002 -15.255 -15.255
  571   3HG2  ILE  81          HG23      ILE  81   7.264 -16.041 -16.041
  572   1HD1  ILE  81          HD11      ILE  81   4.399 -13.983 -13.983
  573   2HD1  ILE  81          HD13      ILE  81   5.780 -13.568 -13.568
  574   3HD1  ILE  81          HD12      ILE  81   4.629 -12.319 -12.319
  575    H    GLN  82           HN       GLN  82   8.622 -14.972 -14.972
  576    HA   GLN  82           HA       GLN  82   7.192 -17.313 -17.313
  577   1HB   GLN  82           HB2      GLN  82   9.757 -15.936 -15.936
  578   2HB   GLN  82           HB1      GLN  82   9.039 -17.345 -17.345
  579   1HG   GLN  82           HG2      GLN  82   7.020 -16.050 -16.050
  580   2HG   GLN  82           HG1      GLN  82   7.700 -14.640 -14.640
  581   1HE2  GLN  82          HE22      GLN  82   8.627 -15.269 -15.269
  582   2HE2  GLN  82          HE21      GLN  82   7.349 -16.050 -16.050
  583    H    GLY  83           HN       GLY  83   7.636 -19.117 -19.117
  584   1HA   GLY  83           HA2      GLY  83   9.299 -20.818 -20.818
  585   2HA   GLY  83           HA1      GLY  83  10.365 -19.504 -19.504
  586    H    LEU  84           HN       LEU  84   6.937 -20.266 -20.266
  587    HA   LEU  84           HA       LEU  84   7.486 -19.695 -19.695
  588   1HB   LEU  84           HB2      LEU  84   5.015 -19.971 -19.971
  589   2HB   LEU  84           HB1      LEU  84   4.947 -19.712 -19.712
  590    HG   LEU  84           HG       LEU  84   6.498 -17.905 -17.905
  591   1HD1  LEU  84          HD13      LEU  84   3.617 -17.843 -17.843
  592   2HD1  LEU  84          HD12      LEU  84   4.476 -16.358 -16.358
  593   3HD1  LEU  84          HD11      LEU  84   4.279 -17.628 -17.628
  594   1HD2  LEU  84          HD23      LEU  84   5.876 -18.036 -18.036
  595   2HD2  LEU  84          HD22      LEU  84   7.278 -17.351 -17.351
  596   3HD2  LEU  84          HD21      LEU  84   5.772 -16.438 -16.438
  597    H    ARG  85           HN       ARG  85   7.576 -21.310 -21.310
  598    HA   ARG  85           HA       ARG  85   6.769 -24.072 -24.072
  599   1HB   ARG  85           HB2      ARG  85   8.649 -22.898 -22.898
  600   2HB   ARG  85           HB1      ARG  85   8.247 -24.615 -24.615
  601   1HG   ARG  85           HG2      ARG  85   9.210 -23.197 -23.197
  602   2HG   ARG  85           HG1      ARG  85  10.367 -23.798 -23.798
  603   1HD   ARG  85           HD2      ARG  85   8.890 -26.016 -26.016
  604   2HD   ARG  85           HD1      ARG  85   8.546 -25.331 -25.331
  605    HE   ARG  85           HE       ARG  85  10.818 -25.636 -25.636
  606   1HH1  ARG  85          HH21      ARG  85  10.400 -25.968 -25.968
  607   2HH1  ARG  85          HH22      ARG  85  12.010 -26.549 -26.549
  608   1HH2  ARG  85          HH11      ARG  85  12.894 -26.387 -26.387
  609   2HH2  ARG  85          HH12      ARG  85  13.408 -26.783 -26.783
  610    H    ALA  86           HN       ALA  86   6.111 -25.326 -25.326
  611    HA   ALA  86           HA       ALA  86   3.588 -24.330 -24.330
  612   1HB   ALA  86           HB2      ALA  86   4.607 -26.696 -26.696
  613   2HB   ALA  86           HB1      ALA  86   5.444 -26.188 -26.188
  614   3HB   ALA  86           HB3      ALA  86   3.679 -26.229 -26.229
  615    H    MET  87           HN       MET  87   6.765 -24.382 -24.382
  616    HA   MET  87           HA       MET  87   6.087 -23.096 -23.096
  617   1HB   MET  87           HB2      MET  87   8.587 -23.275 -23.275
  618   2HB   MET  87           HB1      MET  87   8.587 -22.583 -22.583
  619   1HG   MET  87           HG2      MET  87   7.738 -24.686 -24.686
  620   2HG   MET  87           HG1      MET  87   7.630 -25.374 -25.374
  621   1HE   MET  87           HE1      MET  87   9.551 -23.894 -23.894
  622   2HE   MET  87           HE3      MET  87   9.933 -25.576 -25.576
  623   3HE   MET  87           HE2      MET  87  11.212 -24.472 -24.472
  624    H    ASP  88           HN       ASP  88   7.122 -21.742 -21.742
  625    HA   ASP  88           HA       ASP  88   7.464 -19.029 -19.029
  626   1HB   ASP  88           HB2      ASP  88   6.552 -20.376 -20.376
  627   2HB   ASP  88           HB1      ASP  88   6.915 -18.653 -18.653
  628    H    THR  89           HN       THR  89   4.504 -20.851 -20.851
  629    HA   THR  89           HA       THR  89   2.599 -18.920 -18.920
  630    HB   THR  89           HB       THR  89   2.343 -21.134 -21.134
  631    HG1  THR  89           HG1      THR  89   2.353 -21.143 -21.143
  632   1HG2  THR  89          HG22      THR  89   0.471 -19.368 -19.368
  633   2HG2  THR  89          HG21      THR  89   0.276 -20.376 -20.376
  634   3HG2  THR  89          HG23      THR  89   0.068 -21.076 -21.076
  635    H    GLY  90           HN       GLY  90   1.578 -17.333 -17.333
  636   1HA   GLY  90           HA2      GLY  90   1.212 -17.047 -17.047
  637   2HA   GLY  90           HA1      GLY  90   2.866 -16.485 -16.485
  638    H    LEU  91           HN       LEU  91   1.995 -14.407 -14.407
  639    HA   LEU  91           HA       LEU  91   0.121 -12.934 -12.934
  640   1HB   LEU  91           HB2      LEU  91   0.289 -12.944 -12.944
  641   2HB   LEU  91           HB1      LEU  91   1.743 -11.975 -11.975
  642    HG   LEU  91           HG       LEU  91  -0.255 -10.576 -10.576
  643   1HD1  LEU  91          HD12      LEU  91   1.691 -10.017 -10.017
  644   2HD1  LEU  91          HD11      LEU  91   0.276  -9.850  -9.850
  645   3HD1  LEU  91          HD13      LEU  91   0.410  -8.893  -8.893
  646   1HD2  LEU  91          HD21      LEU  91  -1.882 -12.103 -12.103
  647   2HD2  LEU  91          HD23      LEU  91  -2.060 -10.405 -10.405
  648   3HD2  LEU  91          HD22      LEU  91  -1.249 -11.525 -11.525
  649    H    TYR  92           HN       TYR  92   0.642 -11.318 -11.318
  650    HA   TYR  92           HA       TYR  92   3.459 -10.337 -10.337
  651   1HB   TYR  92           HB2      TYR  92   1.576 -11.315 -11.315
  652   2HB   TYR  92           HB1      TYR  92   2.854 -10.162 -10.162
  653    HD1  TYR  92           HD2      TYR  92   5.244 -10.749 -10.749
  654    HD2  TYR  92           HD1      TYR  92   2.095 -13.633 -13.633
  655    HE1  TYR  92           HE2      TYR  92   6.931 -12.592 -12.592
  656    HE2  TYR  92           HE1      TYR  92   3.780 -15.482 -15.482
  657    HH   TYR  92           HH       TYR  92   5.997 -15.940 -15.940
  658    H    ILE  93           HN       ILE  93   3.472  -8.107  -8.107
  659    HA   ILE  93           HA       ILE  93   0.853  -6.713  -6.713
  660    HB   ILE  93           HB       ILE  93   3.580  -6.112  -6.112
  661   1HG1  ILE  93          HG12      ILE  93   1.873  -6.047  -6.047
  662   2HG1  ILE  93          HG11      ILE  93   0.976  -7.124  -7.124
  663   1HG2  ILE  93          HG22      ILE  93   1.270  -4.305  -4.305
  664   2HG2  ILE  93          HG21      ILE  93   1.940  -4.263  -4.263
  665   3HG2  ILE  93          HG23      ILE  93   2.972  -3.913  -3.913
  666   1HD1  ILE  93          HD12      ILE  93   3.100  -8.496  -8.496
  667   2HD1  ILE  93          HD11      ILE  93   3.766  -7.509  -7.509
  668   3HD1  ILE  93          HD13      ILE  93   2.343  -8.514  -8.514
  669    H    CYS  94           HN       CYS  94   0.323  -5.282  -5.282
  670    HA   CYS  94           HA       CYS  94   2.346  -4.495  -4.495
  671   1HB   CYS  94           HB2      CYS  94   0.333  -3.689  -3.689
  672   2HB   CYS  94           HB1      CYS  94   0.036  -5.323  -5.323
  673    H    LYS  95           HN       LYS  95   3.372  -2.484  -2.484
  674    HA   LYS  95           HA       LYS  95   2.085  -0.550  -0.550
  675   1HB   LYS  95           HB2      LYS  95   4.951  -1.108  -1.108
  676   2HB   LYS  95           HB1      LYS  95   4.439   0.187   0.187
  677   1HG   LYS  95           HG2      LYS  95   3.171  -2.176  -2.176
  678   2HG   LYS  95           HG1      LYS  95   4.852  -2.604  -2.604
  679   1HD   LYS  95           HD2      LYS  95   4.377  -0.023  -0.023
  680   2HD   LYS  95           HD1      LYS  95   4.078  -1.471  -1.471
  681   1HE   LYS  95           HE2      LYS  95   6.434  -2.214  -2.214
  682   2HE   LYS  95           HE1      LYS  95   6.647  -0.473  -0.473
  683   1HZ   LYS  95           HZ3      LYS  95   5.747  -1.690  -1.690
  684   2HZ   LYS  95           HZ2      LYS  95   7.325  -1.140  -1.140
  685   3HZ   LYS  95           HZ1      LYS  95   6.029  -0.042  -0.042
  686    H    VAL  96           HN       VAL  96   1.963   1.635   1.635
  687    HA   VAL  96           HA       VAL  96   3.045   2.330   2.330
  688    HB   VAL  96           HB       VAL  96   0.201   2.791   2.791
  689   1HG1  VAL  96          HG11      VAL  96   1.681   4.026   4.026
  690   2HG1  VAL  96          HG13      VAL  96   0.665   2.849   2.849
  691   3HG1  VAL  96          HG12      VAL  96  -0.068   4.069   4.069
  692   1HG2  VAL  96          HG21      VAL  96   1.447   0.561   0.561
  693   2HG2  VAL  96          HG23      VAL  96   0.205   0.486   0.486
  694   3HG2  VAL  96          HG22      VAL  96  -0.203   1.055   1.055
  695    H    GLU  97           HN       GLU  97   4.439   3.979   3.979
  696    HA   GLU  97           HA       GLU  97   3.136   6.210   6.210
  697   1HB   GLU  97           HB2      GLU  97   5.888   4.993   4.993
  698   2HB   GLU  97           HB1      GLU  97   5.324   6.436   6.436
  699   1HG   GLU  97           HG2      GLU  97   4.132   3.641   3.641
  700   2HG   GLU  97           HG1      GLU  97   5.027   4.480   4.480
  701    H    LEU  98           HN       LEU  98   3.639   8.225   8.225
  702    HA   LEU  98           HA       LEU  98   5.373   8.509   8.509
  703   1HB   LEU  98           HB2      LEU  98   3.762  10.648  10.648
  704   2HB   LEU  98           HB1      LEU  98   4.174  10.579  10.579
  705    HG   LEU  98           HG       LEU  98   2.117   8.931   8.931
  706   1HD1  LEU  98          HD13      LEU  98   2.076  11.010  11.010
  707   2HD1  LEU  98          HD12      LEU  98   0.766   9.833   9.833
  708   3HD1  LEU  98          HD11      LEU  98   1.110  10.911  10.911
  709   1HD2  LEU  98          HD22      LEU  98   3.385   8.468   8.468
  710   2HD2  LEU  98          HD21      LEU  98   3.111   7.313   7.313
  711   3HD2  LEU  98          HD23      LEU  98   1.750   7.904   7.904
  712    H    MET  99           HN       MET  99   7.286   8.018   8.018
  713    HA   MET  99           HA       MET  99   7.787   9.589   9.589
  714   1HB   MET  99           HB2      MET  99   9.444   7.670   7.670
  715   2HB   MET  99           HB1      MET  99   9.991   8.362   8.362
  716   1HG   MET  99           HG2      MET  99   7.531   7.499   7.499
  717   2HG   MET  99           HG1      MET  99   7.912   6.310   6.310
  718   1HE   MET  99           HE1      MET  99   8.259   7.622   7.622
  719   2HE   MET  99           HE3      MET  99   7.601   5.979   5.979
  720   3HE   MET  99           HE2      MET  99   9.117   6.345   6.345
  721    H    TYR 100           HN       TYR 100   8.869   9.788   9.788
  722    HA   TYR 100           HA       TYR 100  11.000  11.694  11.694
  723   1HB   TYR 100           HB2      TYR 100   9.574  10.652  10.652
  724   2HB   TYR 100           HB1      TYR 100  10.856  11.857  11.857
  725    HD1  TYR 100           HD1      TYR 100  10.041   8.370   8.370
  726    HD2  TYR 100           HD2      TYR 100  13.185  11.280  11.280
  727    HE1  TYR 100           HE1      TYR 100  11.762   6.566   6.566
  728    HE2  TYR 100           HE2      TYR 100  14.901   9.471   9.471
  729    HH   TYR 100           HH       TYR 100  14.933   7.096   7.096
  730    HA   PRO 101           HA       PRO 101   7.858  14.986  14.986
  731   1HB   PRO 101           HB2      PRO 101   5.183  14.334  14.334
  732   2HB   PRO 101           HB1      PRO 101   6.276  14.099  14.099
  733   1HG   PRO 101           HG2      PRO 101   5.259  12.164  12.164
  734   2HG   PRO 101           HG1      PRO 101   5.611  11.946  11.946
  735   1HD   PRO 101           HD2      PRO 101   7.237  11.039  11.039
  736   2HD   PRO 101           HD1      PRO 101   7.786  11.405  11.405
  737    HA   PRO 102           HA       PRO 102   6.508  15.715  15.715
  738   1HB   PRO 102           HB2      PRO 102   6.973  18.461  18.461
  739   2HB   PRO 102           HB1      PRO 102   8.344  17.302  17.302
  740   1HG   PRO 102           HG2      PRO 102   7.415  18.829  18.829
  741   2HG   PRO 102           HG1      PRO 102   9.025  18.485  18.485
  742   1HD   PRO 102           HD2      PRO 102   7.876  17.088  17.088
  743   2HD   PRO 102           HD1      PRO 102   9.169  16.469  16.469
  744    HA   PRO 103           HA       PRO 103   5.997  16.574  16.574
  745   1HB   PRO 103           HB2      PRO 103   5.411  17.220  17.220
  746   2HB   PRO 103           HB1      PRO 103   5.961  18.427  18.427
  747   1HG   PRO 103           HG2      PRO 103   3.469  18.553  18.553
  748   2HG   PRO 103           HG1      PRO 103   4.095  19.233  19.233
  749   1HD   PRO 103           HD2      PRO 103   3.229  16.470  16.470
  750   2HD   PRO 103           HD1      PRO 103   2.247  17.501  17.501
  751    H    TYR 104           HN       TYR 104   4.835  14.528  14.528
  752    HA   TYR 104           HA       TYR 104   4.429  12.306  12.306
  753   1HB   TYR 104           HB2      TYR 104   6.539  12.447  12.447
  754   2HB   TYR 104           HB1      TYR 104   5.545  12.861  12.861
  755    HD1  TYR 104           HD2      TYR 104   4.196  10.405  10.405
  756    HD2  TYR 104           HD1      TYR 104   6.529  11.042  11.042
  757    HE1  TYR 104           HE2      TYR 104   4.019   7.962   7.962
  758    HE2  TYR 104           HE1      TYR 104   6.361   8.616   8.616
  759    HH   TYR 104           HH       TYR 104   4.466   6.620   6.620
  760    H    TYR 105           HN       TYR 105   2.350  11.420  11.420
  761    HA   TYR 105           HA       TYR 105   0.970  11.266  11.266
  762   1HB   TYR 105           HB2      TYR 105  -1.127  12.439  12.439
  763   2HB   TYR 105           HB1      TYR 105   0.123  13.484  13.484
  764    HD1  TYR 105           HD2      TYR 105   1.715  14.579  14.579
  765    HD2  TYR 105           HD1      TYR 105  -1.600  12.308  12.308
  766    HE1  TYR 105           HE2      TYR 105   1.981  15.704  15.704
  767    HE2  TYR 105           HE1      TYR 105  -1.349  13.429  13.429
  768    HH   TYR 105           HH       TYR 105   1.064  14.832  14.832
  769    H    LEU 106           HN       LEU 106   0.567   9.040   9.040
  770    HA   LEU 106           HA       LEU 106  -1.389   8.281   8.281
  771   1HB   LEU 106           HB2      LEU 106   1.314   8.250   8.250
  772   2HB   LEU 106           HB1      LEU 106   1.001   6.571   6.571
  773    HG   LEU 106           HG       LEU 106  -0.993   6.624   6.624
  774   1HD1  LEU 106          HD12      LEU 106   0.229   9.325   9.325
  775   2HD1  LEU 106          HD11      LEU 106  -0.872   8.505   8.505
  776   3HD1  LEU 106          HD13      LEU 106  -1.425   8.986   8.986
  777   1HD2  LEU 106          HD23      LEU 106   1.849   6.934   6.934
  778   2HD2  LEU 106          HD22      LEU 106   0.778   5.539   5.539
  779   3HD2  LEU 106          HD21      LEU 106   0.586   6.908   6.908
  780    H    GLY 108           HN       GLY 108  -0.594   5.389   5.389
  781   1HA   GLY 108           HA2      GLY 108  -0.847   4.775   4.775
  782   2HA   GLY 108           HA1      GLY 108  -2.281   4.414   4.414
  783    H    ILE 109           HN       ILE 109  -1.230   2.316   2.316
  784    HA   ILE 109           HA       ILE 109   0.389   0.882   0.882
  785    HB   ILE 109           HB       ILE 109   0.156   0.581   0.581
  786   1HG1  ILE 109          HG12      ILE 109   1.389   2.595   2.595
  787   2HG1  ILE 109          HG11      ILE 109   2.488   1.373   1.373
  788   1HG2  ILE 109          HG21      ILE 109   1.723  -0.927  -0.927
  789   2HG2  ILE 109          HG23      ILE 109   2.187  -0.907  -0.907
  790   3HG2  ILE 109          HG22      ILE 109   0.620  -1.556  -1.556
  791   1HD1  ILE 109          HD13      ILE 109   2.714   0.698   0.698
  792   2HD1  ILE 109          HD12      ILE 109   2.162   2.343   2.343
  793   3HD1  ILE 109          HD11      ILE 109   3.641   2.053   2.053
  794    H    GLY 110           HN       GLY 110  -0.139  -1.472  -1.472
  795   1HA   GLY 110           HA2      GLY 110  -3.056  -1.946  -1.946
  796   2HA   GLY 110           HA1      GLY 110  -1.938  -2.942  -2.942
  797    H    ASN 111           HN       ASN 111  -3.847  -3.504  -3.504
  798    HA   ASN 111           HA       ASN 111  -2.326  -4.161  -4.161
  799   1HB   ASN 111           HB2      ASN 111  -4.875  -4.109  -4.109
  800   2HB   ASN 111           HB1      ASN 111  -4.678  -5.762  -5.762
  801    HD2  ASN 111          HD22      ASN 111  -3.643  -3.848  -3.848
  802    H    GLY 112           HN       GLY 112  -2.953  -6.038  -6.038
  803   1HA   GLY 112           HA2      GLY 112  -0.899  -7.430  -7.430
  804   2HA   GLY 112           HA1      GLY 112  -1.012  -8.080  -8.080
  805    H    THR 113           HN       THR 113  -1.125  -9.405  -9.405
  806    HA   THR 113           HA       THR 113  -3.841 -10.691 -10.691
  807    HB   THR 113           HB       THR 113  -1.823 -10.431 -10.431
  808    HG1  THR 113           HG1      THR 113  -4.356  -9.232  -9.232
  809   1HG2  THR 113          HG21      THR 113  -4.483 -11.838 -11.838
  810   2HG2  THR 113          HG23      THR 113  -3.869 -11.285 -11.285
  811   3HG2  THR 113          HG22      THR 113  -2.952 -12.473 -12.473
  812    H    GLN 114           HN       GLN 114  -3.786 -12.970 -12.970
  813    HA   GLN 114           HA       GLN 114  -1.096 -14.108 -14.108
  814   1HB   GLN 114           HB2      GLN 114  -3.008 -14.514 -14.514
  815   2HB   GLN 114           HB1      GLN 114  -3.848 -15.377 -15.377
  816   1HG   GLN 114           HG2      GLN 114  -2.407 -17.171 -17.171
  817   2HG   GLN 114           HG1      GLN 114  -1.049 -16.200 -16.200
  818   1HE2  GLN 114          HE22      GLN 114  -1.673 -17.786 -17.786
  819   2HE2  GLN 114          HE21      GLN 114  -0.656 -17.741 -17.741
  820    H    ILE 115           HN       ILE 115  -0.041 -15.390 -15.390
  821    HA   ILE 115           HA       ILE 115  -1.493 -15.990 -15.990
  822    HB   ILE 115           HB       ILE 115   1.430 -16.150 -16.150
  823   1HG1  ILE 115          HG12      ILE 115   0.015 -14.306 -14.306
  824   2HG1  ILE 115          HG11      ILE 115   0.411 -13.872 -13.872
  825   1HG2  ILE 115          HG21      ILE 115   0.120 -16.710 -16.710
  826   2HG2  ILE 115          HG23      ILE 115   1.853 -16.464 -16.464
  827   3HG2  ILE 115          HG22      ILE 115   1.056 -17.840 -17.840
  828   1HD1  ILE 115          HD11      ILE 115   2.835 -14.522 -14.522
  829   2HD1  ILE 115          HD13      ILE 115   2.295 -14.457 -14.457
  830   3HD1  ILE 115          HD12      ILE 115   2.215 -13.010 -13.010
  831    H    TYR 116           HN       TYR 116  -2.147 -18.079 -18.079
  832    HA   TYR 116           HA       TYR 116  -1.464 -20.247 -20.247
  833   1HB   TYR 116           HB2      TYR 116  -3.735 -19.672 -19.672
  834   2HB   TYR 116           HB1      TYR 116  -3.524 -21.269 -21.269
  835    HD1  TYR 116           HD2      TYR 116  -2.367 -19.717 -19.717
  836    HD2  TYR 116           HD1      TYR 116  -6.034 -19.685 -19.685
  837    HE1  TYR 116           HE2      TYR 116  -3.666 -19.048 -19.048
  838    HE2  TYR 116           HE1      TYR 116  -7.312 -19.057 -19.057
  839    HH   TYR 116           HH       TYR 116  -6.050 -19.277 -19.277
  840    H    VAL 117           HN       VAL 117  -0.813 -22.306 -22.306
  841    HA   VAL 117           HA       VAL 117   0.520 -22.334 -22.334
  842    HB   VAL 117           HB       VAL 117   0.209 -24.399 -24.399
  843   1HG1  VAL 117          HG13      VAL 117   1.847 -24.400 -24.400
  844   2HG1  VAL 117          HG12      VAL 117   2.181 -25.484 -25.484
  845   3HG1  VAL 117          HG11      VAL 117   0.638 -25.582 -25.582
  846   1HG2  VAL 117          HG22      VAL 117   1.787 -22.053 -22.053
  847   2HG2  VAL 117          HG21      VAL 117   1.932 -23.357 -23.357
  848   3HG2  VAL 117          HG23      VAL 117   2.891 -23.393 -23.393
  849    H    ILE 118           HN       ILE 118   0.070 -24.298 -24.298
  850    HA   ILE 118           HA       ILE 118  -2.868 -24.647 -24.647
  851    HB   ILE 118           HB       ILE 118  -0.512 -25.052 -25.052
  852   1HG1  ILE 118          HG12      ILE 118  -0.787 -22.713 -22.713
  853   2HG1  ILE 118          HG11      ILE 118  -1.414 -22.995 -22.995
  854   1HG2  ILE 118          HG22      ILE 118  -3.464 -25.417 -25.417
  855   2HG2  ILE 118          HG21      ILE 118  -2.470 -24.899 -24.899
  856   3HG2  ILE 118          HG23      ILE 118  -2.140 -26.437 -26.437
  857   1HD1  ILE 118          HD11      ILE 118  -3.637 -23.450 -23.450
  858   2HD1  ILE 118          HD13      ILE 118  -2.839 -22.196 -22.196
  859   3HD1  ILE 118          HD12      ILE 118  -3.253 -21.898 -21.898
  860    H    ASP 119           HN       ASP 119  -3.807 -26.645 -26.645
  861    HA   ASP 119           HA       ASP 119  -2.061 -29.031 -29.031
  862   1HB   ASP 119           HB2      ASP 119  -3.456 -28.167 -28.167
  863   2HB   ASP 119           HB1      ASP 119  -4.895 -28.393 -28.393
  864    HA   PRO 120           HA       PRO 120  -3.798 -30.671 -30.671
  865   1HB   PRO 120           HB2      PRO 120  -3.764 -33.363 -33.363
  866   2HB   PRO 120           HB1      PRO 120  -2.318 -32.442 -32.442
  867   1HG   PRO 120           HG2      PRO 120  -3.277 -33.187 -33.187
  868   2HG   PRO 120           HG1      PRO 120  -1.642 -33.286 -33.286
  869   1HD   PRO 120           HD2      PRO 120  -2.323 -31.272 -31.272
  870   2HD   PRO 120           HD1      PRO 120  -1.279 -30.994 -30.994
  871    H    GLU 121           HN       GLU 121  -5.839 -31.419 -31.419
  872    HA   GLU 121           HA       GLU 121  -8.073 -30.999 -30.999
  873   1HB   GLU 121           HB2      GLU 121  -7.805 -32.307 -32.307
  874   2HB   GLU 121           HB1      GLU 121  -9.340 -31.823 -31.823
  875   1HG   GLU 121           HG2      GLU 121  -8.609 -29.494 -29.494
  876   2HG   GLU 121           HG1      GLU 121  -7.020 -29.945 -29.945
  877    HA   PRO 122           HA       PRO 122  -8.432 -35.092 -35.092
  878   1HB   PRO 122           HB2      PRO 122 -10.946 -34.898 -34.898
  879   2HB   PRO 122           HB1      PRO 122  -9.531 -34.125 -34.125
  880   1HG   PRO 122           HG2      PRO 122 -11.696 -32.938 -32.938
  881   2HG   PRO 122           HG1      PRO 122 -10.785 -32.244 -32.244
  882   1HD   PRO 122           HD2      PRO 122 -10.340 -31.686 -31.686
  883   2HD   PRO 122           HD1      PRO 122  -9.166 -31.430 -31.430
  884    H    CYS 123           HN       CYS 123 -10.077 -34.009 -34.009
  885    HA   CYS 123           HA       CYS 123 -11.082 -35.190 -35.190
  886   1HB   CYS 123           HB2      CYS 123  -9.725 -37.144 -37.144
  887   2HB   CYS 123           HB1      CYS 123 -11.381 -37.726 -37.726
  888    HG   CYS 123           HG       CYS 123  -9.904 -37.319 -37.319
  889    HA   PRO 124           HA       PRO 124 -15.344 -35.028 -35.028
  890   1HB   PRO 124           HB2      PRO 124 -16.528 -37.067 -37.067
  891   2HB   PRO 124           HB1      PRO 124 -15.886 -35.603 -35.603
  892   1HG   PRO 124           HG2      PRO 124 -14.674 -38.313 -38.313
  893   2HG   PRO 124           HG1      PRO 124 -14.666 -37.178 -37.178
  894   1HD   PRO 124           HD2      PRO 124 -12.547 -37.523 -37.523
  895   2HD   PRO 124           HD1      PRO 124 -12.889 -35.991 -35.991
  896    H    ASP 125           HN       ASP 125 -13.661 -37.842 -37.842
  897    HA   ASP 125           HA       ASP 125 -15.803 -39.358 -39.358
  898   1HB   ASP 125           HB2      ASP 125 -13.970 -40.451 -40.451
  899   2HB   ASP 125           HB1      ASP 125 -13.502 -40.170 -40.170
  900    H    SER 126           HN       SER 126 -14.481 -36.305 -36.305
  901    HA   SER 126           HA       SER 126 -15.572 -36.592 -36.592
  902   1HB   SER 126           HB2      SER 126 -13.984 -34.790 -34.790
  903   2HB   SER 126           HB1      SER 126 -13.142 -36.116 -36.116
  904    HG   SER 126           HG       SER 126 -13.468 -33.543 -33.543
  905    H    ASP 127           HN       ASP 127 -16.824 -34.780 -34.780
  906    HA   ASP 127           HA       ASP 127 -18.652 -33.619 -33.619
  907   1HB   ASP 127           HB2      ASP 127 -19.073 -34.249 -34.249
  908   2HB   ASP 127           HB1      ASP 127 -18.132 -32.835 -32.835
  909    H    GLN 128           HN       GLN 128 -18.670 -31.561 -31.561
  910    HA   GLN 128           HA       GLN 128 -16.345 -29.771 -29.771
  911   1HB   GLN 128           HB2      GLN 128 -17.897 -30.256 -30.256
  912   2HB   GLN 128           HB1      GLN 128 -16.613 -29.060 -29.060
  913   1HG   GLN 128           HG2      GLN 128 -15.003 -30.814 -30.814
  914   2HG   GLN 128           HG1      GLN 128 -16.276 -32.034 -32.034
  915   1HE2  GLN 128          HE22      GLN 128 -15.606 -32.536 -32.536
  916   2HE2  GLN 128          HE21      GLN 128 -15.872 -33.221 -33.221
  917    H    GLU 129           HN       GLU 129 -16.804 -27.498 -27.498
  918    HA   GLU 129           HA       GLU 129 -18.107 -25.617 -25.617
  919   1HB   GLU 129           HB2      GLU 129 -19.908 -27.050 -27.050
  920   2HB   GLU 129           HB1      GLU 129 -20.133 -25.380 -25.380
  921   1HG   GLU 129           HG2      GLU 129 -17.938 -24.770 -24.770
  922   2HG   GLU 129           HG1      GLU 129 -17.622 -26.448 -26.448
  923    HA   PRO 130           HA       PRO 130 -20.883 -28.461 -28.461
  924   1HB   PRO 130           HB2      PRO 130 -19.479 -28.323 -28.323
  925   2HB   PRO 130           HB1      PRO 130 -19.227 -29.597 -29.597
  926   1HG   PRO 130           HG2      PRO 130 -17.652 -27.111 -27.111
  927   2HG   PRO 130           HG1      PRO 130 -17.086 -28.751 -28.751
  928   1HD   PRO 130           HD2      PRO 130 -17.182 -26.811 -26.811
  929   2HD   PRO 130           HD1      PRO 130 -17.452 -28.525 -28.525
  930    H    LYS 131           HN       LYS 131 -19.334 -25.349 -25.349
  931    HA   LYS 131           HA       LYS 131 -20.882 -24.326 -24.326
  932   1HB   LYS 131           HB2      LYS 131 -19.420 -23.015 -23.015
  933   2HB   LYS 131           HB1      LYS 131 -20.036 -22.140 -22.140
  934   1HG   LYS 131           HG2      LYS 131 -18.617 -23.454 -23.454
  935   2HG   LYS 131           HG1      LYS 131 -18.050 -24.427 -24.427
  936   1HD   LYS 131           HD2      LYS 131 -17.033 -22.461 -22.461
  937   2HD   LYS 131           HD1      LYS 131 -17.668 -21.429 -21.429
  938   1HE   LYS 131           HE2      LYS 131 -15.827 -23.771 -23.771
  939   2HE   LYS 131           HE1      LYS 131 -15.231 -22.122 -22.122
  940   1HZ   LYS 131           HZ1      LYS 131 -16.897 -21.397 -21.397
  941   2HZ   LYS 131           HZ3      LYS 131 -17.142 -23.032 -23.032
  942   3HZ   LYS 131           HZ2      LYS 131 -15.615 -22.328 -22.328
  943    H1   NAG 132           H1       NAG 132  -2.447  -6.496  -6.496
  944    H2   NAG 132           H2       NAG 132  -1.572  -3.649  -3.649
  945    H3   NAG 132           H3       NAG 132  -0.023  -6.283  -6.283
  946    H4   NAG 132           H4       NAG 132  -1.282  -4.598  -4.598
  947    H5   NAG 132           H5       NAG 132  -2.186  -7.330  -7.330
  948   1H6   NAG 132           H61      NAG 132  -2.684  -5.808  -5.808
  949   2H6   NAG 132           H62      NAG 132  -4.178  -6.049  -6.049
  950   1H8   NAG 132           H81      NAG 132  -0.504  -1.724  -1.724
  951   2H8   NAG 132           H82      NAG 132   0.794  -2.051  -2.051
  952   3H8   NAG 132           H83      NAG 132  -0.841  -2.709  -2.709
  953    HN2  NAG 132           HN2      NAG 132  -0.963  -5.240  -5.240
  954    HO3  NAG 132           HO3      NAG 132   1.322  -4.845  -4.845
  955    H1   NAG 133           H1       NAG 133  -0.647  -5.732  -5.732
  956    H2   NAG 133           H2       NAG 133   2.182  -6.581  -6.581
  957    H3   NAG 133           H3       NAG 133   1.207  -5.856  -5.856
  958    H4   NAG 133           H4       NAG 133   3.071  -4.253  -4.253
  959    H5   NAG 133           H5       NAG 133   0.171  -3.619  -3.619
  960   1H6   NAG 133           H61      NAG 133   2.253  -2.207  -2.207
  961   2H6   NAG 133           H62      NAG 133   1.356  -1.612  -1.612
  962   1H8   NAG 133           H81      NAG 133  -1.505  -9.562  -9.562
  963   2H8   NAG 133           H82      NAG 133  -2.088  -7.890  -7.890
  964   3H8   NAG 133           H83      NAG 133  -1.217  -8.745  -8.745
  965    HN2  NAG 133           HN2      NAG 133   1.438  -8.620  -8.620
  966    HO3  NAG 133           HO3      NAG 133   3.831  -6.279  -6.279
  967    HO6  NAG 133           HO6      NAG 133   0.299  -2.211  -2.211
  968    H1   FUC 134           H1       FUC 134  -3.718  -8.217  -8.217
  969    H2   FUC 134           H2       FUC 134  -3.822 -10.328 -10.328
  970    H3   FUC 134           H3       FUC 134  -6.281 -10.211 -10.211
  971    H4   FUC 134           H4       FUC 134  -7.585 -10.402 -10.402
  972    H5   FUC 134           H5       FUC 134  -7.023  -7.956  -7.956
  973   1H6   FUC 134           H61      FUC 134  -7.033  -6.956  -6.956
  974   2H6   FUC 134           H62      FUC 134  -8.203  -8.313  -8.313
  975   3H6   FUC 134           H63      FUC 134  -6.620  -8.523  -8.523
  976    HO2  FUC 134           HO2      FUC 134  -4.142  -9.831  -9.831
  977    HO3  FUC 134           HO3      FUC 134  -6.180 -12.266 -12.266
  978    HO4  FUC 134           HO4      FUC 134  -5.023 -10.377 -10.377
  979    H1   MAN 135           H1       MAN 135   4.513  -3.933  -3.933
  980    H2   MAN 135           H2       MAN 135   3.894  -1.589  -1.589
  981    H3   MAN 135           H3       MAN 135   6.215  -1.898  -1.898
  982    H4   MAN 135           H4       MAN 135   5.434  -1.358  -1.358
  983    H5   MAN 135           H5       MAN 135   6.308  -4.002  -4.002
  984   1H6   MAN 135           H61      MAN 135   5.980  -3.056  -3.056
  985   2H6   MAN 135           H62      MAN 135   5.175  -4.595  -4.595
  986    HO2  MAN 135           HO2      MAN 135   3.399  -1.359  -1.359
  987    HO3  MAN 135           HO3      MAN 135   5.164   0.380   0.380
  988    HO4  MAN 135           HO4      MAN 135   7.642  -2.066  -2.066
  989    HO6  MAN 135           HO6      MAN 135   7.128  -5.474  -5.474
  990    H1   NAG 136           H1       NAG 136   0.185  -9.510  -9.510
  991    H2   NAG 136           H2       NAG 136  -2.880  -9.542  -9.542
  992    H3   NAG 136           H3       NAG 136  -0.879 -11.818 -11.818
  993    H4   NAG 136           H4       NAG 136  -2.409 -10.171 -10.171
  994    H5   NAG 136           H5       NAG 136   0.520 -10.020 -10.020
  995   1H6   NAG 136           H61      NAG 136   0.781  -8.814  -8.814
  996   2H6   NAG 136           H62      NAG 136  -0.659  -9.672  -9.672
  997   1H8   NAG 136           H81      NAG 136  -5.060 -10.789 -10.789
  998   2H8   NAG 136           H82      NAG 136  -4.112 -10.866 -10.866
  999   3H8   NAG 136           H83      NAG 136  -3.915  -9.477  -9.477
 1000    HN2  NAG 136           HN2      NAG 136  -1.211 -10.425 -10.425
 1001    HO3  NAG 136           HO3      NAG 136  -2.645 -12.956 -12.956
 1002    H1   NAG 137           H1       NAG 137   0.556 -11.240 -11.240
 1003    H2   NAG 137           H2       NAG 137  -0.474 -14.086 -14.086
 1004    H3   NAG 137           H3       NAG 137   2.449 -13.138 -13.138
 1005    H4   NAG 137           H4       NAG 137   0.752 -14.174 -14.174
 1006    H5   NAG 137           H5       NAG 137   1.699 -11.297 -11.297
 1007   1H6   NAG 137           H61      NAG 137   1.634 -11.823 -11.823
 1008   2H6   NAG 137           H62      NAG 137   0.310 -10.730 -10.730
 1009   1H8   NAG 137           H81      NAG 137   1.062 -11.329 -11.329
 1010   2H8   NAG 137           H82      NAG 137   2.809 -11.673 -11.673
 1011   3H8   NAG 137           H83      NAG 137   2.146 -11.177 -11.177
 1012    HN2  NAG 137           HN2      NAG 137  -0.205 -13.825 -13.825
 1013    HO3  NAG 137           HO3      NAG 137   1.118 -15.645 -15.645
 1014    HO6  NAG 137           HO6      NAG 137   0.178 -13.235 -13.235
 1015    H1   FUC 138           H1       FUC 138  -2.308  -8.348  -8.348
 1016    H2   FUC 138           H2       FUC 138  -2.503  -5.635  -5.635
 1017    H3   FUC 138           H3       FUC 138  -1.035  -5.310  -5.310
 1018    H4   FUC 138           H4       FUC 138   0.760  -4.501  -4.501
 1019    H5   FUC 138           H5       FUC 138   0.903  -7.104  -7.104
 1020   1H6   FUC 138           H61      FUC 138   2.294  -6.072  -6.072
 1021   2H6   FUC 138           H62      FUC 138   0.927  -6.362  -6.362
 1022   3H6   FUC 138           H63      FUC 138   1.742  -7.745  -7.745
 1023    HO2  FUC 138           HO2      FUC 138  -3.033  -6.295  -6.295
 1024    HO3  FUC 138           HO3      FUC 138  -1.328  -3.235  -3.235
 1025    HO4  FUC 138           HO4      FUC 138  -0.320  -3.671  -3.671
 1026    H1   MAN 139           H1       MAN 139   2.111 -15.477 -15.477
 1027    H2   MAN 139           H2       MAN 139   3.234 -14.437 -14.437
 1028    H3   MAN 139           H3       MAN 139   3.437 -16.846 -16.846
 1029    H4   MAN 139           H4       MAN 139   5.988 -16.439 -16.439
 1030    H5   MAN 139           H5       MAN 139   3.253 -17.491 -17.491
 1031   1H6   MAN 139           H61      MAN 139   4.176 -17.570 -17.570
 1032   2H6   MAN 139           H62      MAN 139   5.266 -18.468 -18.468
 1033    HO2  MAN 139           HO2      MAN 139   5.485 -14.322 -14.322
 1034    HO3  MAN 139           HO3      MAN 139   4.793 -15.583 -15.583
 1035    HO4  MAN 139           HO4      MAN 139   6.187 -18.349 -18.349
 1036    HO6  MAN 139           HO6      MAN 139   5.908 -16.452 -16.452

  Start of MODEL   13
    1   1H    ALA   1           HT3      ALA   1 -11.811   3.643   3.643
    2   2H    ALA   1           HT2      ALA   1 -13.263   3.865   3.865
    3   3H    ALA   1           HT1      ALA   1 -12.832   2.320   2.320
    4    HA   ALA   1           HA       ALA   1 -10.959   2.240   2.240
    5   1HB   ALA   1           HB2      ALA   1 -13.742   2.897   2.897
    6   2HB   ALA   1           HB1      ALA   1 -12.479   2.415   2.415
    7   3HB   ALA   1           HB3      ALA   1 -12.978   1.314   1.314
    8    H    MET   1           HN       MET   1  -9.338   3.607   3.607
    9    HA   MET   1           HA       MET   1  -9.807   6.471   6.471
   10   1HB   MET   1           HB2      MET   1  -7.369   4.666   4.666
   11   2HB   MET   1           HB1      MET   1  -7.321   6.429   6.429
   12   1HG   MET   1           HG2      MET   1  -8.407   4.795   4.795
   13   2HG   MET   1           HG1      MET   1  -6.802   5.523   5.523
   14   1HE   MET   1           HE3      MET   1  -7.168   6.731   6.731
   15   2HE   MET   1           HE2      MET   1  -8.496   7.824   7.824
   16   3HE   MET   1           HE1      MET   1  -8.810   6.101   6.101
   17    H    HIS   2           HN       HIS   2  -7.709   6.602   6.602
   18    HA   HIS   2           HA       HIS   2  -9.509   6.023   6.023
   19   1HB   HIS   2           HB2      HIS   2  -6.969   7.656   7.656
   20   2HB   HIS   2           HB1      HIS   2  -7.931   7.567   7.567
   21    HD1  HIS   2           HD1      HIS   2  -7.849   9.119   9.119
   22    HD2  HIS   2           HD2      HIS   2 -10.523   8.829   8.829
   23    HE1  HIS   2           HE1      HIS   2  -9.668  10.827  10.827
   24    H    VAL   3           HN       VAL   3  -7.953   3.911   3.911
   25    HA   VAL   3           HA       VAL   3  -6.298   2.986   2.986
   26    HB   VAL   3           HB       VAL   3  -5.890   2.570   2.570
   27   1HG1  VAL   3          HG13      VAL   3  -5.182   0.691   0.691
   28   2HG1  VAL   3          HG12      VAL   3  -3.985   1.832   1.832
   29   3HG1  VAL   3          HG11      VAL   3  -3.938   1.328   1.328
   30   1HG2  VAL   3          HG23      VAL   3  -5.378   4.868   4.868
   31   2HG2  VAL   3          HG22      VAL   3  -4.020   4.059   4.059
   32   3HG2  VAL   3          HG21      VAL   3  -4.141   4.076   4.076
   33    H    ALA   4           HN       ALA   4  -7.020   1.055   1.055
   34    HA   ALA   4           HA       ALA   4  -9.064  -0.478  -0.478
   35   1HB   ALA   4           HB2      ALA   4  -8.348  -0.367  -0.367
   36   2HB   ALA   4           HB1      ALA   4  -9.638  -1.360  -1.360
   37   3HB   ALA   4           HB3      ALA   4  -9.740   0.399   0.399
   38    H    GLN   5           HN       GLN   5  -8.568  -2.523  -2.523
   39    HA   GLN   5           HA       GLN   5  -6.213  -3.918  -3.918
   40   1HB   GLN   5           HB2      GLN   5  -6.906  -3.586  -3.586
   41   2HB   GLN   5           HB1      GLN   5  -5.539  -4.506  -4.506
   42   1HG   GLN   5           HG2      GLN   5  -4.363  -2.580  -2.580
   43   2HG   GLN   5           HG1      GLN   5  -5.241  -2.058  -2.058
   44   1HE2  GLN   5          HE22      GLN   5  -5.732   0.386   0.386
   45   2HE2  GLN   5          HE21      GLN   5  -4.334  -0.315  -0.315
   46    HA   PRO   6           HA       PRO   6  -9.276  -7.227  -7.227
   47   1HB   PRO   6           HB2      PRO   6  -7.635  -9.244  -9.244
   48   2HB   PRO   6           HB1      PRO   6  -8.298  -8.024  -8.024
   49   1HG   PRO   6           HG2      PRO   6  -5.589  -8.196  -8.196
   50   2HG   PRO   6           HG1      PRO   6  -6.061  -7.705  -7.705
   51   1HD   PRO   6           HD2      PRO   6  -5.399  -5.938  -5.938
   52   2HD   PRO   6           HD1      PRO   6  -6.525  -5.556  -5.556
   53    H    ALA   7           HN       ALA   7  -9.845  -8.687  -8.687
   54    HA   ALA   7           HA       ALA   7  -8.149  -8.871  -8.871
   55   1HB   ALA   7           HB3      ALA   7 -10.707  -8.822  -8.822
   56   2HB   ALA   7           HB2      ALA   7 -10.615 -10.494 -10.494
   57   3HB   ALA   7           HB1      ALA   7 -10.039 -10.066 -10.066
   58    H    VAL   8           HN       VAL   8  -8.860 -10.971 -10.971
   59    HA   VAL   8           HA       VAL   8  -6.578 -12.623 -12.623
   60    HB   VAL   8           HB       VAL   8  -8.781 -13.402 -13.402
   61   1HG1  VAL   8          HG12      VAL   8  -9.412 -13.896 -13.896
   62   2HG1  VAL   8          HG11      VAL   8  -9.806 -15.183 -15.183
   63   3HG1  VAL   8          HG13      VAL   8 -10.493 -13.561 -13.561
   64   1HG2  VAL   8          HG23      VAL   8  -6.538 -14.761 -14.761
   65   2HG2  VAL   8          HG22      VAL   8  -7.619 -15.279 -15.279
   66   3HG2  VAL   8          HG21      VAL   8  -7.919 -15.765 -15.765
   67    H    VAL   9           HN       VAL   9  -5.863 -13.996 -13.996
   68    HA   VAL   9           HA       VAL   9  -6.988 -13.492 -13.492
   69    HB   VAL   9           HB       VAL   9  -4.287 -12.831 -12.831
   70   1HG1  VAL   9          HG11      VAL   9  -4.942 -13.609 -13.609
   71   2HG1  VAL   9          HG13      VAL   9  -3.654 -12.454 -12.454
   72   3HG1  VAL   9          HG12      VAL   9  -3.558 -14.099 -14.099
   73   1HG2  VAL   9          HG23      VAL   9  -6.228 -11.210 -11.210
   74   2HG2  VAL   9          HG22      VAL   9  -4.715 -10.729 -10.729
   75   3HG2  VAL   9          HG21      VAL   9  -6.015 -11.411 -11.411
   76    H    LEU  10           HN       LEU  10  -6.960 -15.265 -15.265
   77    HA   LEU  10           HA       LEU  10  -5.838 -17.782 -17.782
   78   1HB   LEU  10           HB2      LEU  10  -7.739 -17.097 -17.097
   79   2HB   LEU  10           HB1      LEU  10  -7.325 -18.736 -18.736
   80    HG   LEU  10           HG       LEU  10  -9.388 -18.250 -18.250
   81   1HD1  LEU  10          HD11      LEU  10  -7.429 -19.143 -19.143
   82   2HD1  LEU  10          HD13      LEU  10  -7.555 -17.571 -17.571
   83   3HD1  LEU  10          HD12      LEU  10  -8.941 -18.661 -18.661
   84   1HD2  LEU  10          HD23      LEU  10  -8.916 -15.667 -15.667
   85   2HD2  LEU  10          HD22      LEU  10 -10.063 -16.253 -16.253
   86   3HD2  LEU  10          HD21      LEU  10  -8.426 -15.809 -15.809
   87    H    ALA  11           HN       ALA  11  -3.914 -18.538 -18.538
   88    HA   ALA  11           HA       ALA  11  -2.726 -17.266 -17.266
   89   1HB   ALA  11           HB1      ALA  11  -1.621 -17.958 -17.958
   90   2HB   ALA  11           HB3      ALA  11  -1.625 -19.590 -19.590
   91   3HB   ALA  11           HB2      ALA  11  -0.740 -18.303 -18.303
   92    H    SER  12           HN       SER  12  -2.144 -18.434 -18.434
   93    HA   SER  12           HA       SER  12  -4.014 -20.515 -20.515
   94   1HB   SER  12           HB2      SER  12  -3.220 -18.783 -18.783
   95   2HB   SER  12           HB1      SER  12  -1.549 -19.276 -19.276
   96    HG   SER  12           HG       SER  12  -2.640 -20.119 -20.119
   97    H    SER  13           HN       SER  13  -3.060 -22.536 -22.536
   98    HA   SER  13           HA       SER  13  -1.726 -24.213 -24.213
   99   1HB   SER  13           HB2      SER  13  -1.623 -25.768 -25.768
  100   2HB   SER  13           HB1      SER  13  -3.171 -24.927 -24.927
  101    HG   SER  13           HG       SER  13  -2.543 -24.583 -24.583
  102    H    ARG  14           HN       ARG  14  -0.488 -22.098 -22.098
  103    HA   ARG  14           HA       ARG  14   2.175 -23.094 -23.094
  104   1HB   ARG  14           HB2      ARG  14   1.040 -21.386 -21.386
  105   2HB   ARG  14           HB1      ARG  14   1.146 -20.239 -20.239
  106   1HG   ARG  14           HG2      ARG  14   3.034 -19.736 -19.736
  107   2HG   ARG  14           HG1      ARG  14   3.683 -20.736 -20.736
  108   1HD   ARG  14           HD2      ARG  14   4.140 -22.492 -22.492
  109   2HD   ARG  14           HD1      ARG  14   2.714 -22.191 -22.191
  110    HE   ARG  14           HE       ARG  14   5.351 -20.957 -20.957
  111   1HH1  ARG  14          HH21      ARG  14   1.916 -20.638 -20.638
  112   2HH1  ARG  14          HH22      ARG  14   2.145 -19.592 -19.592
  113   1HH2  ARG  14          HH11      ARG  14   5.597 -19.598 -19.598
  114   2HH2  ARG  14          HH12      ARG  14   4.204 -19.007 -19.007
  115    H    GLY  15           HN       GLY  15   0.631 -21.172 -21.172
  116   1HA   GLY  15           HA2      GLY  15   1.499 -21.036 -21.036
  117   2HA   GLY  15           HA1      GLY  15   3.122 -21.312 -21.312
  118    H    ILE  16           HN       ILE  16   1.025 -19.078 -19.078
  119    HA   ILE  16           HA       ILE  16   2.700 -16.843 -16.843
  120    HB   ILE  16           HB       ILE  16   1.429 -17.542 -17.542
  121   1HG1  ILE  16          HG12      ILE  16   3.712 -16.885 -16.885
  122   2HG1  ILE  16          HG11      ILE  16   4.150 -16.577 -16.577
  123   1HG2  ILE  16          HG23      ILE  16   1.953 -14.795 -14.795
  124   2HG2  ILE  16          HG22      ILE  16   2.380 -15.119 -15.119
  125   3HG2  ILE  16          HG21      ILE  16   0.717 -15.336 -15.336
  126   1HD1  ILE  16          HD11      ILE  16   3.008 -19.254 -19.254
  127   2HD1  ILE  16          HD13      ILE  16   4.669 -18.905 -18.905
  128   3HD1  ILE  16          HD12      ILE  16   4.217 -18.802 -18.802
  129    H    ALA  17           HN       ALA  17   1.610 -15.782 -15.782
  130    HA   ALA  17           HA       ALA  17  -1.349 -15.427 -15.427
  131   1HB   ALA  17           HB3      ALA  17   0.649 -14.984 -14.984
  132   2HB   ALA  17           HB2      ALA  17  -1.077 -14.647 -14.647
  133   3HB   ALA  17           HB1      ALA  17  -0.518 -16.301 -16.301
  134    H    SER  18           HN       SER  18  -1.944 -13.555 -13.555
  135    HA   SER  18           HA       SER  18  -0.183 -11.156 -11.156
  136   1HB   SER  18           HB2      SER  18  -0.703 -10.599 -10.599
  137   2HB   SER  18           HB1      SER  18  -0.181 -12.279 -12.279
  138    HG   SER  18           HG       SER  18  -2.763 -11.195 -11.195
  139    H    PHE  19           HN       PHE  19  -1.196  -9.257  -9.257
  140    HA   PHE  19           HA       PHE  19  -4.148  -9.042  -9.042
  141   1HB   PHE  19           HB2      PHE  19  -4.223  -8.510  -8.510
  142   2HB   PHE  19           HB1      PHE  19  -3.662 -10.147 -10.147
  143    HD1  PHE  19           HD1      PHE  19  -1.221 -10.715 -10.715
  144    HD2  PHE  19           HD2      PHE  19  -2.773  -6.833  -6.833
  145    HE1  PHE  19           HE1      PHE  19   0.884 -10.245 -10.245
  146    HE2  PHE  19           HE2      PHE  19  -0.661  -6.361  -6.361
  147    HZ   PHE  19           HZ       PHE  19   1.163  -8.073  -8.073
  148    H    VAL  20           HN       VAL  20  -4.832  -6.784  -6.784
  149    HA   VAL  20           HA       VAL  20  -2.634  -4.838  -4.838
  150    HB   VAL  20           HB       VAL  20  -5.502  -4.906  -4.906
  151   1HG1  VAL  20          HG11      VAL  20  -4.612  -2.573  -2.573
  152   2HG1  VAL  20          HG13      VAL  20  -3.379  -2.869  -2.869
  153   3HG1  VAL  20          HG12      VAL  20  -5.087  -2.843  -2.843
  154   1HG2  VAL  20          HG23      VAL  20  -3.856  -6.440  -6.440
  155   2HG2  VAL  20          HG22      VAL  20  -4.533  -5.226  -5.226
  156   3HG2  VAL  20          HG21      VAL  20  -2.904  -5.020  -5.020
  157    H    CYS  21           HN       CYS  21  -2.274  -3.654  -3.654
  158    HA   CYS  21           HA       CYS  21  -4.561  -2.985  -2.985
  159   1HB   CYS  21           HB2      CYS  21  -2.454  -4.032  -4.032
  160   2HB   CYS  21           HB1      CYS  21  -1.552  -2.635  -2.635
  161    H    GLU  22           HN       GLU  22  -5.528  -1.145  -1.145
  162    HA   GLU  22           HA       GLU  22  -4.010   0.802   0.802
  163   1HB   GLU  22           HB2      GLU  22  -6.821   0.908   0.908
  164   2HB   GLU  22           HB1      GLU  22  -6.157   1.885   1.885
  165   1HG   GLU  22           HG2      GLU  22  -5.720  -0.157  -0.157
  166   2HG   GLU  22           HG1      GLU  22  -6.456  -1.117  -1.117
  167    H    TYR  23           HN       TYR  23  -4.090   3.112   3.112
  168    HA   TYR  23           HA       TYR  23  -4.252   3.852   3.852
  169   1HB   TYR  23           HB2      TYR  23  -1.922   4.595   4.595
  170   2HB   TYR  23           HB1      TYR  23  -1.960   2.912   2.912
  171    HD1  TYR  23           HD2      TYR  23  -1.693   2.335   2.335
  172    HD2  TYR  23           HD1      TYR  23  -1.184   6.370   6.370
  173    HE1  TYR  23           HE2      TYR  23  -0.530   2.961   2.961
  174    HE2  TYR  23           HE1      TYR  23  -0.024   7.001   7.001
  175    HH   TYR  23           HH       TYR  23  -0.100   6.014   6.014
  176    H    ALA  24           HN       ALA  24  -3.513   6.326   6.326
  177    HA   ALA  24           HA       ALA  24  -4.631   7.737   7.737
  178   1HB   ALA  24           HB1      ALA  24  -5.187   8.056   8.056
  179   2HB   ALA  24           HB3      ALA  24  -5.585   9.321   9.321
  180   3HB   ALA  24           HB2      ALA  24  -6.343   7.734   7.734
  181    H    SER  25           HN       SER  25  -3.225   9.292   9.292
  182    HA   SER  25           HA       SER  25  -1.023  10.181  10.181
  183   1HB   SER  25           HB2      SER  25  -0.197   8.960   8.960
  184   2HB   SER  25           HB1      SER  25  -1.234   9.837   9.837
  185    HG   SER  25           HG       SER  25   0.377  11.166  11.166
  186    HA   PRO  26           HA       PRO  26  -2.559  14.302  14.302
  187   1HB   PRO  26           HB2      PRO  26  -0.231  15.713  15.713
  188   2HB   PRO  26           HB1      PRO  26  -1.023  14.853  14.853
  189   1HG   PRO  26           HG2      PRO  26   1.294  14.014  14.014
  190   2HG   PRO  26           HG1      PRO  26   1.048  13.843  13.843
  191   1HD   PRO  26           HD2      PRO  26   0.680  11.789  11.789
  192   2HD   PRO  26           HD1      PRO  26  -0.262  11.966  11.966
  193    H    GLY  27           HN       GLY  27  -0.145  13.162  13.162
  194   1HA   GLY  27           HA2      GLY  27  -1.249  14.720  14.720
  195   2HA   GLY  27           HA1      GLY  27   0.289  15.402  15.402
  196    H    LYS  28           HN       LYS  28   0.904  14.763  14.763
  197    HA   LYS  28           HA       LYS  28   1.342  11.862  11.862
  198   1HB   LYS  28           HB2      LYS  28   0.429  13.382  13.382
  199   2HB   LYS  28           HB1      LYS  28   1.932  14.304  14.304
  200   1HG   LYS  28           HG2      LYS  28   3.170  12.196  12.196
  201   2HG   LYS  28           HG1      LYS  28   1.613  11.394  11.394
  202   1HD   LYS  28           HD2      LYS  28   0.994  12.972  12.972
  203   2HD   LYS  28           HD1      LYS  28   2.492  13.871  13.871
  204   1HE   LYS  28           HE2      LYS  28   3.789  11.827  11.827
  205   2HE   LYS  28           HE1      LYS  28   2.258  11.001  11.001
  206   1HZ   LYS  28           HZ3      LYS  28   1.692  12.782  12.782
  207   2HZ   LYS  28           HZ2      LYS  28   3.173  13.553  13.553
  208   3HZ   LYS  28           HZ1      LYS  28   3.147  12.041  12.041
  209    H    ALA  29           HN       ALA  29   3.267  10.925  10.925
  210    HA   ALA  29           HA       ALA  29   5.793  12.477  12.477
  211   1HB   ALA  29           HB3      ALA  29   4.641  11.188  11.188
  212   2HB   ALA  29           HB2      ALA  29   6.349  11.605  11.605
  213   3HB   ALA  29           HB1      ALA  29   5.122  12.871  12.871
  214    H    THR  30           HN       THR  30   7.663  11.028  11.028
  215    HA   THR  30           HA       THR  30   7.040   8.426   8.426
  216    HB   THR  30           HB       THR  30   9.460   8.298   8.298
  217    HG1  THR  30           HG1      THR  30   9.592  10.618  10.618
  218   1HG2  THR  30          HG23      THR  30   7.897  10.273  10.273
  219   2HG2  THR  30          HG22      THR  30   9.256  11.175  11.175
  220   3HG2  THR  30          HG21      THR  30   9.548   9.886   9.886
  221    H    GLU  31           HN       GLU  31   8.513   9.597   9.597
  222    HA   GLU  31           HA       GLU  31   9.306   6.950   6.950
  223   1HB   GLU  31           HB2      GLU  31   9.005   9.533   9.533
  224   2HB   GLU  31           HB1      GLU  31  10.035   8.175   8.175
  225   1HG   GLU  31           HG2      GLU  31  10.502   9.413   9.413
  226   2HG   GLU  31           HG1      GLU  31  10.952  10.371  10.371
  227    H    VAL  32           HN       VAL  32   7.810   5.499   5.499
  228    HA   VAL  32           HA       VAL  32   5.747   6.349   6.349
  229    HB   VAL  32           HB       VAL  32   5.435   4.447   4.447
  230   1HG1  VAL  32          HG12      VAL  32   4.174   4.251   4.251
  231   2HG1  VAL  32          HG11      VAL  32   3.057   5.285   5.285
  232   3HG1  VAL  32          HG13      VAL  32   3.485   3.695   3.695
  233   1HG2  VAL  32          HG22      VAL  32   4.699   7.289   7.289
  234   2HG2  VAL  32          HG21      VAL  32   5.122   6.500   6.500
  235   3HG2  VAL  32          HG23      VAL  32   3.506   6.299   6.299
  236    H    ARG  33           HN       ARG  33   7.423   5.570   5.570
  237    HA   ARG  33           HA       ARG  33   8.650   3.018   3.018
  238   1HB   ARG  33           HB2      ARG  33   9.178   5.028   5.028
  239   2HB   ARG  33           HB1      ARG  33   7.824   4.544   4.544
  240   1HG   ARG  33           HG2      ARG  33   8.861   2.370   2.370
  241   2HG   ARG  33           HG1      ARG  33  10.188   2.773   2.773
  242   1HD   ARG  33           HD2      ARG  33  11.259   3.552   3.552
  243   2HD   ARG  33           HD1      ARG  33  10.133   4.921   4.921
  244    HE   ARG  33           HE       ARG  33   8.887   3.940   3.940
  245   1HH1  ARG  33          HH21      ARG  33  11.119   1.608   1.608
  246   2HH1  ARG  33          HH22      ARG  33  10.828   0.455   0.455
  247   1HH2  ARG  33          HH11      ARG  33   8.543   2.416   2.416
  248   2HH2  ARG  33          HH12      ARG  33   9.386   0.903   0.903
  249    H    VAL  34           HN       VAL  34   7.757   1.048   1.048
  250    HA   VAL  34           HA       VAL  34   5.318   0.705   0.705
  251    HB   VAL  34           HB       VAL  34   4.661  -1.041  -1.041
  252   1HG1  VAL  34          HG11      VAL  34   4.107   1.515   1.515
  253   2HG1  VAL  34          HG13      VAL  34   5.172   1.487   1.487
  254   3HG1  VAL  34          HG12      VAL  34   3.727   0.477   0.477
  255   1HG2  VAL  34          HG21      VAL  34   7.042   0.023   0.023
  256   2HG2  VAL  34          HG23      VAL  34   6.903  -1.590  -1.590
  257   3HG2  VAL  34          HG22      VAL  34   5.843  -1.109  -1.109
  258    H    THR  35           HN       THR  35   5.531  -0.841  -0.841
  259    HA   THR  35           HA       THR  35   7.850  -2.737  -2.737
  260    HB   THR  35           HB       THR  35   6.664  -1.360  -1.360
  261    HG1  THR  35           HG1      THR  35   8.985  -0.871  -0.871
  262   1HG2  THR  35          HG21      THR  35   8.028  -3.714  -3.714
  263   2HG2  THR  35          HG23      THR  35   9.368  -2.572  -2.572
  264   3HG2  THR  35          HG22      THR  35   8.110  -2.569  -2.569
  265    H    VAL  36           HN       VAL  36   7.291  -4.860  -4.860
  266    HA   VAL  36           HA       VAL  36   4.515  -5.503  -5.503
  267    HB   VAL  36           HB       VAL  36   6.601  -7.044  -7.044
  268   1HG1  VAL  36          HG12      VAL  36   3.778  -7.723  -7.723
  269   2HG1  VAL  36          HG11      VAL  36   4.570  -8.517  -8.517
  270   3HG1  VAL  36          HG13      VAL  36   5.245  -8.666  -8.666
  271   1HG2  VAL  36          HG22      VAL  36   4.352  -5.229  -5.229
  272   2HG2  VAL  36          HG21      VAL  36   5.856  -5.547  -5.547
  273   3HG2  VAL  36          HG23      VAL  36   4.515  -6.686  -6.686
  274    H    LEU  37           HN       LEU  37   4.233  -6.832  -6.832
  275    HA   LEU  37           HA       LEU  37   6.818  -7.725  -7.725
  276   1HB   LEU  37           HB2      LEU  37   4.302  -6.601  -6.601
  277   2HB   LEU  37           HB1      LEU  37   5.713  -7.157  -7.157
  278    HG   LEU  37           HG       LEU  37   6.013  -5.073  -5.073
  279   1HD1  LEU  37          HD12      LEU  37   4.205  -4.557  -4.557
  280   2HD1  LEU  37          HD11      LEU  37   5.627  -4.297  -4.297
  281   3HD1  LEU  37          HD13      LEU  37   5.392  -3.331  -3.331
  282   1HD2  LEU  37          HD21      LEU  37   7.577  -6.242  -6.242
  283   2HD2  LEU  37          HD23      LEU  37   8.133  -5.566  -5.566
  284   3HD2  LEU  37          HD22      LEU  37   7.726  -4.492  -4.492
  285    H    ARG  38           HN       ARG  38   6.551  -9.489  -9.489
  286    HA   ARG  38           HA       ARG  38   4.358 -11.397 -11.397
  287   1HB   ARG  38           HB2      ARG  38   7.282 -11.567 -11.567
  288   2HB   ARG  38           HB1      ARG  38   6.458 -12.832 -12.832
  289   1HG   ARG  38           HG2      ARG  38   5.328 -13.628 -13.628
  290   2HG   ARG  38           HG1      ARG  38   5.815 -12.218 -12.218
  291   1HD   ARG  38           HD2      ARG  38   8.251 -12.963 -12.963
  292   2HD   ARG  38           HD1      ARG  38   7.533 -14.520 -14.520
  293    HE   ARG  38           HE       ARG  38   7.602 -13.359 -13.359
  294   1HH1  ARG  38          HH21      ARG  38   6.069 -15.670 -15.670
  295   2HH1  ARG  38          HH22      ARG  38   5.568 -16.687 -16.687
  296   1HH2  ARG  38          HH11      ARG  38   6.928 -14.704 -14.704
  297   2HH2  ARG  38          HH12      ARG  38   6.044 -16.148 -16.148
  298    H    GLN  39           HN       GLN  39   2.942 -10.672 -10.672
  299    HA   GLN  39           HA       GLN  39   4.038 -10.770 -10.770
  300   1HB   GLN  39           HB2      GLN  39   2.545  -8.951  -8.951
  301   2HB   GLN  39           HB1      GLN  39   1.266 -10.147 -10.147
  302   1HG   GLN  39           HG2      GLN  39   1.743 -10.679 -10.679
  303   2HG   GLN  39           HG1      GLN  39   2.543  -9.104  -9.104
  304   1HE2  GLN  39          HE22      GLN  39  -1.479  -9.179  -9.179
  305   2HE2  GLN  39          HE21      GLN  39  -0.511 -10.511 -10.511
  306    H    ALA  40           HN       ALA  40   3.509 -12.317 -12.317
  307    HA   ALA  40           HA       ALA  40   1.427 -14.340 -14.340
  308   1HB   ALA  40           HB2      ALA  40   4.286 -14.648 -14.648
  309   2HB   ALA  40           HB1      ALA  40   3.719 -15.801 -15.801
  310   3HB   ALA  40           HB3      ALA  40   2.984 -15.771 -15.771
  311    H    ASP  41           HN       ASP  41   0.858 -15.560 -15.560
  312    HA   ASP  41           HA       ASP  41   0.926 -14.106 -14.106
  313   1HB   ASP  41           HB2      ASP  41   0.414 -16.978 -16.978
  314   2HB   ASP  41           HB1      ASP  41   0.170 -16.364 -16.364
  315    H    SER  42           HN       SER  42   2.906 -16.849 -16.849
  316    HA   SER  42           HA       SER  42   4.435 -17.111 -17.111
  317   1HB   SER  42           HB2      SER  42   5.819 -18.574 -18.574
  318   2HB   SER  42           HB1      SER  42   4.113 -18.861 -18.861
  319    HG   SER  42           HG       SER  42   5.058 -18.625 -18.625
  320    H    GLN  43           HN       GLN  43   5.103 -15.456 -15.456
  321    HA   GLN  43           HA       GLN  43   6.939 -13.589 -13.589
  322   1HB   GLN  43           HB2      GLN  43   7.758 -15.758 -15.758
  323   2HB   GLN  43           HB1      GLN  43   8.682 -14.259 -14.259
  324   1HG   GLN  43           HG2      GLN  43   9.819 -15.269 -15.269
  325   2HG   GLN  43           HG1      GLN  43   8.417 -14.865 -14.865
  326   1HE2  GLN  43          HE22      GLN  43   9.024 -18.538 -18.538
  327   2HE2  GLN  43          HE21      GLN  43   9.909 -17.135 -17.135
  328    H    VAL  44           HN       VAL  44   7.617 -11.817 -11.817
  329    HA   VAL  44           HA       VAL  44   5.986 -11.550 -11.550
  330    HB   VAL  44           HB       VAL  44   6.547  -9.457  -9.457
  331   1HG1  VAL  44          HG11      VAL  44   6.135  -8.979  -8.979
  332   2HG1  VAL  44          HG13      VAL  44   4.464  -9.050  -9.050
  333   3HG1  VAL  44          HG12      VAL  44   5.585  -7.892  -7.892
  334   1HG2  VAL  44          HG23      VAL  44   4.829 -11.374 -11.374
  335   2HG2  VAL  44          HG22      VAL  44   4.331  -9.709  -9.709
  336   3HG2  VAL  44          HG21      VAL  44   3.829 -10.537 -10.537
  337    H    THR  45           HN       THR  45   7.278 -10.975 -10.975
  338    HA   THR  45           HA       THR  45   9.878  -9.588  -9.588
  339    HB   THR  45           HB       THR  45  10.974 -11.230 -11.230
  340    HG1  THR  45           HG1      THR  45   8.456 -12.528 -12.528
  341   1HG2  THR  45          HG22      THR  45  10.722 -11.569 -11.569
  342   2HG2  THR  45          HG21      THR  45   9.439 -12.714 -12.714
  343   3HG2  THR  45          HG23      THR  45  11.084 -13.010 -13.010
  344    H    GLU  46           HN       GLU  46  10.851  -8.699  -8.699
  345    HA   GLU  46           HA       GLU  46   8.838  -7.409  -7.409
  346   1HB   GLU  46           HB2      GLU  46  11.858  -7.390  -7.390
  347   2HB   GLU  46           HB1      GLU  46  10.973  -6.428  -6.428
  348   1HG   GLU  46           HG2      GLU  46   9.901  -5.143  -5.143
  349   2HG   GLU  46           HG1      GLU  46  10.377  -6.273  -6.273
  350    H    VAL  47           HN       VAL  47   8.908  -7.510  -7.510
  351    HA   VAL  47           HA       VAL  47   9.908 -10.154 -10.154
  352    HB   VAL  47           HB       VAL  47   7.357  -8.654  -8.654
  353   1HG1  VAL  47          HG11      VAL  47   8.702 -11.050 -11.050
  354   2HG1  VAL  47          HG13      VAL  47   6.948 -11.111 -11.111
  355   3HG1  VAL  47          HG12      VAL  47   7.690  -9.845  -9.845
  356   1HG2  VAL  47          HG23      VAL  47   7.492  -9.732  -9.732
  357   2HG2  VAL  47          HG22      VAL  47   6.215 -10.364 -10.364
  358   3HG2  VAL  47          HG21      VAL  47   7.709 -11.275 -11.275
  359    H    CYS  48           HN       CYS  48   8.362  -7.580  -7.580
  360    HA   CYS  48           HA       CYS  48  10.959  -7.216  -7.216
  361   1HB   CYS  48           HB2      CYS  48   9.024  -8.465  -8.465
  362   2HB   CYS  48           HB1      CYS  48   8.133  -6.948  -6.948
  363    H    ALA  49           HN       ALA  49  11.411  -5.038  -5.038
  364    HA   ALA  49           HA       ALA  49   9.599  -2.826  -2.826
  365   1HB   ALA  49           HB2      ALA  49  10.997  -3.906  -3.906
  366   2HB   ALA  49           HB1      ALA  49  12.076  -2.605  -2.605
  367   3HB   ALA  49           HB3      ALA  49  10.412  -2.242  -2.242
  368    H    ALA  50           HN       ALA  50  10.050  -1.210  -1.210
  369    HA   ALA  50           HA       ALA  50  12.698  -0.175  -0.175
  370   1HB   ALA  50           HB1      ALA  50  12.454  -2.435  -2.435
  371   2HB   ALA  50           HB3      ALA  50  11.420  -1.500  -1.500
  372   3HB   ALA  50           HB2      ALA  50  13.105  -1.037  -1.037
  373    H    THR  51           HN       THR  51  12.510   1.727   1.727
  374    HA   THR  51           HA       THR  51   9.854   2.967   2.967
  375    HB   THR  51           HB       THR  51  12.174   4.115   4.115
  376    HG1  THR  51           HG1      THR  51  11.860   3.895   3.895
  377   1HG2  THR  51          HG23      THR  51   9.781   5.076   5.076
  378   2HG2  THR  51          HG22      THR  51  11.206   6.113   6.113
  379   3HG2  THR  51          HG21      THR  51  10.417   5.610   5.610
  380    H    TYR  52           HN       TYR  52   8.284   2.626   2.626
  381    HA   TYR  52           HA       TYR  52   8.925   1.431   1.431
  382   1HB   TYR  52           HB2      TYR  52   6.865   1.051   1.051
  383   2HB   TYR  52           HB1      TYR  52   6.327   2.658   2.658
  384    HD1  TYR  52           HD1      TYR  52   6.282   3.149   3.149
  385    HD2  TYR  52           HD2      TYR  52   6.412  -0.806  -0.806
  386    HE1  TYR  52           HE1      TYR  52   5.440   2.170   2.170
  387    HE2  TYR  52           HE2      TYR  52   5.576  -1.786  -1.786
  388    HH   TYR  52           HH       TYR  52   5.589  -0.162  -0.162
  389    H    MET  53           HN       MET  53   9.889   2.788   2.788
  390    HA   MET  53           HA       MET  53   9.236   5.661   5.661
  391   1HB   MET  53           HB2      MET  53  10.917   3.922   3.922
  392   2HB   MET  53           HB1      MET  53  10.946   5.683   5.683
  393   1HG   MET  53           HG2      MET  53  12.179   3.688   3.688
  394   2HG   MET  53           HG1      MET  53  12.684   5.337   5.337
  395   1HE   MET  53           HE3      MET  53  11.115   7.237   7.237
  396   2HE   MET  53           HE2      MET  53  10.529   7.594   7.594
  397   3HE   MET  53           HE1      MET  53  12.251   7.371   7.371
  398    H    MET  54           HN       MET  54   7.806   6.555   6.555
  399    HA   MET  54           HA       MET  54   5.836   4.922   4.922
  400   1HB   MET  54           HB2      MET  54   6.845   7.729   7.729
  401   2HB   MET  54           HB1      MET  54   5.436   7.066   7.066
  402   1HG   MET  54           HG2      MET  54   5.685   7.046   7.046
  403   2HG   MET  54           HG1      MET  54   4.963   8.397   8.397
  404   1HE   MET  54           HE3      MET  54   4.873   5.371   5.371
  405   2HE   MET  54           HE2      MET  54   3.210   4.789   4.789
  406   3HE   MET  54           HE1      MET  54   4.365   4.208   4.208
  407    H    GLY  55           HN       GLY  55   9.074   5.665   5.665
  408   1HA   GLY  55           HA2      GLY  55   8.484   4.845   4.845
  409   2HA   GLY  55           HA1      GLY  55  10.018   5.494   5.494
  410    H    ASN  56           HN       ASN  56  11.534   4.072   4.072
  411    HA   ASN  56           HA       ASN  56  11.299   1.264   1.264
  412   1HB   ASN  56           HB2      ASN  56  13.385   2.864   2.864
  413   2HB   ASN  56           HB1      ASN  56  13.618   1.209   1.209
  414   1HD2  ASN  56          HD22      ASN  56  13.310   2.396   2.396
  415   2HD2  ASN  56          HD21      ASN  56  12.469   1.289   1.289
  416    H    GLU  57           HN       GLU  57  11.741  -0.512  -0.512
  417    HA   GLU  57           HA       GLU  57  10.377   0.036   0.036
  418   1HB   GLU  57           HB2      GLU  57   9.313  -1.524  -1.524
  419   2HB   GLU  57           HB1      GLU  57  10.758  -2.535  -2.535
  420   1HG   GLU  57           HG2      GLU  57   9.137  -3.483  -3.483
  421   2HG   GLU  57           HG1      GLU  57  10.420  -2.753  -2.753
  422    H    LEU  58           HN       LEU  58  11.566  -0.211  -0.211
  423    HA   LEU  58           HA       LEU  58  14.385  -0.947  -0.947
  424   1HB   LEU  58           HB2      LEU  58  12.426  -0.353  -0.353
  425   2HB   LEU  58           HB1      LEU  58  14.140  -0.651  -0.651
  426    HG   LEU  58           HG       LEU  58  12.994   1.553   1.553
  427   1HD1  LEU  58          HD11      LEU  58  12.940   1.524   1.524
  428   2HD1  LEU  58          HD13      LEU  58  14.616   2.035   2.035
  429   3HD1  LEU  58          HD12      LEU  58  13.306   2.996   2.996
  430   1HD2  LEU  58          HD22      LEU  58  15.811   0.688   0.688
  431   2HD2  LEU  58          HD21      LEU  58  15.121   0.963   0.963
  432   3HD2  LEU  58          HD23      LEU  58  15.449   2.330   2.330
  433    H    THR  59           HN       THR  59  15.228  -2.623  -2.623
  434    HA   THR  59           HA       THR  59  13.722  -5.145  -5.145
  435    HB   THR  59           HB       THR  59  15.939  -6.063  -6.063
  436    HG1  THR  59           HG1      THR  59  16.978  -3.463  -3.463
  437   1HG2  THR  59          HG22      THR  59  15.373  -5.403  -5.403
  438   2HG2  THR  59          HG21      THR  59  16.209  -3.878  -3.878
  439   3HG2  THR  59          HG23      THR  59  17.101  -5.398  -5.398
  440    H    PHE  60           HN       PHE  60  13.714  -6.609  -6.609
  441    HA   PHE  60           HA       PHE  60  13.464  -5.035  -5.035
  442   1HB   PHE  60           HB2      PHE  60  12.042  -7.506  -7.506
  443   2HB   PHE  60           HB1      PHE  60  11.806  -6.825  -6.825
  444    HD1  PHE  60           HD1      PHE  60  11.497  -4.062  -4.062
  445    HD2  PHE  60           HD2      PHE  60  10.365  -6.966  -6.966
  446    HE1  PHE  60           HE1      PHE  60   9.795  -2.462  -2.462
  447    HE2  PHE  60           HE2      PHE  60   8.657  -5.380  -5.380
  448    HZ   PHE  60           HZ       PHE  60   8.358  -3.134  -3.134
  449    H    LEU  61           HN       LEU  61  15.635  -5.418  -5.418
  450    HA   LEU  61           HA       LEU  61  16.915  -8.003  -8.003
  451   1HB   LEU  61           HB2      LEU  61  17.296  -5.419  -5.419
  452   2HB   LEU  61           HB1      LEU  61  18.409  -6.781  -6.781
  453    HG   LEU  61           HG       LEU  61  17.670  -5.424  -5.424
  454   1HD1  LEU  61          HD12      LEU  61  18.959  -3.968  -3.968
  455   2HD1  LEU  61          HD11      LEU  61  20.237  -5.185  -5.185
  456   3HD1  LEU  61          HD13      LEU  61  19.823  -4.326  -4.326
  457   1HD2  LEU  61          HD21      LEU  61  19.675  -7.549  -7.549
  458   2HD2  LEU  61          HD23      LEU  61  18.374  -7.685  -7.685
  459   3HD2  LEU  61          HD22      LEU  61  19.775  -6.670  -6.670
  460    H    ASP  62           HN       ASP  62  14.764  -6.344  -6.344
  461    HA   ASP  62           HA       ASP  62  15.245  -7.843  -7.843
  462   1HB   ASP  62           HB2      ASP  62  12.822  -6.456  -6.456
  463   2HB   ASP  62           HB1      ASP  62  12.848  -7.135  -7.135
  464    H    ASP  63           HN       ASP  63  13.021  -8.499  -8.499
  465    HA   ASP  63           HA       ASP  63  12.285 -11.045 -11.045
  466   1HB   ASP  63           HB2      ASP  63  10.658  -9.276  -9.276
  467   2HB   ASP  63           HB1      ASP  63  11.148  -9.856  -9.856
  468    H    SER  64           HN       SER  64  14.776 -10.237 -10.237
  469    HA   SER  64           HA       SER  64  16.201 -11.369 -11.369
  470   1HB   SER  64           HB2      SER  64  15.650 -13.217 -13.217
  471   2HB   SER  64           HB1      SER  64  14.329 -13.696 -13.696
  472    HG   SER  64           HG       SER  64  17.040 -13.462 -13.462
  473    H    ILE  67           HN       ILE  67  13.010 -12.862 -12.862
  474    HA   ILE  67           HA       ILE  67  13.259 -11.738 -11.738
  475    HB   ILE  67           HB       ILE  67  12.556 -14.540 -14.540
  476   1HG1  ILE  67          HG12      ILE  67  14.826 -13.451 -13.451
  477   2HG1  ILE  67          HG11      ILE  67  14.968 -13.876 -13.876
  478   1HG2  ILE  67          HG23      ILE  67  12.337 -13.136 -13.136
  479   2HG2  ILE  67          HG22      ILE  67  12.671 -14.866 -14.866
  480   3HG2  ILE  67          HG21      ILE  67  11.186 -14.229 -14.229
  481   1HD1  ILE  67          HD13      ILE  67  14.015 -16.173 -16.173
  482   2HD1  ILE  67          HD12      ILE  67  14.477 -15.675 -15.675
  483   3HD1  ILE  67          HD11      ILE  67  15.702 -15.816 -15.816
  484    H    CYS  68           HN       CYS  68  11.644 -10.130 -10.130
  485    HA   CYS  68           HA       CYS  68   8.867 -11.278 -11.278
  486   1HB   CYS  68           HB2      CYS  68   8.417  -9.049  -9.049
  487   2HB   CYS  68           HB1      CYS  68   9.239 -10.357 -10.357
  488    H    THR  69           HN       THR  69   7.222  -9.902  -9.902
  489    HA   THR  69           HA       THR  69   8.369  -7.952  -7.952
  490    HB   THR  69           HB       THR  69   7.945 -10.148 -10.148
  491    HG1  THR  69           HG1      THR  69   7.503  -8.632  -8.632
  492   1HG2  THR  69          HG23      THR  69   5.250  -9.783  -9.783
  493   2HG2  THR  69          HG22      THR  69   5.433 -10.801 -10.801
  494   3HG2  THR  69          HG21      THR  69   6.317 -11.184 -11.184
  495    H    GLY  70           HN       GLY  70   6.949  -6.193  -6.193
  496   1HA   GLY  70           HA2      GLY  70   4.281  -6.095  -6.095
  497   2HA   GLY  70           HA1      GLY  70   5.451  -4.976  -4.976
  498    H    THR  71           HN       THR  71   2.994  -4.440  -4.440
  499    HA   THR  71           HA       THR  71   4.188  -2.760  -2.760
  500    HB   THR  71           HB       THR  71   1.568  -4.200  -4.200
  501    HG1  THR  71           HG1      THR  71   2.673  -5.812  -5.812
  502   1HG2  THR  71          HG21      THR  71   1.549  -2.116  -2.116
  503   2HG2  THR  71          HG23      THR  71   2.952  -2.677  -2.677
  504   3HG2  THR  71          HG22      THR  71   1.410  -3.523  -3.523
  505    H    SER  72           HN       SER  72   2.904  -0.791  -0.791
  506    HA   SER  72           HA       SER  72   0.928  -0.074  -0.074
  507   1HB   SER  72           HB2      SER  72   3.207   0.505   0.505
  508   2HB   SER  72           HB1      SER  72   3.449   1.500   1.500
  509    HG   SER  72           HG       SER  72   2.010   1.992   1.992
  510    H    SER  73           HN       SER  73  -0.765   0.453   0.453
  511    HA   SER  73           HA       SER  73  -0.201   2.349   2.349
  512   1HB   SER  73           HB2      SER  73  -0.900   0.038   0.038
  513   2HB   SER  73           HB1      SER  73  -2.373   0.245   0.245
  514    HG   SER  73           HG       SER  73  -2.602   0.725   0.725
  515    H    GLY  74           HN       GLY  74  -1.115   4.338   4.338
  516   1HA   GLY  74           HA2      GLY  74  -2.544   5.997   5.997
  517   2HA   GLY  74           HA1      GLY  74  -3.795   4.751   4.751
  518    H    ASN  75           HN       ASN  75  -4.599   4.436   4.436
  519    HA   ASN  75           HA       ASN  75  -2.860   4.993   4.993
  520   1HB   ASN  75           HB2      ASN  75  -5.864   4.849   4.849
  521   2HB   ASN  75           HB1      ASN  75  -5.087   5.193   5.193
  522   1HD2  ASN  75          HD22      ASN  75  -5.729   8.244   8.244
  523   2HD2  ASN  75          HD21      ASN  75  -6.570   6.770   6.770
  524    H    GLN  76           HN       GLN  76  -3.220   2.376   2.376
  525    HA   GLN  76           HA       GLN  76  -4.007   0.556   0.556
  526   1HB   GLN  76           HB2      GLN  76  -3.991   0.175   0.175
  527   2HB   GLN  76           HB1      GLN  76  -4.545  -1.019  -1.019
  528   1HG   GLN  76           HG2      GLN  76  -6.255   0.624   0.624
  529   2HG   GLN  76           HG1      GLN  76  -5.757   1.710   1.710
  530   1HE2  GLN  76          HE22      GLN  76  -6.848  -0.999  -0.999
  531   2HE2  GLN  76          HE21      GLN  76  -5.323  -0.378  -0.378
  532    H    VAL  77           HN       VAL  77  -2.185  -0.475  -0.475
  533    HA   VAL  77           HA       VAL  77   0.157  -0.889  -0.889
  534    HB   VAL  77           HB       VAL  77   1.498  -0.842  -0.842
  535   1HG1  VAL  77          HG12      VAL  77  -0.742   1.114   1.114
  536   2HG1  VAL  77          HG11      VAL  77   0.689   1.143   1.143
  537   3HG1  VAL  77          HG13      VAL  77   0.842   1.383   1.383
  538   1HG2  VAL  77          HG23      VAL  77  -0.883  -1.792  -1.792
  539   2HG2  VAL  77          HG22      VAL  77   0.810  -2.191  -2.191
  540   3HG2  VAL  77          HG21      VAL  77   0.145  -0.691  -0.691
  541    H    ASN  78           HN       ASN  78   0.485  -2.930  -2.930
  542    HA   ASN  78           HA       ASN  78  -1.003  -5.183  -5.183
  543   1HB   ASN  78           HB2      ASN  78  -1.238  -4.460  -4.460
  544   2HB   ASN  78           HB1      ASN  78   0.416  -4.999  -4.999
  545    HD2  ASN  78          HD22      ASN  78  -2.301  -6.678  -6.678
  546    H    LEU  79           HN       LEU  79   0.301  -6.176  -6.176
  547    HA   LEU  79           HA       LEU  79   3.188  -6.680  -6.680
  548   1HB   LEU  79           HB2      LEU  79   1.529  -6.666  -6.666
  549   2HB   LEU  79           HB1      LEU  79   3.176  -7.289  -7.289
  550    HG   LEU  79           HG       LEU  79   2.456  -4.500  -4.500
  551   1HD1  LEU  79          HD11      LEU  79   2.796  -5.592  -5.592
  552   2HD1  LEU  79          HD13      LEU  79   3.800  -4.183  -4.183
  553   3HD1  LEU  79          HD12      LEU  79   2.048  -4.085  -4.085
  554   1HD2  LEU  79          HD23      LEU  79   5.019  -6.004  -6.004
  555   2HD2  LEU  79          HD22      LEU  79   4.565  -5.186  -5.186
  556   3HD2  LEU  79          HD21      LEU  79   4.971  -4.240  -4.240
  557    H    THR  80           HN       THR  80   3.906  -8.839  -8.839
  558    HA   THR  80           HA       THR  80   1.953 -11.013 -11.013
  559    HB   THR  80           HB       THR  80   3.476 -10.630 -10.630
  560    HG1  THR  80           HG1      THR  80   0.849 -10.032 -10.032
  561   1HG2  THR  80          HG22      THR  80   1.580 -12.730 -12.730
  562   2HG2  THR  80          HG21      THR  80   1.811 -12.460 -12.460
  563   3HG2  THR  80          HG23      THR  80   3.176 -12.945 -12.945
  564    H    ILE  81           HN       ILE  81   2.920 -13.051 -13.051
  565    HA   ILE  81           HA       ILE  81   5.902 -13.042 -13.042
  566    HB   ILE  81           HB       ILE  81   3.624 -14.408 -14.408
  567   1HG1  ILE  81          HG12      ILE  81   5.578 -12.421 -12.421
  568   2HG1  ILE  81          HG11      ILE  81   4.115 -11.879 -11.879
  569   1HG2  ILE  81          HG22      ILE  81   6.619 -14.506 -14.506
  570   2HG2  ILE  81          HG21      ILE  81   5.404 -15.147 -15.147
  571   3HG2  ILE  81          HG23      ILE  81   5.596 -15.858 -15.858
  572   1HD1  ILE  81          HD12      ILE  81   2.790 -13.402 -13.402
  573   2HD1  ILE  81          HD11      ILE  81   4.275 -13.690 -13.690
  574   3HD1  ILE  81          HD13      ILE  81   3.587 -12.067 -12.067
  575    H    GLN  82           HN       GLN  82   7.005 -14.838 -14.838
  576    HA   GLN  82           HA       GLN  82   5.293 -16.933 -16.933
  577   1HB   GLN  82           HB2      GLN  82   8.006 -15.805 -15.805
  578   2HB   GLN  82           HB1      GLN  82   7.281 -17.225 -17.225
  579   1HG   GLN  82           HG2      GLN  82   5.698 -16.007 -16.007
  580   2HG   GLN  82           HG1      GLN  82   5.609 -14.762 -14.762
  581   1HE2  GLN  82          HE22      GLN  82   7.441 -13.464 -13.464
  582   2HE2  GLN  82          HE21      GLN  82   5.940 -14.232 -14.232
  583    H    GLY  83           HN       GLY  83   5.456 -18.830 -18.830
  584   1HA   GLY  83           HA2      GLY  83   6.858 -20.764 -20.764
  585   2HA   GLY  83           HA1      GLY  83   8.051 -19.622 -19.622
  586    H    LEU  84           HN       LEU  84   4.521 -19.966 -19.966
  587    HA   LEU  84           HA       LEU  84   4.930 -19.550 -19.550
  588   1HB   LEU  84           HB2      LEU  84   2.509 -19.622 -19.622
  589   2HB   LEU  84           HB1      LEU  84   2.440 -19.268 -19.268
  590    HG   LEU  84           HG       LEU  84   4.184 -17.711 -17.711
  591   1HD1  LEU  84          HD13      LEU  84   1.354 -17.161 -17.161
  592   2HD1  LEU  84          HD12      LEU  84   2.384 -15.968 -15.968
  593   3HD1  LEU  84          HD11      LEU  84   1.884 -17.417 -17.417
  594   1HD2  LEU  84          HD21      LEU  84   3.451 -17.597 -17.597
  595   2HD2  LEU  84          HD23      LEU  84   4.972 -17.181 -17.181
  596   3HD2  LEU  84          HD22      LEU  84   3.613 -16.057 -16.057
  597    H    ARG  85           HN       ARG  85   5.150 -21.354 -21.354
  598    HA   ARG  85           HA       ARG  85   3.846 -23.904 -23.904
  599   1HB   ARG  85           HB2      ARG  85   5.990 -23.244 -23.244
  600   2HB   ARG  85           HB1      ARG  85   5.439 -24.872 -24.872
  601   1HG   ARG  85           HG2      ARG  85   6.029 -24.168 -24.168
  602   2HG   ARG  85           HG1      ARG  85   7.039 -22.958 -22.958
  603   1HD   ARG  85           HD2      ARG  85   7.169 -25.940 -25.940
  604   2HD   ARG  85           HD1      ARG  85   8.305 -25.063 -25.063
  605    HE   ARG  85           HE       ARG  85   8.269 -23.572 -23.572
  606   1HH1  ARG  85          HH21      ARG  85   8.892 -26.929 -26.929
  607   2HH1  ARG  85          HH22      ARG  85   9.985 -27.131 -27.131
  608   1HH2  ARG  85          HH11      ARG  85   9.689 -23.880 -23.880
  609   2HH2  ARG  85          HH12      ARG  85  10.433 -25.425 -25.425
  610    H    ALA  86           HN       ALA  86   3.212 -25.198 -25.198
  611    HA   ALA  86           HA       ALA  86   0.963 -23.888 -23.888
  612   1HB   ALA  86           HB3      ALA  86   2.691 -26.231 -26.231
  613   2HB   ALA  86           HB2      ALA  86   1.185 -25.809 -25.809
  614   3HB   ALA  86           HB1      ALA  86   1.166 -26.292 -26.292
  615    H    MET  87           HN       MET  87   4.278 -24.343 -24.343
  616    HA   MET  87           HA       MET  87   3.956 -23.122 -23.122
  617   1HB   MET  87           HB2      MET  87   5.858 -24.534 -24.534
  618   2HB   MET  87           HB1      MET  87   6.369 -23.220 -23.220
  619   1HG   MET  87           HG2      MET  87   6.593 -21.741 -21.741
  620   2HG   MET  87           HG1      MET  87   6.185 -23.113 -23.113
  621   1HE   MET  87           HE2      MET  87   8.042 -22.517 -22.517
  622   2HE   MET  87           HE1      MET  87   9.669 -23.154 -23.154
  623   3HE   MET  87           HE3      MET  87   9.236 -21.571 -21.571
  624    H    ASP  88           HN       ASP  88   4.771 -21.767 -21.767
  625    HA   ASP  88           HA       ASP  88   5.390 -19.097 -19.097
  626   1HB   ASP  88           HB2      ASP  88   4.366 -20.214 -20.214
  627   2HB   ASP  88           HB1      ASP  88   5.030 -18.595 -18.595
  628    H    THR  89           HN       THR  89   2.345 -20.722 -20.722
  629    HA   THR  89           HA       THR  89   0.589 -18.643 -18.643
  630    HB   THR  89           HB       THR  89   0.103 -20.931 -20.931
  631    HG1  THR  89           HG1      THR  89   0.156 -20.813 -20.813
  632   1HG2  THR  89          HG23      THR  89  -1.652 -19.093 -19.093
  633   2HG2  THR  89          HG22      THR  89  -1.771 -19.792 -19.792
  634   3HG2  THR  89          HG21      THR  89  -2.156 -20.770 -20.770
  635    H    GLY  90           HN       GLY  90  -0.212 -16.966 -16.966
  636   1HA   GLY  90           HA2      GLY  90  -0.686 -16.855 -16.855
  637   2HA   GLY  90           HA1      GLY  90   0.966 -16.288 -16.288
  638    H    LEU  91           HN       LEU  91   0.431 -14.146 -14.146
  639    HA   LEU  91           HA       LEU  91  -1.468 -12.647 -12.647
  640   1HB   LEU  91           HB2      LEU  91  -1.812 -12.718 -12.718
  641   2HB   LEU  91           HB1      LEU  91  -0.218 -11.997 -11.997
  642    HG   LEU  91           HG       LEU  91  -1.099 -10.129 -10.129
  643   1HD1  LEU  91          HD13      LEU  91  -3.182 -11.560 -11.560
  644   2HD1  LEU  91          HD12      LEU  91  -3.745 -11.047 -11.047
  645   3HD1  LEU  91          HD11      LEU  91  -3.433  -9.846  -9.846
  646   1HD2  LEU  91          HD23      LEU  91  -2.104 -10.490 -10.490
  647   2HD2  LEU  91          HD22      LEU  91  -0.583  -9.746  -9.746
  648   3HD2  LEU  91          HD21      LEU  91  -2.119  -8.961  -8.961
  649    H    TYR  92           HN       TYR  92  -0.731 -11.063 -11.063
  650    HA   TYR  92           HA       TYR  92   2.128 -10.197 -10.197
  651   1HB   TYR  92           HB2      TYR  92   0.274 -10.614 -10.614
  652   2HB   TYR  92           HB1      TYR  92   1.819  -9.771  -9.771
  653    HD1  TYR  92           HD1      TYR  92   0.215 -13.020 -13.020
  654    HD2  TYR  92           HD2      TYR  92   3.919 -10.952 -10.952
  655    HE1  TYR  92           HE1      TYR  92   1.410 -15.213 -15.213
  656    HE2  TYR  92           HE2      TYR  92   5.117 -13.142 -13.142
  657    HH   TYR  92           HH       TYR  92   4.072 -15.787 -15.787
  658    H    ILE  93           HN       ILE  93   2.477  -7.921  -7.921
  659    HA   ILE  93           HA       ILE  93  -0.008  -6.286  -6.286
  660    HB   ILE  93           HB       ILE  93   2.804  -5.905  -5.905
  661   1HG1  ILE  93          HG12      ILE  93   1.413  -6.147  -6.147
  662   2HG1  ILE  93          HG11      ILE  93   0.247  -6.950  -6.950
  663   1HG2  ILE  93          HG21      ILE  93   0.544  -4.060  -4.060
  664   2HG2  ILE  93          HG23      ILE  93   1.077  -4.252  -4.252
  665   3HG2  ILE  93          HG22      ILE  93   2.219  -3.727  -3.727
  666   1HD1  ILE  93          HD12      ILE  93   2.897  -7.947  -7.947
  667   2HD1  ILE  93          HD11      ILE  93   2.549  -8.079  -8.079
  668   3HD1  ILE  93          HD13      ILE  93   1.474  -8.829  -8.829
  669    H    CYS  94           HN       CYS  94  -0.397  -4.712  -4.712
  670    HA   CYS  94           HA       CYS  94   1.708  -4.065  -4.065
  671   1HB   CYS  94           HB2      CYS  94  -0.181  -3.043  -3.043
  672   2HB   CYS  94           HB1      CYS  94  -0.658  -4.648  -4.648
  673    H    LYS  95           HN       LYS  95   2.949  -2.259  -2.259
  674    HA   LYS  95           HA       LYS  95   1.893  -0.161  -0.161
  675   1HB   LYS  95           HB2      LYS  95   3.783  -1.556  -1.556
  676   2HB   LYS  95           HB1      LYS  95   4.713  -1.076  -1.076
  677   1HG   LYS  95           HG2      LYS  95   5.384   0.803   0.803
  678   2HG   LYS  95           HG1      LYS  95   3.707   1.296   1.296
  679   1HD   LYS  95           HD2      LYS  95   3.569  -0.076  -0.076
  680   2HD   LYS  95           HD1      LYS  95   5.230  -0.618  -0.618
  681   1HE   LYS  95           HE2      LYS  95   6.014   1.746   1.746
  682   2HE   LYS  95           HE1      LYS  95   4.345   2.245   2.245
  683   1HZ   LYS  95           HZ2      LYS  95   5.847   0.185   0.185
  684   2HZ   LYS  95           HZ1      LYS  95   5.612   1.787   1.787
  685   3HZ   LYS  95           HZ3      LYS  95   4.281   0.750   0.750
  686    H    VAL  96           HN       VAL  96   1.914   1.967   1.967
  687    HA   VAL  96           HA       VAL  96   3.270   2.427   2.427
  688    HB   VAL  96           HB       VAL  96   0.535   3.486   3.486
  689   1HG1  VAL  96          HG11      VAL  96   2.222   4.181   4.181
  690   2HG1  VAL  96          HG13      VAL  96   1.269   2.918   2.918
  691   3HG1  VAL  96          HG12      VAL  96   0.468   4.326   4.326
  692   1HG2  VAL  96          HG22      VAL  96   1.245   0.856   0.856
  693   2HG2  VAL  96          HG21      VAL  96   0.169   1.139   1.139
  694   3HG2  VAL  96          HG23      VAL  96  -0.321   1.631   1.631
  695    H    GLU  97           HN       GLU  97   4.781   4.011   4.011
  696    HA   GLU  97           HA       GLU  97   3.842   6.366   6.366
  697   1HB   GLU  97           HB2      GLU  97   6.396   4.759   4.759
  698   2HB   GLU  97           HB1      GLU  97   6.085   6.267   6.267
  699   1HG   GLU  97           HG2      GLU  97   4.101   5.230   5.230
  700   2HG   GLU  97           HG1      GLU  97   4.400   3.737   3.737
  701    H    LEU  98           HN       LEU  98   4.212   8.219   8.219
  702    HA   LEU  98           HA       LEU  98   6.091   8.337   8.337
  703   1HB   LEU  98           HB2      LEU  98   4.289  10.233  10.233
  704   2HB   LEU  98           HB1      LEU  98   5.368  10.830  10.830
  705    HG   LEU  98           HG       LEU  98   4.363   9.045   9.045
  706   1HD1  LEU  98          HD11      LEU  98   2.644   8.826   8.826
  707   2HD1  LEU  98          HD13      LEU  98   1.939   8.519   8.519
  708   3HD1  LEU  98          HD12      LEU  98   3.307   7.553   7.553
  709   1HD2  LEU  98          HD23      LEU  98   3.777  11.491  11.491
  710   2HD2  LEU  98          HD22      LEU  98   2.463  10.437  10.437
  711   3HD2  LEU  98          HD21      LEU  98   2.437  11.148  11.148
  712    H    MET  99           HN       MET  99   7.913   7.613   7.613
  713    HA   MET  99           HA       MET  99   8.750   9.065   9.065
  714   1HB   MET  99           HB2      MET  99   9.097   6.629   6.629
  715   2HB   MET  99           HB1      MET  99  10.351   7.158   7.158
  716   1HG   MET  99           HG2      MET  99  11.256   6.541   6.541
  717   2HG   MET  99           HG1      MET  99  11.597   8.210   8.210
  718   1HE   MET  99           HE3      MET  99   9.431   5.779   5.779
  719   2HE   MET  99           HE2      MET  99   8.271   6.825   6.825
  720   3HE   MET  99           HE1      MET  99   8.180   6.612   6.612
  721    H    TYR 100           HN       TYR 100  10.208   8.755   8.755
  722    HA   TYR 100           HA       TYR 100  12.293  10.688  10.688
  723   1HB   TYR 100           HB2      TYR 100  11.112   9.435   9.435
  724   2HB   TYR 100           HB1      TYR 100  12.518  10.504  10.504
  725    HD1  TYR 100           HD2      TYR 100  11.214   7.238   7.238
  726    HD2  TYR 100           HD1      TYR 100  14.666   9.847   9.847
  727    HE1  TYR 100           HE2      TYR 100  12.703   5.335   5.335
  728    HE2  TYR 100           HE1      TYR 100  16.150   7.945   7.945
  729    HH   TYR 100           HH       TYR 100  14.969   5.007   5.007
  730    HA   PRO 101           HA       PRO 101   9.556  13.831  13.831
  731   1HB   PRO 101           HB2      PRO 101   6.894  13.386  13.386
  732   2HB   PRO 101           HB1      PRO 101   8.140  13.006  13.006
  733   1HG   PRO 101           HG2      PRO 101   6.580  11.189  11.189
  734   2HG   PRO 101           HG1      PRO 101   7.519  10.873  10.873
  735   1HD   PRO 101           HD2      PRO 101   8.274  10.321  10.321
  736   2HD   PRO 101           HD1      PRO 101   9.173   9.978   9.978
  737    HA   PRO 102           HA       PRO 102   8.072  14.951  14.951
  738   1HB   PRO 102           HB2      PRO 102   9.078  17.520  17.520
  739   2HB   PRO 102           HB1      PRO 102   9.988  16.074  16.074
  740   1HG   PRO 102           HG2      PRO 102  10.352  17.706  17.706
  741   2HG   PRO 102           HG1      PRO 102  11.416  16.526  16.526
  742   1HD   PRO 102           HD2      PRO 102   9.795  16.207  16.207
  743   2HD   PRO 102           HD1      PRO 102  10.888  15.053  15.053
  744    HA   PRO 103           HA       PRO 103   7.269  16.035  16.035
  745   1HB   PRO 103           HB2      PRO 103   5.589  16.375  16.375
  746   2HB   PRO 103           HB1      PRO 103   6.930  17.483  17.483
  747   1HG   PRO 103           HG2      PRO 103   4.291  18.118  18.118
  748   2HG   PRO 103           HG1      PRO 103   5.595  18.743  18.743
  749   1HD   PRO 103           HD2      PRO 103   3.979  16.259  16.259
  750   2HD   PRO 103           HD1      PRO 103   3.915  17.831  17.831
  751    H    TYR 104           HN       TYR 104   6.898  14.278  14.278
  752    HA   TYR 104           HA       TYR 104   5.597  12.121  12.121
  753   1HB   TYR 104           HB2      TYR 104   7.655  11.808  11.808
  754   2HB   TYR 104           HB1      TYR 104   6.938  12.486  12.486
  755    HD1  TYR 104           HD1      TYR 104   5.255  10.127  10.127
  756    HD2  TYR 104           HD2      TYR 104   7.283  10.671  10.671
  757    HE1  TYR 104           HE1      TYR 104   4.527   7.840   7.840
  758    HE2  TYR 104           HE2      TYR 104   6.561   8.387   8.387
  759    HH   TYR 104           HH       TYR 104   5.775   6.288   6.288
  760    H    TYR 105           HN       TYR 105   3.459  11.541  11.541
  761    HA   TYR 105           HA       TYR 105   2.036  11.625  11.625
  762   1HB   TYR 105           HB2      TYR 105   1.934  13.870  13.870
  763   2HB   TYR 105           HB1      TYR 105   1.183  13.147  13.147
  764    HD1  TYR 105           HD1      TYR 105  -1.026  12.136  12.136
  765    HD2  TYR 105           HD2      TYR 105   0.696  14.176  14.176
  766    HE1  TYR 105           HE1      TYR 105  -3.284  12.225  12.225
  767    HE2  TYR 105           HE2      TYR 105  -1.548  14.268  14.268
  768    HH   TYR 105           HH       TYR 105  -4.166  14.184  14.184
  769    H    LEU 106           HN       LEU 106   1.397   9.419   9.419
  770    HA   LEU 106           HA       LEU 106  -0.588   8.822   8.822
  771   1HB   LEU 106           HB2      LEU 106   2.011   8.423   8.423
  772   2HB   LEU 106           HB1      LEU 106   1.621   6.842   6.842
  773    HG   LEU 106           HG       LEU 106  -0.487   6.890   6.890
  774   1HD1  LEU 106          HD12      LEU 106   0.889   9.380   9.380
  775   2HD1  LEU 106          HD11      LEU 106   0.099   8.411   8.411
  776   3HD1  LEU 106          HD13      LEU 106  -0.829   9.020   9.020
  777   1HD2  LEU 106          HD22      LEU 106   2.314   6.522   6.522
  778   2HD2  LEU 106          HD21      LEU 106   0.972   5.385   5.385
  779   3HD2  LEU 106          HD23      LEU 106   1.041   6.584   6.584
  780    H    GLY 108           HN       GLY 108  -0.060   5.836   5.836
  781   1HA   GLY 108           HA2      GLY 108  -0.427   5.481   5.481
  782   2HA   GLY 108           HA1      GLY 108  -1.937   5.298   5.298
  783    H    ILE 109           HN       ILE 109  -1.206   3.110   3.110
  784    HA   ILE 109           HA       ILE 109   0.086   1.315   1.315
  785    HB   ILE 109           HB       ILE 109   0.122   1.402   1.402
  786   1HG1  ILE 109          HG12      ILE 109   2.635   1.364   1.364
  787   2HG1  ILE 109          HG11      ILE 109   2.202   1.744   1.744
  788   1HG2  ILE 109          HG21      ILE 109   1.142  -0.751  -0.751
  789   2HG2  ILE 109          HG23      ILE 109   1.612  -0.615  -0.615
  790   3HG2  ILE 109          HG22      ILE 109  -0.071  -0.922  -0.922
  791   1HD1  ILE 109          HD12      ILE 109   0.822   3.439   3.439
  792   2HD1  ILE 109          HD11      ILE 109   2.578   3.578   3.578
  793   3HD1  ILE 109          HD13      ILE 109   1.760   3.891   3.891
  794    H    GLY 110           HN       GLY 110  -0.708  -1.021  -1.021
  795   1HA   GLY 110           HA2      GLY 110  -3.611  -1.057  -1.057
  796   2HA   GLY 110           HA1      GLY 110  -2.904  -2.088  -2.088
  797    H    ASN 111           HN       ASN 111  -4.277  -2.778  -2.778
  798    HA   ASN 111           HA       ASN 111  -2.340  -3.727  -3.727
  799   1HB   ASN 111           HB2      ASN 111  -5.169  -4.495  -4.495
  800   2HB   ASN 111           HB1      ASN 111  -4.282  -5.405  -5.405
  801    HD2  ASN 111          HD22      ASN 111  -3.430  -2.205  -2.205
  802    H    GLY 112           HN       GLY 112  -3.732  -5.299  -5.299
  803   1HA   GLY 112           HA2      GLY 112  -1.816  -6.715  -6.715
  804   2HA   GLY 112           HA1      GLY 112  -1.894  -7.604  -7.604
  805    H    THR 113           HN       THR 113  -2.234  -8.841  -8.841
  806    HA   THR 113           HA       THR 113  -5.153  -9.582  -9.582
  807    HB   THR 113           HB       THR 113  -3.056  -9.573  -9.573
  808    HG1  THR 113           HG1      THR 113  -3.725  -7.635  -7.635
  809   1HG2  THR 113          HG23      THR 113  -5.939 -10.483 -10.483
  810   2HG2  THR 113          HG22      THR 113  -5.108 -10.075 -10.075
  811   3HG2  THR 113          HG21      THR 113  -4.517 -11.411 -11.411
  812    H    GLN 114           HN       GLN 114  -5.458 -11.795 -11.795
  813    HA   GLN 114           HA       GLN 114  -3.118 -13.468 -13.468
  814   1HB   GLN 114           HB2      GLN 114  -5.442 -13.514 -13.514
  815   2HB   GLN 114           HB1      GLN 114  -6.016 -14.330 -14.330
  816   1HG   GLN 114           HG2      GLN 114  -5.453 -16.114 -16.114
  817   2HG   GLN 114           HG1      GLN 114  -4.026 -15.950 -15.950
  818   1HE2  GLN 114          HE22      GLN 114  -2.293 -15.955 -15.955
  819   2HE2  GLN 114          HE21      GLN 114  -2.727 -16.908 -16.908
  820    H    ILE 115           HN       ILE 115  -2.252 -15.042 -15.042
  821    HA   ILE 115           HA       ILE 115  -3.558 -15.096 -15.096
  822    HB   ILE 115           HB       ILE 115  -0.643 -15.264 -15.264
  823   1HG1  ILE 115          HG12      ILE 115  -2.160 -13.374 -13.374
  824   2HG1  ILE 115          HG11      ILE 115  -1.648 -13.005 -13.005
  825   1HG2  ILE 115          HG21      ILE 115  -1.859 -15.722 -15.722
  826   2HG2  ILE 115          HG23      ILE 115  -0.135 -15.509 -15.509
  827   3HG2  ILE 115          HG22      ILE 115  -0.984 -16.909 -16.909
  828   1HD1  ILE 115          HD11      ILE 115   0.720 -13.805 -13.805
  829   2HD1  ILE 115          HD13      ILE 115  -0.045 -13.152 -13.152
  830   3HD1  ILE 115          HD12      ILE 115   0.176 -12.126 -12.126
  831    H    TYR 116           HN       TYR 116  -4.395 -17.093 -17.093
  832    HA   TYR 116           HA       TYR 116  -3.509 -19.492 -19.492
  833   1HB   TYR 116           HB2      TYR 116  -5.971 -18.759 -18.759
  834   2HB   TYR 116           HB1      TYR 116  -5.682 -20.402 -20.402
  835    HD1  TYR 116           HD1      TYR 116  -4.668 -20.247 -20.247
  836    HD2  TYR 116           HD2      TYR 116  -7.582 -17.631 -17.631
  837    HE1  TYR 116           HE1      TYR 116  -5.608 -19.663 -19.663
  838    HE2  TYR 116           HE2      TYR 116  -8.499 -17.043 -17.043
  839    HH   TYR 116           HH       TYR 116  -6.952 -17.548 -17.548
  840    H    VAL 117           HN       VAL 117  -2.603 -21.258 -21.258
  841    HA   VAL 117           HA       VAL 117  -2.211 -20.880 -20.880
  842    HB   VAL 117           HB       VAL 117  -0.614 -22.441 -22.441
  843   1HG1  VAL 117          HG11      VAL 117  -0.547 -22.308 -22.308
  844   2HG1  VAL 117          HG13      VAL 117   1.000 -22.352 -22.352
  845   3HG1  VAL 117          HG12      VAL 117  -0.168 -23.656 -23.656
  846   1HG2  VAL 117          HG23      VAL 117  -0.429 -19.939 -19.939
  847   2HG2  VAL 117          HG22      VAL 117   1.083 -20.729 -20.729
  848   3HG2  VAL 117          HG21      VAL 117   0.092 -19.960 -19.960
  849    H    ILE 118           HN       ILE 118  -2.340 -22.760 -22.760
  850    HA   ILE 118           HA       ILE 118  -4.342 -24.745 -24.745
  851    HB   ILE 118           HB       ILE 118  -3.307 -23.821 -23.821
  852   1HG1  ILE 118          HG12      ILE 118  -4.544 -22.055 -22.055
  853   2HG1  ILE 118          HG11      ILE 118  -5.536 -22.711 -22.711
  854   1HG2  ILE 118          HG21      ILE 118  -5.374 -25.854 -25.854
  855   2HG2  ILE 118          HG23      ILE 118  -5.581 -24.940 -24.940
  856   3HG2  ILE 118          HG22      ILE 118  -4.151 -25.946 -25.946
  857   1HD1  ILE 118          HD12      ILE 118  -6.164 -24.307 -24.307
  858   2HD1  ILE 118          HD11      ILE 118  -6.026 -22.688 -22.688
  859   3HD1  ILE 118          HD13      ILE 118  -7.150 -22.992 -22.992
  860    H    ASP 119           HN       ASP 119  -3.816 -26.951 -26.951
  861    HA   ASP 119           HA       ASP 119  -1.043 -27.688 -27.688
  862   1HB   ASP 119           HB2      ASP 119  -1.521 -27.758 -27.758
  863   2HB   ASP 119           HB1      ASP 119  -2.823 -28.905 -28.905
  864    HA   PRO 120           HA       PRO 120  -3.847 -30.015 -30.015
  865   1HB   PRO 120           HB2      PRO 120  -1.998 -30.396 -30.396
  866   2HB   PRO 120           HB1      PRO 120  -2.968 -28.917 -28.917
  867   1HG   PRO 120           HG2      PRO 120  -0.153 -29.425 -29.425
  868   2HG   PRO 120           HG1      PRO 120  -0.865 -27.989 -27.989
  869   1HD   PRO 120           HD2      PRO 120  -0.313 -28.145 -28.145
  870   2HD   PRO 120           HD1      PRO 120  -1.643 -27.164 -27.164
  871    H    GLU 121           HN       GLU 121  -3.952 -32.270 -32.270
  872    HA   GLU 121           HA       GLU 121  -1.599 -33.885 -33.885
  873   1HB   GLU 121           HB2      GLU 121  -4.552 -34.193 -34.193
  874   2HB   GLU 121           HB1      GLU 121  -3.307 -35.352 -35.352
  875   1HG   GLU 121           HG2      GLU 121  -2.157 -33.643 -33.643
  876   2HG   GLU 121           HG1      GLU 121  -3.321 -32.426 -32.426
  877    HA   PRO 122           HA       PRO 122  -2.222 -36.170 -36.170
  878   1HB   PRO 122           HB2      PRO 122  -1.512 -38.706 -38.706
  879   2HB   PRO 122           HB1      PRO 122  -0.334 -37.407 -37.407
  880   1HG   PRO 122           HG2      PRO 122  -1.475 -38.407 -38.407
  881   2HG   PRO 122           HG1      PRO 122   0.191 -37.945 -37.945
  882   1HD   PRO 122           HD2      PRO 122  -1.479 -36.315 -36.315
  883   2HD   PRO 122           HD1      PRO 122  -0.229 -35.694 -35.694
  884    H    CYS 123           HN       CYS 123  -3.899 -37.077 -37.077
  885    HA   CYS 123           HA       CYS 123  -5.674 -39.029 -39.029
  886   1HB   CYS 123           HB2      CYS 123  -5.653 -37.637 -37.637
  887   2HB   CYS 123           HB1      CYS 123  -6.750 -38.949 -38.949
  888    HG   CYS 123           HG       CYS 123  -4.585 -40.478 -40.478
  889    HA   PRO 124           HA       PRO 124  -8.577 -36.028 -36.028
  890   1HB   PRO 124           HB2      PRO 124 -10.879 -37.521 -37.521
  891   2HB   PRO 124           HB1      PRO 124  -9.614 -37.702 -37.702
  892   1HG   PRO 124           HG2      PRO 124 -10.134 -39.347 -39.347
  893   2HG   PRO 124           HG1      PRO 124  -9.677 -39.861 -39.861
  894   1HD   PRO 124           HD2      PRO 124  -7.899 -39.727 -39.727
  895   2HD   PRO 124           HD1      PRO 124  -7.444 -39.419 -39.419
  896    H    ASP 125           HN       ASP 125  -9.006 -37.668 -37.668
  897    HA   ASP 125           HA       ASP 125 -10.351 -35.264 -35.264
  898   1HB   ASP 125           HB2      ASP 125 -12.058 -36.903 -36.903
  899   2HB   ASP 125           HB1      ASP 125 -11.517 -38.049 -38.049
  900    H    SER 126           HN       SER 126 -10.068 -35.108 -35.108
  901    HA   SER 126           HA       SER 126  -8.728 -37.327 -37.327
  902   1HB   SER 126           HB2      SER 126  -6.799 -35.901 -35.901
  903   2HB   SER 126           HB1      SER 126  -6.963 -36.047 -36.047
  904    HG   SER 126           HG       SER 126  -6.703 -33.894 -33.894
  905    H    ASP 127           HN       ASP 127  -8.687 -36.930 -36.930
  906    HA   ASP 127           HA       ASP 127 -10.293 -34.593 -34.593
  907   1HB   ASP 127           HB2      ASP 127 -11.747 -36.586 -36.586
  908   2HB   ASP 127           HB1      ASP 127 -10.738 -37.508 -37.508
  909    H    GLN 128           HN       GLN 128  -8.131 -33.875 -33.875
  910    HA   GLN 128           HA       GLN 128  -7.382 -35.208 -35.208
  911   1HB   GLN 128           HB2      GLN 128  -5.564 -34.300 -34.300
  912   2HB   GLN 128           HB1      GLN 128  -4.994 -34.850 -34.850
  913   1HG   GLN 128           HG2      GLN 128  -6.019 -37.040 -37.040
  914   2HG   GLN 128           HG1      GLN 128  -6.699 -36.500 -36.500
  915   1HE2  GLN 128          HE22      GLN 128  -3.808 -37.629 -37.629
  916   2HE2  GLN 128          HE21      GLN 128  -5.504 -37.580 -37.580
  917    H    GLU 129           HN       GLU 129  -6.758 -33.749 -33.749
  918    HA   GLU 129           HA       GLU 129  -6.672 -31.674 -31.674
  919   1HB   GLU 129           HB2      GLU 129  -5.419 -31.021 -31.021
  920   2HB   GLU 129           HB1      GLU 129  -5.290 -29.997 -29.997
  921   1HG   GLU 129           HG2      GLU 129  -4.183 -31.794 -31.794
  922   2HG   GLU 129           HG1      GLU 129  -4.385 -32.889 -32.889
  923    HA   PRO 130           HA       PRO 130 -10.236 -30.057 -30.057
  924   1HB   PRO 130           HB2      PRO 130 -12.351 -30.947 -30.947
  925   2HB   PRO 130           HB1      PRO 130 -11.656 -31.877 -31.877
  926   1HG   PRO 130           HG2      PRO 130 -11.223 -32.177 -32.177
  927   2HG   PRO 130           HG1      PRO 130 -11.413 -33.422 -33.422
  928   1HD   PRO 130           HD2      PRO 130  -9.001 -32.718 -32.718
  929   2HD   PRO 130           HD1      PRO 130  -9.212 -33.305 -33.305
  930    H    LYS 131           HN       LYS 131 -11.367 -28.134 -28.134
  931    HA   LYS 131           HA       LYS 131 -10.556 -26.959 -26.959
  932   1HB   LYS 131           HB2      LYS 131 -11.912 -25.878 -25.878
  933   2HB   LYS 131           HB1      LYS 131 -11.430 -24.888 -24.888
  934   1HG   LYS 131           HG2      LYS 131  -9.086 -25.571 -25.571
  935   2HG   LYS 131           HG1      LYS 131  -9.557 -26.585 -26.585
  936   1HD   LYS 131           HD2      LYS 131 -10.340 -24.628 -24.628
  937   2HD   LYS 131           HD1      LYS 131  -9.986 -23.587 -23.587
  938   1HE   LYS 131           HE2      LYS 131  -8.151 -23.441 -23.441
  939   2HE   LYS 131           HE1      LYS 131  -7.569 -24.267 -24.267
  940   1HZ   LYS 131           HZ3      LYS 131  -8.751 -25.723 -25.723
  941   2HZ   LYS 131           HZ2      LYS 131  -7.084 -25.422 -25.422
  942   3HZ   LYS 131           HZ1      LYS 131  -7.867 -26.365 -26.365
  943    H1   NAG 132           H1       NAG 132  -3.307  -5.107  -5.107
  944    H2   NAG 132           H2       NAG 132  -1.819  -2.813  -2.813
  945    H3   NAG 132           H3       NAG 132  -1.052  -5.807  -5.807
  946    H4   NAG 132           H4       NAG 132  -2.131  -4.328  -4.328
  947    H5   NAG 132           H5       NAG 132  -3.588  -6.381  -6.381
  948   1H6   NAG 132           H61      NAG 132  -5.536  -5.641  -5.641
  949   2H6   NAG 132           H62      NAG 132  -4.319  -6.599  -6.599
  950   1H8   NAG 132           H81      NAG 132   0.411  -1.018  -1.018
  951   2H8   NAG 132           H82      NAG 132   0.299  -2.613  -2.613
  952   3H8   NAG 132           H83      NAG 132  -1.190  -1.727  -1.727
  953    HN2  NAG 132           HN2      NAG 132  -0.996  -4.386  -4.386
  954    HO3  NAG 132           HO3      NAG 132  -0.035  -3.623  -3.623
  955    H1   NAG 133           H1       NAG 133  -2.336  -6.063  -6.063
  956    H2   NAG 133           H2       NAG 133   0.271  -7.580  -7.580
  957    H3   NAG 133           H3       NAG 133  -1.141  -7.220  -7.220
  958    H4   NAG 133           H4       NAG 133   1.497  -5.965  -5.965
  959    H5   NAG 133           H5       NAG 133  -1.224  -4.595  -4.595
  960   1H6   NAG 133           H61      NAG 133   1.554  -3.663  -3.663
  961   2H6   NAG 133           H62      NAG 133   0.316  -2.982  -2.982
  962   1H8   NAG 133           H81      NAG 133  -3.778  -8.485  -8.485
  963   2H8   NAG 133           H82      NAG 133  -3.179  -8.359  -8.359
  964   3H8   NAG 133           H83      NAG 133  -3.559  -9.962  -9.962
  965    HN2  NAG 133           HN2      NAG 133  -1.832  -9.028  -9.028
  966    HO3  NAG 133           HO3      NAG 133   0.186  -9.138  -9.138
  967    HO6  NAG 133           HO6      NAG 133   0.704  -1.860  -1.860
  968    H1   FUC 134           H1       FUC 134  -4.288  -4.305  -4.305
  969    H2   FUC 134           H2       FUC 134  -5.278  -6.743  -6.743
  970    H3   FUC 134           H3       FUC 134  -6.208  -5.096  -5.096
  971    H4   FUC 134           H4       FUC 134  -8.543  -5.811  -5.811
  972    H5   FUC 134           H5       FUC 134  -7.682  -3.614  -3.614
  973   1H6   FUC 134           H61      FUC 134  -8.735  -4.695  -4.695
  974   2H6   FUC 134           H62      FUC 134  -9.520  -3.609  -3.609
  975   3H6   FUC 134           H63      FUC 134  -9.672  -5.386  -5.386
  976    HO2  FUC 134           HO2      FUC 134  -3.603  -6.699  -6.699
  977    HO3  FUC 134           HO3      FUC 134  -5.337  -7.303  -7.303
  978    HO4  FUC 134           HO4      FUC 134  -7.980  -7.749  -7.749
  979    H1   MAN 135           H1       MAN 135   2.516  -6.593  -6.593
  980    H2   MAN 135           H2       MAN 135   2.929  -4.144  -4.144
  981    H3   MAN 135           H3       MAN 135   4.725  -5.508  -5.508
  982    H4   MAN 135           H4       MAN 135   3.364  -5.368  -5.368
  983    H5   MAN 135           H5       MAN 135   3.626  -7.761  -7.761
  984   1H6   MAN 135           H61      MAN 135   2.258  -7.417  -7.417
  985   2H6   MAN 135           H62      MAN 135   2.049  -8.807  -8.807
  986    HO2  MAN 135           HO2      MAN 135   1.552  -3.161  -3.161
  987    HO3  MAN 135           HO3      MAN 135   4.247  -3.453  -3.453
  988    HO4  MAN 135           HO4      MAN 135   5.104  -6.388  -6.388
  989    HO6  MAN 135           HO6      MAN 135   4.028  -9.502  -9.502
  990    H1   NAG 136           H1       NAG 136   0.333  -7.971  -7.971
  991    H2   NAG 136           H2       NAG 136  -2.205  -8.365  -8.365
  992    H3   NAG 136           H3       NAG 136   0.377 -10.044 -10.044
  993    H4   NAG 136           H4       NAG 136  -0.516  -8.139  -8.139
  994    H5   NAG 136           H5       NAG 136   1.671  -7.672  -7.672
  995   1H6   NAG 136           H61      NAG 136   1.813  -5.537  -5.537
  996   2H6   NAG 136           H62      NAG 136   1.993  -6.688  -6.688
  997   1H8   NAG 136           H81      NAG 136  -4.369  -9.405  -9.405
  998   2H8   NAG 136           H82      NAG 136  -4.697 -11.159 -11.159
  999   3H8   NAG 136           H83      NAG 136  -4.290 -10.218 -10.218
 1000    HN2  NAG 136           HN2      NAG 136  -1.444  -9.559  -9.559
 1001    HO3  NAG 136           HO3      NAG 136  -1.783 -10.093 -10.093
 1002    H1   NAG 137           H1       NAG 137   2.709  -8.265  -8.265
 1003    H2   NAG 137           H2       NAG 137   2.650 -11.288 -11.288
 1004    H3   NAG 137           H3       NAG 137   5.030  -9.640  -9.640
 1005    H4   NAG 137           H4       NAG 137   4.796 -10.975 -10.975
 1006    H5   NAG 137           H5       NAG 137   4.699  -7.981  -7.981
 1007   1H6   NAG 137           H61      NAG 137   4.550  -9.506  -9.506
 1008   2H6   NAG 137           H62      NAG 137   5.867  -8.449  -8.449
 1009   1H8   NAG 137           H81      NAG 137   2.045  -9.040  -9.040
 1010   2H8   NAG 137           H82      NAG 137   2.600 -10.738 -10.738
 1011   3H8   NAG 137           H83      NAG 137   3.775  -9.436  -9.436
 1012    HN2  NAG 137           HN2      NAG 137   2.057 -11.103 -11.103
 1013    HO3  NAG 137           HO3      NAG 137   5.459 -11.620 -11.620
 1014    HO6  NAG 137           HO6      NAG 137   4.302  -7.380  -7.380
 1015    H1   FUC 138           H1       FUC 138   0.106  -6.779  -6.779
 1016    H2   FUC 138           H2       FUC 138  -0.854  -4.468  -4.468
 1017    H3   FUC 138           H3       FUC 138  -1.244  -3.725  -3.725
 1018    H4   FUC 138           H4       FUC 138   0.491  -1.886  -1.886
 1019    H5   FUC 138           H5       FUC 138   1.714  -4.046  -4.046
 1020   1H6   FUC 138           H61      FUC 138   3.129  -3.580  -3.580
 1021   2H6   FUC 138           H62      FUC 138   3.713  -3.481  -3.481
 1022   3H6   FUC 138           H63      FUC 138   2.843  -2.096  -2.096
 1023    HO2  FUC 138           HO2      FUC 138  -2.116  -6.017  -6.017
 1024    HO3  FUC 138           HO3      FUC 138  -2.770  -3.302  -3.302
 1025    HO4  FUC 138           HO4      FUC 138   1.273  -1.875  -1.875
 1026    H1   MAN 139           H1       MAN 139   6.670 -11.586 -11.586
 1027    H2   MAN 139           H2       MAN 139   8.392  -9.930  -9.930
 1028    H3   MAN 139           H3       MAN 139   9.031 -12.242 -12.242
 1029    H4   MAN 139           H4       MAN 139  10.193 -12.204 -12.204
 1030    H5   MAN 139           H5       MAN 139   7.682 -13.651 -13.651
 1031   1H6   MAN 139           H61      MAN 139   7.331 -14.019 -14.019
 1032   2H6   MAN 139           H62      MAN 139   8.645 -14.951 -14.951
 1033    HO2  MAN 139           HO2      MAN 139   9.323 -10.242 -10.242
 1034    HO3  MAN 139           HO3      MAN 139  11.146 -10.742 -10.742
 1035    HO4  MAN 139           HO4      MAN 139  11.184 -13.842 -13.842
 1036    HO6  MAN 139           HO6      MAN 139   9.937 -14.048 -14.048

  Start of MODEL   14
    1   1H    ALA   1           HT1      ALA   1  -9.909   6.964   6.964
    2   2H    ALA   1           HT3      ALA   1 -11.243   7.834   7.834
    3   3H    ALA   1           HT2      ALA   1 -11.274   7.185   7.185
    4    HA   ALA   1           HA       ALA   1 -10.861   9.579   9.579
    5   1HB   ALA   1           HB2      ALA   1  -8.521   8.715   8.715
    6   2HB   ALA   1           HB1      ALA   1  -8.743  10.344  10.344
    7   3HB   ALA   1           HB3      ALA   1  -9.899   9.687   9.687
    8    H    MET   1           HN       MET   1  -7.882   7.596   7.596
    9    HA   MET   1           HA       MET   1  -6.851   8.463   8.463
   10   1HB   MET   1           HB2      MET   1  -6.344   5.992   5.992
   11   2HB   MET   1           HB1      MET   1  -5.314   6.514   6.514
   12   1HG   MET   1           HG2      MET   1  -5.952   8.195   8.195
   13   2HG   MET   1           HG1      MET   1  -4.460   7.282   7.282
   14   1HE   MET   1           HE1      MET   1  -2.740   7.633   7.633
   15   2HE   MET   1           HE3      MET   1  -3.741   7.588   7.588
   16   3HE   MET   1           HE2      MET   1  -2.601   8.907   8.907
   17    H    HIS   2           HN       HIS   2  -7.147   7.622   7.622
   18    HA   HIS   2           HA       HIS   2  -9.135   5.397   5.397
   19   1HB   HIS   2           HB2      HIS   2  -8.311   7.683   7.683
   20   2HB   HIS   2           HB1      HIS   2  -9.502   6.455   6.455
   21    HD1  HIS   2           HD1      HIS   2 -10.496   9.310   9.310
   22    HD2  HIS   2           HD2      HIS   2 -10.492   6.805   6.805
   23    HE1  HIS   2           HE1      HIS   2 -12.221  10.245  10.245
   24    H    VAL   3           HN       VAL   3  -8.439   3.518   3.518
   25    HA   VAL   3           HA       VAL   3  -6.122   3.489   3.489
   26    HB   VAL   3           HB       VAL   3  -6.332   1.933   1.933
   27   1HG1  VAL   3          HG13      VAL   3  -5.323   0.630   0.630
   28   2HG1  VAL   3          HG12      VAL   3  -4.127   1.910   1.910
   29   3HG1  VAL   3          HG11      VAL   3  -4.171   0.970   0.970
   30   1HG2  VAL   3          HG23      VAL   3  -4.600   4.223   4.223
   31   2HG2  VAL   3          HG22      VAL   3  -5.604   4.142   4.142
   32   3HG2  VAL   3          HG21      VAL   3  -4.122   3.191   3.191
   33    H    ALA   4           HN       ALA   4  -6.295   1.724   1.724
   34    HA   ALA   4           HA       ALA   4  -8.764   0.045   0.045
   35   1HB   ALA   4           HB3      ALA   4  -7.870   1.794   1.794
   36   2HB   ALA   4           HB2      ALA   4  -7.855   0.152   0.152
   37   3HB   ALA   4           HB1      ALA   4  -9.335   0.814   0.814
   38    H    GLN   5           HN       GLN   5  -8.294  -1.999  -1.999
   39    HA   GLN   5           HA       GLN   5  -6.106  -3.394  -3.394
   40   1HB   GLN   5           HB2      GLN   5  -6.534  -3.167  -3.167
   41   2HB   GLN   5           HB1      GLN   5  -5.597  -4.487  -4.487
   42   1HG   GLN   5           HG2      GLN   5  -4.883  -1.781  -1.781
   43   2HG   GLN   5           HG1      GLN   5  -4.523  -2.097  -2.097
   44   1HE2  GLN   5          HE22      GLN   5  -2.674  -4.506  -4.506
   45   2HE2  GLN   5          HE21      GLN   5  -4.225  -3.912  -3.912
   46    HA   PRO   6           HA       PRO   6  -9.369  -6.451  -6.451
   47   1HB   PRO   6           HB2      PRO   6  -7.876  -8.595  -8.595
   48   2HB   PRO   6           HB1      PRO   6  -8.335  -7.277  -7.277
   49   1HG   PRO   6           HG2      PRO   6  -5.752  -7.759  -7.759
   50   2HG   PRO   6           HG1      PRO   6  -6.052  -7.170  -7.170
   51   1HD   PRO   6           HD2      PRO   6  -5.367  -5.540  -5.540
   52   2HD   PRO   6           HD1      PRO   6  -6.360  -5.008  -5.008
   53    H    ALA   7           HN       ALA   7 -10.204  -7.846  -7.846
   54    HA   ALA   7           HA       ALA   7  -8.732  -8.281  -8.281
   55   1HB   ALA   7           HB2      ALA   7 -11.366  -9.204  -9.204
   56   2HB   ALA   7           HB1      ALA   7 -10.823  -9.764  -9.764
   57   3HB   ALA   7           HB3      ALA   7 -11.099  -8.045  -8.045
   58    H    VAL   8           HN       VAL   8  -9.302 -10.228 -10.228
   59    HA   VAL   8           HA       VAL   8  -7.300 -12.112 -12.112
   60    HB   VAL   8           HB       VAL   8  -9.698 -12.706 -12.706
   61   1HG1  VAL   8          HG11      VAL   8  -9.984 -12.957 -12.957
   62   2HG1  VAL   8          HG13      VAL   8 -10.556 -14.341 -14.341
   63   3HG1  VAL   8          HG12      VAL   8 -11.214 -12.719 -12.719
   64   1HG2  VAL   8          HG21      VAL   8  -7.473 -14.227 -14.227
   65   2HG2  VAL   8          HG23      VAL   8  -8.802 -14.717 -14.717
   66   3HG2  VAL   8          HG22      VAL   8  -8.826 -15.078 -15.078
   67    H    VAL   9           HN       VAL   9  -6.454 -13.463 -13.463
   68    HA   VAL   9           HA       VAL   9  -7.179 -12.811 -12.811
   69    HB   VAL   9           HB       VAL   9  -4.573 -12.405 -12.405
   70   1HG1  VAL   9          HG13      VAL   9  -4.926 -12.726 -12.726
   71   2HG1  VAL   9          HG12      VAL   9  -3.471 -12.100 -12.100
   72   3HG1  VAL   9          HG11      VAL   9  -3.966 -13.772 -13.772
   73   1HG2  VAL   9          HG23      VAL   9  -6.330 -10.599 -10.599
   74   2HG2  VAL   9          HG22      VAL   9  -4.700 -10.226 -10.226
   75   3HG2  VAL   9          HG21      VAL   9  -5.931 -10.732 -10.732
   76    H    LEU  10           HN       LEU  10  -6.625 -14.486 -14.486
   77    HA   LEU  10           HA       LEU  10  -6.011 -17.115 -17.115
   78   1HB   LEU  10           HB2      LEU  10  -7.468 -16.394 -16.394
   79   2HB   LEU  10           HB1      LEU  10  -7.269 -18.031 -18.031
   80    HG   LEU  10           HG       LEU  10  -8.622 -15.796 -15.796
   81   1HD1  LEU  10          HD13      LEU  10  -9.731 -17.926 -17.926
   82   2HD1  LEU  10          HD12      LEU  10 -10.712 -17.185 -17.185
   83   3HD1  LEU  10          HD11      LEU  10 -10.041 -16.190 -16.190
   84   1HD2  LEU  10          HD21      LEU  10  -7.584 -18.223 -18.223
   85   2HD2  LEU  10          HD23      LEU  10  -8.830 -17.287 -17.287
   86   3HD2  LEU  10          HD22      LEU  10  -9.285 -18.595 -18.595
   87    H    ALA  11           HN       ALA  11  -4.109 -18.096 -18.096
   88    HA   ALA  11           HA       ALA  11  -2.409 -16.807 -16.807
   89   1HB   ALA  11           HB3      ALA  11  -2.071 -18.979 -18.979
   90   2HB   ALA  11           HB2      ALA  11  -0.789 -18.565 -18.565
   91   3HB   ALA  11           HB1      ALA  11  -1.378 -17.357 -17.357
   92    H    SER  12           HN       SER  12  -2.000 -17.671 -17.671
   93    HA   SER  12           HA       SER  12  -3.631 -19.813 -19.813
   94   1HB   SER  12           HB2      SER  12  -2.407 -19.333 -19.333
   95   2HB   SER  12           HB1      SER  12  -2.689 -17.804 -17.804
   96    HG   SER  12           HG       SER  12  -0.480 -18.240 -18.240
   97    H    SER  13           HN       SER  13  -2.485 -21.673 -21.673
   98    HA   SER  13           HA       SER  13  -1.196 -23.439 -23.439
   99   1HB   SER  13           HB2      SER  13  -0.882 -24.818 -24.818
  100   2HB   SER  13           HB1      SER  13  -2.469 -24.054 -24.054
  101    HG   SER  13           HG       SER  13  -1.530 -23.724 -23.724
  102    H    ARG  14           HN       ARG  14   0.110 -21.075 -21.075
  103    HA   ARG  14           HA       ARG  14   2.824 -21.946 -21.946
  104   1HB   ARG  14           HB2      ARG  14   1.726 -20.186 -20.186
  105   2HB   ARG  14           HB1      ARG  14   1.691 -19.130 -19.130
  106   1HG   ARG  14           HG2      ARG  14   3.652 -18.474 -18.474
  107   2HG   ARG  14           HG1      ARG  14   4.241 -19.543 -19.543
  108   1HD   ARG  14           HD2      ARG  14   5.308 -20.142 -20.142
  109   2HD   ARG  14           HD1      ARG  14   4.204 -21.442 -21.442
  110    HE   ARG  14           HE       ARG  14   2.810 -19.467 -19.467
  111   1HH1  ARG  14          HH21      ARG  14   5.036 -22.155 -22.155
  112   2HH1  ARG  14          HH22      ARG  14   4.557 -22.533 -22.533
  113   1HH2  ARG  14          HH11      ARG  14   2.221 -19.993 -19.993
  114   2HH2  ARG  14          HH12      ARG  14   2.981 -21.324 -21.324
  115    H    GLY  15           HN       GLY  15   1.052 -20.202 -20.202
  116   1HA   GLY  15           HA2      GLY  15   1.743 -20.193 -20.193
  117   2HA   GLY  15           HA1      GLY  15   3.408 -20.445 -20.445
  118    H    ILE  16           HN       ILE  16   1.421 -18.083 -18.083
  119    HA   ILE  16           HA       ILE  16   3.031 -15.936 -15.936
  120    HB   ILE  16           HB       ILE  16   2.052 -16.464 -16.464
  121   1HG1  ILE  16          HG12      ILE  16   4.418 -15.798 -15.798
  122   2HG1  ILE  16          HG11      ILE  16   4.666 -15.599 -15.599
  123   1HG2  ILE  16          HG22      ILE  16   2.756 -13.764 -13.764
  124   2HG2  ILE  16          HG21      ILE  16   2.876 -14.101 -14.101
  125   3HG2  ILE  16          HG23      ILE  16   1.312 -14.198 -14.198
  126   1HD1  ILE  16          HD13      ILE  16   3.548 -18.208 -18.208
  127   2HD1  ILE  16          HD12      ILE  16   5.233 -17.881 -17.881
  128   3HD1  ILE  16          HD11      ILE  16   4.724 -17.837 -17.837
  129    H    ALA  17           HN       ALA  17   1.865 -14.798 -14.798
  130    HA   ALA  17           HA       ALA  17  -1.068 -14.393 -14.393
  131   1HB   ALA  17           HB2      ALA  17   0.727 -14.349 -14.349
  132   2HB   ALA  17           HB1      ALA  17  -0.930 -13.744 -13.744
  133   3HB   ALA  17           HB3      ALA  17  -0.619 -15.440 -15.440
  134    H    SER  18           HN       SER  18  -1.658 -12.338 -12.338
  135    HA   SER  18           HA       SER  18   0.265 -10.104 -10.104
  136   1HB   SER  18           HB2      SER  18   0.286 -10.921 -10.921
  137   2HB   SER  18           HB1      SER  18  -1.442 -10.597 -10.597
  138    HG   SER  18           HG       SER  18   0.478  -8.934  -8.934
  139    H    PHE  19           HN       PHE  19  -0.605  -8.335  -8.335
  140    HA   PHE  19           HA       PHE  19  -3.516  -7.781  -7.781
  141   1HB   PHE  19           HB2      PHE  19  -3.636  -7.484  -7.484
  142   2HB   PHE  19           HB1      PHE  19  -3.233  -9.135  -9.135
  143    HD1  PHE  19           HD1      PHE  19  -1.922  -5.962  -5.962
  144    HD2  PHE  19           HD2      PHE  19  -1.029 -10.087 -10.087
  145    HE1  PHE  19           HE1      PHE  19   0.168  -5.834  -5.834
  146    HE2  PHE  19           HE2      PHE  19   1.064  -9.957  -9.957
  147    HZ   PHE  19           HZ       PHE  19   1.662  -7.832  -7.832
  148    H    VAL  20           HN       VAL  20  -3.965  -5.509  -5.509
  149    HA   VAL  20           HA       VAL  20  -1.540  -3.784  -3.784
  150    HB   VAL  20           HB       VAL  20  -4.315  -3.453  -3.453
  151   1HG1  VAL  20          HG13      VAL  20  -1.872  -1.675  -1.675
  152   2HG1  VAL  20          HG12      VAL  20  -3.387  -1.464  -1.464
  153   3HG1  VAL  20          HG11      VAL  20  -3.352  -1.269  -1.269
  154   1HG2  VAL  20          HG21      VAL  20  -2.814  -5.139  -5.139
  155   2HG2  VAL  20          HG23      VAL  20  -3.242  -3.791  -3.791
  156   3HG2  VAL  20          HG22      VAL  20  -1.652  -3.845  -3.845
  157    H    CYS  21           HN       CYS  21  -1.235  -2.468  -2.468
  158    HA   CYS  21           HA       CYS  21  -3.530  -1.930  -1.930
  159   1HB   CYS  21           HB2      CYS  21  -1.390  -2.908  -2.908
  160   2HB   CYS  21           HB1      CYS  21  -0.541  -1.466  -1.466
  161    H    GLU  22           HN       GLU  22  -4.592  -0.098  -0.098
  162    HA   GLU  22           HA       GLU  22  -3.157   2.100   2.100
  163   1HB   GLU  22           HB2      GLU  22  -5.325   1.285   1.285
  164   2HB   GLU  22           HB1      GLU  22  -6.039   1.658   1.658
  165   1HG   GLU  22           HG2      GLU  22  -5.587   4.041   4.041
  166   2HG   GLU  22           HG1      GLU  22  -4.782   3.698   3.698
  167    H    TYR  23           HN       TYR  23  -2.711   4.096   4.096
  168    HA   TYR  23           HA       TYR  23  -3.521   4.533   4.533
  169   1HB   TYR  23           HB2      TYR  23  -1.264   5.044   5.044
  170   2HB   TYR  23           HB1      TYR  23  -1.115   3.674   3.674
  171    HD1  TYR  23           HD2      TYR  23  -0.953   7.417   7.417
  172    HD2  TYR  23           HD1      TYR  23   0.127   3.858   3.858
  173    HE1  TYR  23           HE2      TYR  23   0.498   8.791   8.791
  174    HE2  TYR  23           HE1      TYR  23   1.577   5.235   5.235
  175    HH   TYR  23           HH       TYR  23   2.679   8.189   8.189
  176    H    ALA  24           HN       ALA  24  -3.475   6.873   6.873
  177    HA   ALA  24           HA       ALA  24  -3.593   8.748   8.748
  178   1HB   ALA  24           HB3      ALA  24  -5.797   8.251   8.251
  179   2HB   ALA  24           HB2      ALA  24  -5.822   9.520   9.520
  180   3HB   ALA  24           HB1      ALA  24  -5.845   7.824   7.824
  181    H    SER  25           HN       SER  25  -2.627  10.664  10.664
  182    HA   SER  25           HA       SER  25  -2.810  11.767  11.767
  183   1HB   SER  25           HB2      SER  25  -0.381  11.665  11.665
  184   2HB   SER  25           HB1      SER  25  -1.022  10.046  10.046
  185    HG   SER  25           HG       SER  25   0.788  11.444  11.444
  186    HA   PRO  26           HA       PRO  26  -2.265  15.488  15.488
  187   1HB   PRO  26           HB2      PRO  26  -1.079  17.143  17.143
  188   2HB   PRO  26           HB1      PRO  26  -2.790  16.679  16.679
  189   1HG   PRO  26           HG2      PRO  26  -0.466  15.622  15.622
  190   2HG   PRO  26           HG1      PRO  26  -2.122  15.940  15.940
  191   1HD   PRO  26           HD2      PRO  26  -1.185  13.449  13.449
  192   2HD   PRO  26           HD1      PRO  26  -2.893  13.919  13.919
  193    H    GLY  27           HN       GLY  27  -0.668  16.572  16.572
  194   1HA   GLY  27           HA2      GLY  27   1.462  17.030  17.030
  195   2HA   GLY  27           HA1      GLY  27   2.152  16.500  16.500
  196    H    LYS  28           HN       LYS  28   3.436  15.783  15.783
  197    HA   LYS  28           HA       LYS  28   2.866  12.841  12.841
  198   1HB   LYS  28           HB2      LYS  28   3.659  14.808  14.808
  199   2HB   LYS  28           HB1      LYS  28   3.549  13.063  13.063
  200   1HG   LYS  28           HG2      LYS  28   1.247  14.779  14.779
  201   2HG   LYS  28           HG1      LYS  28   1.485  14.320  14.320
  202   1HD   LYS  28           HD2      LYS  28   1.440  11.921  11.921
  203   2HD   LYS  28           HD1      LYS  28   1.088  12.427  12.427
  204   1HE   LYS  28           HE2      LYS  28  -0.999  13.485  13.485
  205   2HE   LYS  28           HE1      LYS  28  -0.637  13.087  13.087
  206   1HZ   LYS  28           HZ1      LYS  28  -0.519  10.743  10.743
  207   2HZ   LYS  28           HZ3      LYS  28  -0.936  11.138  11.138
  208   3HZ   LYS  28           HZ2      LYS  28  -2.052  11.391  11.391
  209    H    ALA  29           HN       ALA  29   4.736  11.516  11.516
  210    HA   ALA  29           HA       ALA  29   7.417  12.806  12.806
  211   1HB   ALA  29           HB3      ALA  29   6.425  12.612  12.612
  212   2HB   ALA  29           HB2      ALA  29   6.495  10.862  10.862
  213   3HB   ALA  29           HB1      ALA  29   7.981  11.812  11.812
  214    H    THR  30           HN       THR  30   9.085  11.316  11.316
  215    HA   THR  30           HA       THR  30   8.148   9.047   9.047
  216    HB   THR  30           HB       THR  30  10.502   8.856   8.856
  217    HG1  THR  30           HG1      THR  30  10.981  10.685  10.685
  218   1HG2  THR  30          HG23      THR  30   9.055  11.154  11.154
  219   2HG2  THR  30          HG22      THR  30  10.560  11.752  11.752
  220   3HG2  THR  30          HG21      THR  30  10.600  10.767  10.767
  221    H    GLU  31           HN       GLU  31   9.827   9.532   9.532
  222    HA   GLU  31           HA       GLU  31  10.607   6.754   6.754
  223   1HB   GLU  31           HB2      GLU  31  10.465   9.045   9.045
  224   2HB   GLU  31           HB1      GLU  31  11.395   7.567   7.567
  225   1HG   GLU  31           HG2      GLU  31  11.888   9.162   9.162
  226   2HG   GLU  31           HG1      GLU  31  12.498   9.808   9.808
  227    H    VAL  32           HN       VAL  32   8.222   5.899   5.899
  228    HA   VAL  32           HA       VAL  32   6.658   6.206   6.206
  229    HB   VAL  32           HB       VAL  32   5.003   4.751   4.751
  230   1HG1  VAL  32          HG11      VAL  32   5.398   7.409   7.409
  231   2HG1  VAL  32          HG13      VAL  32   5.569   7.032   7.032
  232   3HG1  VAL  32          HG12      VAL  32   4.082   6.604   6.604
  233   1HG2  VAL  32          HG21      VAL  32   7.171   4.162   4.162
  234   2HG2  VAL  32          HG23      VAL  32   5.486   3.823   3.823
  235   3HG2  VAL  32          HG22      VAL  32   6.254   5.296   5.296
  236    H    ARG  33           HN       ARG  33   8.127   5.163   5.163
  237    HA   ARG  33           HA       ARG  33   9.449   2.711   2.711
  238   1HB   ARG  33           HB2      ARG  33   9.607   4.439   4.439
  239   2HB   ARG  33           HB1      ARG  33   8.158   3.705   3.705
  240   1HG   ARG  33           HG2      ARG  33   9.287   1.549   1.549
  241   2HG   ARG  33           HG1      ARG  33  10.722   2.203   2.203
  242   1HD   ARG  33           HD2      ARG  33  10.949   3.855   3.855
  243   2HD   ARG  33           HD1      ARG  33   9.595   3.054   3.054
  244    HE   ARG  33           HE       ARG  33  12.294   1.959   1.959
  245   1HH1  ARG  33          HH21      ARG  33   8.913   1.208   1.208
  246   2HH1  ARG  33          HH22      ARG  33   9.261  -0.310  -0.310
  247   1HH2  ARG  33          HH11      ARG  33  12.694  -0.013  -0.013
  248   2HH2  ARG  33          HH12      ARG  33  11.376  -0.997  -0.997
  249    H    VAL  34           HN       VAL  34   8.358   0.934   0.934
  250    HA   VAL  34           HA       VAL  34   5.784   0.162   0.162
  251    HB   VAL  34           HB       VAL  34   5.485  -1.198  -1.198
  252   1HG1  VAL  34          HG12      VAL  34   5.118   1.480   1.480
  253   2HG1  VAL  34          HG11      VAL  34   6.142   1.473   1.473
  254   3HG1  VAL  34          HG13      VAL  34   4.613   0.595   0.595
  255   1HG2  VAL  34          HG21      VAL  34   7.967  -1.459  -1.459
  256   2HG2  VAL  34          HG23      VAL  34   7.016  -0.990  -0.990
  257   3HG2  VAL  34          HG22      VAL  34   7.977   0.214   0.214
  258    H    THR  35           HN       THR  35   5.702  -1.633  -1.633
  259    HA   THR  35           HA       THR  35   7.851  -3.693  -3.693
  260    HB   THR  35           HB       THR  35   6.824  -2.448  -2.448
  261    HG1  THR  35           HG1      THR  35   8.327  -1.081  -1.081
  262   1HG2  THR  35          HG21      THR  35   8.305  -4.923  -4.923
  263   2HG2  THR  35          HG23      THR  35   9.074  -3.899  -3.899
  264   3HG2  THR  35          HG22      THR  35   7.422  -4.465  -4.465
  265    H    VAL  36           HN       VAL  36   7.151  -5.802  -5.802
  266    HA   VAL  36           HA       VAL  36   4.192  -6.118  -6.118
  267    HB   VAL  36           HB       VAL  36   6.282  -7.804  -7.804
  268   1HG1  VAL  36          HG13      VAL  36   4.441  -9.149  -9.149
  269   2HG1  VAL  36          HG12      VAL  36   3.274  -8.186  -8.186
  270   3HG1  VAL  36          HG11      VAL  36   4.428  -9.210  -9.210
  271   1HG2  VAL  36          HG22      VAL  36   4.392  -5.672  -5.672
  272   2HG2  VAL  36          HG21      VAL  36   5.897  -6.191  -6.191
  273   3HG2  VAL  36          HG23      VAL  36   4.409  -7.092  -7.092
  274    H    LEU  37           HN       LEU  37   3.507  -7.524  -7.524
  275    HA   LEU  37           HA       LEU  37   5.772  -8.822  -8.822
  276   1HB   LEU  37           HB2      LEU  37   3.295  -7.402  -7.402
  277   2HB   LEU  37           HB1      LEU  37   4.496  -8.194  -8.194
  278    HG   LEU  37           HG       LEU  37   5.342  -6.090  -6.090
  279   1HD1  LEU  37          HD12      LEU  37   3.388  -5.488  -5.488
  280   2HD1  LEU  37          HD11      LEU  37   4.809  -5.280  -5.280
  281   3HD1  LEU  37          HD13      LEU  37   4.661  -4.346  -4.346
  282   1HD2  LEU  37          HD23      LEU  37   6.419  -7.542  -7.542
  283   2HD2  LEU  37          HD22      LEU  37   7.244  -6.953  -6.953
  284   3HD2  LEU  37          HD21      LEU  37   6.861  -5.836  -5.836
  285    H    ARG  38           HN       ARG  38   5.030 -10.609 -10.609
  286    HA   ARG  38           HA       ARG  38   2.562 -11.964 -11.964
  287   1HB   ARG  38           HB2      ARG  38   4.766 -12.849 -12.849
  288   2HB   ARG  38           HB1      ARG  38   5.197 -13.252 -13.252
  289   1HG   ARG  38           HG2      ARG  38   3.258 -14.732 -14.732
  290   2HG   ARG  38           HG1      ARG  38   2.740 -14.284 -14.284
  291   1HD   ARG  38           HD2      ARG  38   3.936 -16.434 -16.434
  292   2HD   ARG  38           HD1      ARG  38   4.915 -15.189 -15.189
  293    HE   ARG  38           HE       ARG  38   6.454 -15.291 -15.291
  294   1HH1  ARG  38          HH21      ARG  38   3.469 -16.896 -16.896
  295   2HH1  ARG  38          HH22      ARG  38   4.132 -17.550 -17.550
  296   1HH2  ARG  38          HH11      ARG  38   7.266 -16.157 -16.157
  297   2HH2  ARG  38          HH12      ARG  38   6.256 -17.137 -17.137
  298    H    GLN  39           HN       GLN  39   1.139 -12.097 -12.097
  299    HA   GLN  39           HA       GLN  39   2.290 -12.287 -12.287
  300   1HB   GLN  39           HB2      GLN  39  -0.382 -11.412 -11.412
  301   2HB   GLN  39           HB1      GLN  39  -0.079 -11.587 -11.587
  302   1HG   GLN  39           HG2      GLN  39   1.757  -9.964  -9.964
  303   2HG   GLN  39           HG1      GLN  39   1.501  -9.805  -9.805
  304   1HE2  GLN  39          HE22      GLN  39  -1.635  -8.013  -8.013
  305   2HE2  GLN  39          HE21      GLN  39  -0.934  -9.191  -9.191
  306    H    ALA  40           HN       ALA  40   2.225 -14.204 -14.204
  307    HA   ALA  40           HA       ALA  40   0.159 -16.211 -16.211
  308   1HB   ALA  40           HB1      ALA  40   2.903 -16.298 -16.298
  309   2HB   ALA  40           HB3      ALA  40   2.687 -17.178 -17.178
  310   3HB   ALA  40           HB2      ALA  40   1.855 -17.716 -17.716
  311    H    ASP  41           HN       ASP  41  -0.620 -17.568 -17.568
  312    HA   ASP  41           HA       ASP  41  -1.073 -16.257 -16.257
  313   1HB   ASP  41           HB2      ASP  41  -1.213 -19.115 -19.115
  314   2HB   ASP  41           HB1      ASP  41  -1.772 -18.614 -18.614
  315    H    SER  42           HN       SER  42   1.274 -18.802 -18.802
  316    HA   SER  42           HA       SER  42   2.402 -19.077 -19.077
  317   1HB   SER  42           HB2      SER  42   3.368 -19.689 -19.689
  318   2HB   SER  42           HB1      SER  42   4.270 -20.152 -20.152
  319    HG   SER  42           HG       SER  42   1.671 -20.947 -20.947
  320    H    GLN  43           HN       GLN  43   3.578 -17.296 -17.296
  321    HA   GLN  43           HA       GLN  43   4.884 -15.301 -15.301
  322   1HB   GLN  43           HB2      GLN  43   6.319 -17.231 -17.231
  323   2HB   GLN  43           HB1      GLN  43   7.068 -15.743 -15.743
  324   1HG   GLN  43           HG2      GLN  43   6.545 -16.516 -16.516
  325   2HG   GLN  43           HG1      GLN  43   6.087 -18.072 -18.072
  326   1HE2  GLN  43          HE21      GLN  43   8.843 -15.764 -15.764
  327   2HE2  GLN  43          HE22      GLN  43  10.040 -16.966 -16.966
  328    H    VAL  44           HN       VAL  44   5.702 -13.443 -13.443
  329    HA   VAL  44           HA       VAL  44   4.548 -13.215 -13.215
  330    HB   VAL  44           HB       VAL  44   4.642 -11.212 -11.212
  331   1HG1  VAL  44          HG12      VAL  44   3.665 -10.926 -10.926
  332   2HG1  VAL  44          HG11      VAL  44   3.289  -9.780  -9.780
  333   3HG1  VAL  44          HG13      VAL  44   4.960 -10.016 -10.016
  334   1HG2  VAL  44          HG23      VAL  44   2.857 -13.234 -13.234
  335   2HG2  VAL  44          HG22      VAL  44   2.436 -11.687 -11.687
  336   3HG2  VAL  44          HG21      VAL  44   2.092 -11.975 -11.975
  337    H    THR  45           HN       THR  45   6.018 -12.466 -12.466
  338    HA   THR  45           HA       THR  45   8.500 -11.091 -11.091
  339    HB   THR  45           HB       THR  45   9.816 -12.635 -12.635
  340    HG1  THR  45           HG1      THR  45   8.541 -13.423 -13.423
  341   1HG2  THR  45          HG21      THR  45   9.213 -13.118 -13.118
  342   2HG2  THR  45          HG23      THR  45   8.049 -14.278 -14.278
  343   3HG2  THR  45          HG22      THR  45   9.769 -14.483 -14.483
  344    H    GLU  46           HN       GLU  46   9.688 -10.041 -10.041
  345    HA   GLU  46           HA       GLU  46   7.869  -8.733  -8.733
  346   1HB   GLU  46           HB2      GLU  46   9.728  -7.588  -7.588
  347   2HB   GLU  46           HB1      GLU  46  10.879  -8.616  -8.616
  348   1HG   GLU  46           HG2      GLU  46   9.901  -7.696  -7.696
  349   2HG   GLU  46           HG1      GLU  46   9.077  -6.499  -6.499
  350    H    VAL  47           HN       VAL  47   8.185  -8.756  -8.756
  351    HA   VAL  47           HA       VAL  47   9.341 -11.330 -11.330
  352    HB   VAL  47           HB       VAL  47   7.037  -9.598  -9.598
  353   1HG1  VAL  47          HG11      VAL  47   8.406 -11.959 -11.959
  354   2HG1  VAL  47          HG13      VAL  47   6.662 -11.781 -11.781
  355   3HG1  VAL  47          HG12      VAL  47   7.747 -10.522 -10.522
  356   1HG2  VAL  47          HG21      VAL  47   7.300 -12.114 -12.114
  357   2HG2  VAL  47          HG23      VAL  47   6.181 -10.767 -10.767
  358   3HG2  VAL  47          HG22      VAL  47   5.911 -11.943 -11.943
  359    H    CYS  48           HN       CYS  48   8.347  -8.613  -8.613
  360    HA   CYS  48           HA       CYS  48  11.238  -8.180  -8.180
  361   1HB   CYS  48           HB2      CYS  48   8.736  -8.354  -8.354
  362   2HB   CYS  48           HB1      CYS  48  10.275  -7.764  -7.764
  363    H    ALA  49           HN       ALA  49  11.846  -5.986  -5.986
  364    HA   ALA  49           HA       ALA  49   9.757  -3.887  -3.887
  365   1HB   ALA  49           HB3      ALA  49  11.145  -4.861  -4.861
  366   2HB   ALA  49           HB2      ALA  49  12.157  -3.498  -3.498
  367   3HB   ALA  49           HB1      ALA  49  10.458  -3.238  -3.238
  368    H    ALA  50           HN       ALA  50  10.250  -2.030  -2.030
  369    HA   ALA  50           HA       ALA  50  12.926  -1.137  -1.137
  370   1HB   ALA  50           HB2      ALA  50  11.252  -2.534  -2.534
  371   2HB   ALA  50           HB1      ALA  50  12.703  -1.595  -1.595
  372   3HB   ALA  50           HB3      ALA  50  12.815  -3.067  -3.067
  373    H    THR  51           HN       THR  51  12.808   0.980   0.980
  374    HA   THR  51           HA       THR  51  10.132   2.242   2.242
  375    HB   THR  51           HB       THR  51  12.687   3.617   3.617
  376    HG1  THR  51           HG1      THR  51  13.514   2.922   2.922
  377   1HG2  THR  51          HG22      THR  51  10.316   4.434   4.434
  378   2HG2  THR  51          HG21      THR  51  11.683   5.468   5.468
  379   3HG2  THR  51          HG23      THR  51  10.594   4.897   4.897
  380    H    TYR  52           HN       TYR  52   8.835   2.339   2.339
  381    HA   TYR  52           HA       TYR  52   9.906   1.777   1.777
  382   1HB   TYR  52           HB2      TYR  52   7.609   1.155   1.155
  383   2HB   TYR  52           HB1      TYR  52   7.187   2.853   2.853
  384    HD1  TYR  52           HD2      TYR  52   7.527   3.955   3.955
  385    HD2  TYR  52           HD1      TYR  52   7.426  -0.322  -0.322
  386    HE1  TYR  52           HE2      TYR  52   7.027   3.543   3.543
  387    HE2  TYR  52           HE1      TYR  52   6.928  -0.726  -0.726
  388    HH   TYR  52           HH       TYR  52   6.069   1.848   1.848
  389    H    MET  53           HN       MET  53  11.113   3.398   3.398
  390    HA   MET  53           HA       MET  53  10.543   6.239   6.239
  391   1HB   MET  53           HB2      MET  53  12.304   4.877   4.877
  392   2HB   MET  53           HB1      MET  53  12.412   6.559   6.559
  393   1HG   MET  53           HG2      MET  53  12.571   4.742   4.742
  394   2HG   MET  53           HG1      MET  53  13.835   4.412   4.412
  395   1HE   MET  53           HE2      MET  53  12.190   6.854   6.854
  396   2HE   MET  53           HE1      MET  53  12.944   8.409   8.409
  397   3HE   MET  53           HE3      MET  53  11.876   7.647   7.647
  398    H    MET  54           HN       MET  54  10.143   7.614   7.614
  399    HA   MET  54           HA       MET  54   7.794   6.583   6.583
  400   1HB   MET  54           HB2      MET  54   9.645   8.913   8.913
  401   2HB   MET  54           HB1      MET  54   8.065   8.673   8.673
  402   1HG   MET  54           HG2      MET  54   8.612   9.040   9.040
  403   2HG   MET  54           HG1      MET  54   7.838  10.207  10.207
  404   1HE   MET  54           HE3      MET  54   7.976   7.325   7.325
  405   2HE   MET  54           HE2      MET  54   6.377   7.385   7.385
  406   3HE   MET  54           HE1      MET  54   6.722   6.189   6.189
  407    H    GLY  55           HN       GLY  55  11.243   6.521   6.521
  408   1HA   GLY  55           HA2      GLY  55  10.492   4.825   4.825
  409   2HA   GLY  55           HA1      GLY  55  11.481   6.243   6.243
  410    H    ASN  56           HN       ASN  56  11.836   4.096   4.096
  411    HA   ASN  56           HA       ASN  56  14.409   3.130   3.130
  412   1HB   ASN  56           HB2      ASN  56  13.948   4.079   4.079
  413   2HB   ASN  56           HB1      ASN  56  15.454   3.423   3.423
  414   1HD2  ASN  56          HD22      ASN  56  14.999   7.300   7.300
  415   2HD2  ASN  56          HD21      ASN  56  14.334   6.312   6.312
  416    H    GLU  57           HN       GLU  57  15.166   1.072   1.072
  417    HA   GLU  57           HA       GLU  57  12.938  -0.772  -0.772
  418   1HB   GLU  57           HB2      GLU  57  14.865  -1.238  -1.238
  419   2HB   GLU  57           HB1      GLU  57  15.942  -1.182  -1.182
  420   1HG   GLU  57           HG2      GLU  57  14.773  -3.066  -3.066
  421   2HG   GLU  57           HG1      GLU  57  13.606  -3.092  -3.092
  422    H    LEU  58           HN       LEU  58  12.472  -1.783  -1.783
  423    HA   LEU  58           HA       LEU  58  13.693  -0.706  -0.706
  424   1HB   LEU  58           HB2      LEU  58  11.374  -2.526  -2.526
  425   2HB   LEU  58           HB1      LEU  58  11.815  -2.145  -2.145
  426    HG   LEU  58           HG       LEU  58  11.698   0.336   0.336
  427   1HD1  LEU  58          HD11      LEU  58  10.350  -1.170  -1.170
  428   2HD1  LEU  58          HD13      LEU  58   9.815   0.454   0.454
  429   3HD1  LEU  58          HD12      LEU  58  11.474   0.185   0.185
  430   1HD2  LEU  58          HD22      LEU  58   9.621  -1.576  -1.576
  431   2HD2  LEU  58          HD21      LEU  58   9.988   0.029   0.029
  432   3HD2  LEU  58          HD23      LEU  58   8.971  -0.147  -0.147
  433    H    THR  59           HN       THR  59  15.239  -1.833  -1.833
  434    HA   THR  59           HA       THR  59  15.942  -4.574  -4.574
  435    HB   THR  59           HB       THR  59  17.989  -3.970  -3.970
  436    HG1  THR  59           HG1      THR  59  17.604  -2.512  -2.512
  437   1HG2  THR  59          HG21      THR  59  17.697  -3.431  -3.431
  438   2HG2  THR  59          HG23      THR  59  17.189  -1.814  -1.814
  439   3HG2  THR  59          HG22      THR  59  18.824  -2.369  -2.369
  440    H    PHE  60           HN       PHE  60  15.643  -6.311  -6.311
  441    HA   PHE  60           HA       PHE  60  14.551  -5.800  -5.800
  442   1HB   PHE  60           HB2      PHE  60  14.364  -8.149  -8.149
  443   2HB   PHE  60           HB1      PHE  60  13.637  -8.119  -8.119
  444    HD1  PHE  60           HD1      PHE  60  11.924  -6.304  -6.304
  445    HD2  PHE  60           HD2      PHE  60  13.274  -7.086  -7.086
  446    HE1  PHE  60           HE1      PHE  60   9.931  -5.087  -5.087
  447    HE2  PHE  60           HE2      PHE  60  11.284  -5.867  -5.867
  448    HZ   PHE  60           HZ       PHE  60   9.611  -4.870  -4.870
  449    H    LEU  61           HN       LEU  61  16.151  -6.006  -6.006
  450    HA   LEU  61           HA       LEU  61  18.727  -7.106  -7.106
  451   1HB   LEU  61           HB2      LEU  61  18.040  -5.485  -5.485
  452   2HB   LEU  61           HB1      LEU  61  17.161  -6.767  -6.767
  453    HG   LEU  61           HG       LEU  61  19.292  -8.044  -8.044
  454   1HD1  LEU  61          HD12      LEU  61  20.388  -5.553  -5.553
  455   2HD1  LEU  61          HD11      LEU  61  21.404  -6.650  -6.650
  456   3HD1  LEU  61          HD13      LEU  61  20.584  -7.228  -7.228
  457   1HD2  LEU  61          HD23      LEU  61  19.151  -5.232  -5.232
  458   2HD2  LEU  61          HD22      LEU  61  18.664  -6.732  -6.732
  459   3HD2  LEU  61          HD21      LEU  61  20.373  -6.394  -6.394
  460    H    ASP  62           HN       ASP  62  15.899  -8.684  -8.684
  461    HA   ASP  62           HA       ASP  62  17.180 -11.318 -11.318
  462   1HB   ASP  62           HB2      ASP  62  17.016 -11.931 -11.931
  463   2HB   ASP  62           HB1      ASP  62  18.004 -10.488 -10.488
  464    H    ASP  63           HN       ASP  63  15.473 -12.874 -12.874
  465    HA   ASP  63           HA       ASP  63  13.370 -13.921 -13.921
  466   1HB   ASP  63           HB2      ASP  63  12.583 -11.006 -11.006
  467   2HB   ASP  63           HB1      ASP  63  11.455 -12.311 -12.311
  468    H    SER  64           HN       SER  64  14.582 -14.308 -14.308
  469    HA   SER  64           HA       SER  64  14.296 -14.779 -14.779
  470   1HB   SER  64           HB2      SER  64  11.429 -14.301 -14.301
  471   2HB   SER  64           HB1      SER  64  11.891 -15.015 -15.015
  472    HG   SER  64           HG       SER  64  12.110 -16.824 -16.824
  473    H    ILE  67           HN       ILE  67  13.638 -13.765 -13.765
  474    HA   ILE  67           HA       ILE  67  13.986 -10.842 -10.842
  475    HB   ILE  67           HB       ILE  67  13.938 -12.865 -12.865
  476   1HG1  ILE  67          HG12      ILE  67  16.238 -11.319 -11.319
  477   2HG1  ILE  67          HG11      ILE  67  15.784 -12.943 -12.943
  478   1HG2  ILE  67          HG21      ILE  67  14.070  -9.898  -9.898
  479   2HG2  ILE  67          HG23      ILE  67  15.286 -10.701 -10.701
  480   3HG2  ILE  67          HG22      ILE  67  13.572 -10.989 -10.989
  481   1HD1  ILE  67          HD13      ILE  67  16.130 -12.489 -12.489
  482   2HD1  ILE  67          HD12      ILE  67  17.587 -12.527 -12.527
  483   3HD1  ILE  67          HD11      ILE  67  16.499 -13.914 -13.914
  484    H    CYS  68           HN       CYS  68  11.804 -10.300 -10.300
  485    HA   CYS  68           HA       CYS  68   9.388 -11.046 -11.046
  486   1HB   CYS  68           HB2      CYS  68  10.146  -8.777  -8.777
  487   2HB   CYS  68           HB1      CYS  68   8.492  -9.061  -9.061
  488    H    THR  69           HN       THR  69   8.144  -9.709  -9.709
  489    HA   THR  69           HA       THR  69   9.573  -7.384  -7.384
  490    HB   THR  69           HB       THR  69  10.116  -9.426  -9.426
  491    HG1  THR  69           HG1      THR  69   9.894  -8.306  -8.306
  492   1HG2  THR  69          HG21      THR  69   8.032 -10.666 -10.666
  493   2HG2  THR  69          HG23      THR  69   7.136  -9.683  -9.683
  494   3HG2  THR  69          HG22      THR  69   8.403 -10.774 -10.774
  495    H    GLY  70           HN       GLY  70   8.096  -5.843  -5.843
  496   1HA   GLY  70           HA2      GLY  70   5.279  -6.382  -6.382
  497   2HA   GLY  70           HA1      GLY  70   5.595  -5.532  -5.532
  498    H    THR  71           HN       THR  71   4.075  -4.131  -4.131
  499    HA   THR  71           HA       THR  71   5.785  -2.092  -2.092
  500    HB   THR  71           HB       THR  71   3.070  -3.168  -3.168
  501    HG1  THR  71           HG1      THR  71   4.146  -4.470  -4.470
  502   1HG2  THR  71          HG21      THR  71   4.668  -0.886  -0.886
  503   2HG2  THR  71          HG23      THR  71   3.525  -1.761  -1.761
  504   3HG2  THR  71          HG22      THR  71   2.957  -0.938  -0.938
  505    H    SER  72           HN       SER  72   4.576   0.061   0.061
  506    HA   SER  72           HA       SER  72   2.477   0.470   0.470
  507   1HB   SER  72           HB2      SER  72   5.227   1.732   1.732
  508   2HB   SER  72           HB1      SER  72   3.880   2.048   2.048
  509    HG   SER  72           HG       SER  72   5.116   0.493   0.493
  510    H    SER  73           HN       SER  73   1.093   1.972   1.972
  511    HA   SER  73           HA       SER  73   2.315   4.132   4.132
  512   1HB   SER  73           HB2      SER  73   0.610   3.633   3.633
  513   2HB   SER  73           HB1      SER  73   1.666   2.252   2.252
  514    HG   SER  73           HG       SER  73   0.070   1.260   1.260
  515    H    GLY  74           HN       GLY  74   1.136   6.074   6.074
  516   1HA   GLY  74           HA2      GLY  74  -0.297   7.674   7.674
  517   2HA   GLY  74           HA1      GLY  74  -1.553   6.462   6.462
  518    H    ASN  75           HN       ASN  75  -2.628   6.042   6.042
  519    HA   ASN  75           HA       ASN  75  -1.216   6.305   6.305
  520   1HB   ASN  75           HB2      ASN  75  -4.135   6.303   6.303
  521   2HB   ASN  75           HB1      ASN  75  -3.575   6.477   6.477
  522   1HD2  ASN  75          HD22      ASN  75  -3.797   9.758   9.758
  523   2HD2  ASN  75          HD21      ASN  75  -4.658   8.325   8.325
  524    H    GLN  76           HN       GLN  76  -1.627   3.841   3.841
  525    HA   GLN  76           HA       GLN  76  -2.530   1.895   1.895
  526   1HB   GLN  76           HB2      GLN  76  -2.686   1.931   1.931
  527   2HB   GLN  76           HB1      GLN  76  -3.053   0.497   0.497
  528   1HG   GLN  76           HG2      GLN  76  -4.756   1.817   1.817
  529   2HG   GLN  76           HG1      GLN  76  -4.443   3.183   3.183
  530   1HE2  GLN  76          HE22      GLN  76  -5.653   1.012   1.012
  531   2HE2  GLN  76          HE21      GLN  76  -4.135   1.660   1.660
  532    H    VAL  77           HN       VAL  77  -0.939   0.517   0.517
  533    HA   VAL  77           HA       VAL  77   1.509   0.255   0.255
  534    HB   VAL  77           HB       VAL  77   2.675  -0.062  -0.062
  535   1HG1  VAL  77          HG11      VAL  77   1.343   2.246   2.246
  536   2HG1  VAL  77          HG13      VAL  77   0.778   1.851   1.851
  537   3HG1  VAL  77          HG12      VAL  77   2.506   2.020   2.020
  538   1HG2  VAL  77          HG21      VAL  77   0.044  -0.858  -0.858
  539   2HG2  VAL  77          HG23      VAL  77   1.641  -1.553  -1.553
  540   3HG2  VAL  77          HG22      VAL  77   1.159  -0.059  -0.059
  541    H    ASN  78           HN       ASN  78   1.785  -1.666  -1.666
  542    HA   ASN  78           HA       ASN  78   0.138  -4.005  -4.005
  543   1HB   ASN  78           HB2      ASN  78   0.106  -3.072  -3.072
  544   2HB   ASN  78           HB1      ASN  78   1.823  -3.451  -3.451
  545    HD2  ASN  78          HD22      ASN  78  -0.904  -4.738  -4.738
  546    H    LEU  79           HN       LEU  79   1.147  -5.505  -5.505
  547    HA   LEU  79           HA       LEU  79   4.112  -5.900  -5.900
  548   1HB   LEU  79           HB2      LEU  79   2.152  -6.285  -6.285
  549   2HB   LEU  79           HB1      LEU  79   3.802  -6.903  -6.903
  550    HG   LEU  79           HG       LEU  79   3.079  -3.994  -3.994
  551   1HD1  LEU  79          HD11      LEU  79   3.077  -5.487  -5.487
  552   2HD1  LEU  79          HD13      LEU  79   4.503  -4.448  -4.448
  553   3HD1  LEU  79          HD12      LEU  79   2.902  -3.746  -3.746
  554   1HD2  LEU  79          HD21      LEU  79   5.663  -5.538  -5.538
  555   2HD2  LEU  79          HD23      LEU  79   5.200  -4.368  -4.368
  556   3HD2  LEU  79          HD22      LEU  79   5.596  -3.819  -3.819
  557    H    THR  80           HN       THR  80   4.813  -7.983  -7.983
  558    HA   THR  80           HA       THR  80   2.712 -10.122 -10.122
  559    HB   THR  80           HB       THR  80   4.924  -9.433  -9.433
  560    HG1  THR  80           HG1      THR  80   3.444  -8.352  -8.352
  561   1HG2  THR  80          HG21      THR  80   2.822 -11.592 -11.592
  562   2HG2  THR  80          HG23      THR  80   3.536 -11.061 -11.061
  563   3HG2  THR  80          HG22      THR  80   4.557 -11.762 -11.762
  564    H    ILE  81           HN       ILE  81   3.356 -12.154 -12.154
  565    HA   ILE  81           HA       ILE  81   6.187 -12.465 -12.465
  566    HB   ILE  81           HB       ILE  81   3.549 -13.650 -13.650
  567   1HG1  ILE  81          HG12      ILE  81   5.434 -11.830 -11.830
  568   2HG1  ILE  81          HG11      ILE  81   4.094 -11.210 -11.210
  569   1HG2  ILE  81          HG21      ILE  81   6.355 -14.021 -14.021
  570   2HG2  ILE  81          HG23      ILE  81   4.877 -14.641 -14.641
  571   3HG2  ILE  81          HG22      ILE  81   5.407 -15.258 -15.258
  572   1HD1  ILE  81          HD13      ILE  81   2.632 -12.894 -12.894
  573   2HD1  ILE  81          HD12      ILE  81   3.987 -12.945 -12.945
  574   3HD1  ILE  81          HD11      ILE  81   3.155 -11.421 -11.421
  575    H    GLN  82           HN       GLN  82   7.327 -14.175 -14.175
  576    HA   GLN  82           HA       GLN  82   5.750 -16.231 -16.231
  577   1HB   GLN  82           HB2      GLN  82   8.525 -15.110 -15.110
  578   2HB   GLN  82           HB1      GLN  82   7.792 -16.437 -16.437
  579   1HG   GLN  82           HG2      GLN  82   6.369 -15.068 -15.068
  580   2HG   GLN  82           HG1      GLN  82   6.186 -13.946 -13.946
  581   1HE2  GLN  82          HE22      GLN  82   8.758 -13.025 -13.025
  582   2HE2  GLN  82          HE21      GLN  82   7.563 -14.223 -14.223
  583    H    GLY  83           HN       GLY  83   5.869 -18.156 -18.156
  584   1HA   GLY  83           HA2      GLY  83   7.284 -20.078 -20.078
  585   2HA   GLY  83           HA1      GLY  83   8.376 -18.924 -18.924
  586    H    LEU  84           HN       LEU  84   4.840 -19.470 -19.470
  587    HA   LEU  84           HA       LEU  84   4.891 -19.002 -19.002
  588   1HB   LEU  84           HB2      LEU  84   2.703 -19.520 -19.520
  589   2HB   LEU  84           HB1      LEU  84   2.411 -19.122 -19.122
  590    HG   LEU  84           HG       LEU  84   4.063 -17.369 -17.369
  591   1HD1  LEU  84          HD11      LEU  84   1.119 -17.149 -17.149
  592   2HD1  LEU  84          HD13      LEU  84   2.048 -15.955 -15.955
  593   3HD1  LEU  84          HD12      LEU  84   1.765 -17.556 -17.556
  594   1HD2  LEU  84          HD21      LEU  84   2.971 -17.221 -17.221
  595   2HD2  LEU  84          HD23      LEU  84   4.547 -16.720 -16.720
  596   3HD2  LEU  84          HD22      LEU  84   3.123 -15.727 -15.727
  597    H    ARG  85           HN       ARG  85   5.188 -20.701 -20.701
  598    HA   ARG  85           HA       ARG  85   4.570 -23.473 -23.473
  599   1HB   ARG  85           HB2      ARG  85   6.006 -22.358 -22.358
  600   2HB   ARG  85           HB1      ARG  85   5.915 -24.062 -24.062
  601   1HG   ARG  85           HG2      ARG  85   6.969 -23.402 -23.402
  602   2HG   ARG  85           HG1      ARG  85   7.317 -21.839 -21.839
  603   1HD   ARG  85           HD2      ARG  85   8.537 -23.013 -23.013
  604   2HD   ARG  85           HD1      ARG  85   8.267 -24.548 -24.548
  605    HE   ARG  85           HE       ARG  85   9.339 -22.964 -22.964
  606   1HH1  ARG  85          HH21      ARG  85  10.351 -23.712 -23.712
  607   2HH1  ARG  85          HH22      ARG  85  12.028 -23.516 -23.516
  608   1HH2  ARG  85          HH11      ARG  85  11.520 -22.721 -22.721
  609   2HH2  ARG  85          HH12      ARG  85  12.685 -22.962 -22.962
  610    H    ALA  86           HN       ALA  86   3.715 -24.829 -24.829
  611    HA   ALA  86           HA       ALA  86   1.063 -23.958 -23.958
  612   1HB   ALA  86           HB2      ALA  86   2.983 -25.983 -25.983
  613   2HB   ALA  86           HB1      ALA  86   1.354 -25.793 -25.793
  614   3HB   ALA  86           HB3      ALA  86   1.584 -26.275 -26.275
  615    H    MET  87           HN       MET  87   4.089 -23.745 -23.745
  616    HA   MET  87           HA       MET  87   2.982 -22.621 -22.621
  617   1HB   MET  87           HB2      MET  87   5.203 -23.729 -23.729
  618   2HB   MET  87           HB1      MET  87   5.748 -22.347 -22.347
  619   1HG   MET  87           HG2      MET  87   5.263 -20.862 -20.862
  620   2HG   MET  87           HG1      MET  87   4.833 -22.286 -22.286
  621   1HE   MET  87           HE2      MET  87   6.572 -20.610 -20.610
  622   2HE   MET  87           HE1      MET  87   6.700 -22.243 -22.243
  623   3HE   MET  87           HE3      MET  87   8.161 -21.305 -21.305
  624    H    ASP  88           HN       ASP  88   4.269 -21.177 -21.177
  625    HA   ASP  88           HA       ASP  88   4.388 -18.456 -18.456
  626   1HB   ASP  88           HB2      ASP  88   3.918 -19.851 -19.851
  627   2HB   ASP  88           HB1      ASP  88   4.066 -18.098 -18.098
  628    H    THR  89           HN       THR  89   1.621 -20.382 -20.382
  629    HA   THR  89           HA       THR  89  -0.249 -18.418 -18.418
  630    HB   THR  89           HB       THR  89  -0.750 -20.891 -20.891
  631    HG1  THR  89           HG1      THR  89  -0.224 -21.994 -21.994
  632   1HG2  THR  89          HG23      THR  89  -2.386 -19.296 -19.296
  633   2HG2  THR  89          HG22      THR  89  -2.845 -20.904 -20.904
  634   3HG2  THR  89          HG21      THR  89  -2.736 -19.569 -19.569
  635    H    GLY  90           HN       GLY  90  -1.244 -16.875 -16.875
  636   1HA   GLY  90           HA2      GLY  90  -2.202 -17.012 -17.012
  637   2HA   GLY  90           HA1      GLY  90  -0.537 -16.460 -16.460
  638    H    LEU  91           HN       LEU  91  -0.937 -14.339 -14.339
  639    HA   LEU  91           HA       LEU  91  -2.632 -12.663 -12.663
  640   1HB   LEU  91           HB2      LEU  91  -3.198 -12.868 -12.868
  641   2HB   LEU  91           HB1      LEU  91  -1.597 -12.257 -12.257
  642    HG   LEU  91           HG       LEU  91  -2.201 -10.215 -10.215
  643   1HD1  LEU  91          HD12      LEU  91  -4.200 -11.382 -11.382
  644   2HD1  LEU  91          HD11      LEU  91  -4.995 -11.236 -11.236
  645   3HD1  LEU  91          HD13      LEU  91  -4.544  -9.785  -9.785
  646   1HD2  LEU  91          HD21      LEU  91  -2.287 -10.619 -10.619
  647   2HD2  LEU  91          HD23      LEU  91  -2.863  -9.111  -9.111
  648   3HD2  LEU  91          HD22      LEU  91  -4.015 -10.370 -10.370
  649    H    TYR  92           HN       TYR  92  -1.638 -11.172 -11.172
  650    HA   TYR  92           HA       TYR  92   1.201 -10.450 -10.450
  651   1HB   TYR  92           HB2      TYR  92  -0.435 -10.627 -10.627
  652   2HB   TYR  92           HB1      TYR  92   1.152  -9.853  -9.853
  653    HD1  TYR  92           HD1      TYR  92  -0.665 -13.073 -13.073
  654    HD2  TYR  92           HD2      TYR  92   3.185 -11.124 -11.124
  655    HE1  TYR  92           HE1      TYR  92   0.458 -15.307 -15.307
  656    HE2  TYR  92           HE2      TYR  92   4.309 -13.353 -13.353
  657    HH   TYR  92           HH       TYR  92   3.648 -15.798 -15.798
  658    H    ILE  93           HN       ILE  93   1.611  -8.334  -8.334
  659    HA   ILE  93           HA       ILE  93  -0.680  -6.413  -6.413
  660    HB   ILE  93           HB       ILE  93   1.906  -6.485  -6.485
  661   1HG1  ILE  93          HG12      ILE  93   0.236  -6.903  -6.903
  662   2HG1  ILE  93          HG11      ILE  93  -0.905  -7.354  -7.354
  663   1HG2  ILE  93          HG22      ILE  93   0.301  -4.281  -4.281
  664   2HG2  ILE  93          HG21      ILE  93  -0.336  -4.884  -4.884
  665   3HG2  ILE  93          HG23      ILE  93   1.372  -4.471  -4.471
  666   1HD1  ILE  93          HD11      ILE  93   1.805  -8.596  -8.596
  667   2HD1  ILE  93          HD13      ILE  93   0.685  -9.155  -9.155
  668   3HD1  ILE  93          HD12      ILE  93   0.252  -9.278  -9.278
  669    H    CYS  94           HN       CYS  94  -0.502  -4.608  -4.608
  670    HA   CYS  94           HA       CYS  94   2.040  -4.115  -4.115
  671   1HB   CYS  94           HB2      CYS  94   0.741  -2.443  -2.443
  672   2HB   CYS  94           HB1      CYS  94  -0.299  -3.851  -3.851
  673    H    LYS  95           HN       LYS  95   3.211  -2.033  -2.033
  674    HA   LYS  95           HA       LYS  95   2.569  -0.596  -0.596
  675   1HB   LYS  95           HB2      LYS  95   3.983  -2.525  -2.525
  676   2HB   LYS  95           HB1      LYS  95   5.120  -2.058  -2.058
  677   1HG   LYS  95           HG2      LYS  95   6.205  -0.738  -0.738
  678   2HG   LYS  95           HG1      LYS  95   4.741   0.219   0.219
  679   1HD   LYS  95           HD2      LYS  95   3.947  -1.461  -1.461
  680   2HD   LYS  95           HD1      LYS  95   5.500  -2.286  -2.286
  681   1HE   LYS  95           HE2      LYS  95   5.294   0.649   0.649
  682   2HE   LYS  95           HE1      LYS  95   5.361  -0.648  -0.648
  683   1HZ   LYS  95           HZ3      LYS  95   7.362  -1.489  -1.489
  684   2HZ   LYS  95           HZ2      LYS  95   7.344  -0.098  -0.098
  685   3HZ   LYS  95           HZ1      LYS  95   7.591   0.038   0.038
  686    H    VAL  96           HN       VAL  96   2.102   1.023   1.023
  687    HA   VAL  96           HA       VAL  96   4.488   2.033   2.033
  688    HB   VAL  96           HB       VAL  96   2.513   1.630   1.630
  689   1HG1  VAL  96          HG12      VAL  96   1.110   3.147   3.147
  690   2HG1  VAL  96          HG11      VAL  96   0.425   3.084   3.084
  691   3HG1  VAL  96          HG13      VAL  96   0.709   1.589   1.589
  692   1HG2  VAL  96          HG23      VAL  96   3.760   4.149   4.149
  693   2HG2  VAL  96          HG22      VAL  96   2.840   3.488   3.488
  694   3HG2  VAL  96          HG21      VAL  96   2.035   4.489   4.489
  695    H    GLU  97           HN       GLU  97   5.700   3.485   3.485
  696    HA   GLU  97           HA       GLU  97   4.377   5.614   5.614
  697   1HB   GLU  97           HB2      GLU  97   6.817   3.922   3.922
  698   2HB   GLU  97           HB1      GLU  97   6.359   5.320   5.320
  699   1HG   GLU  97           HG2      GLU  97   4.754   2.764   2.764
  700   2HG   GLU  97           HG1      GLU  97   5.491   3.297   3.297
  701    H    LEU  98           HN       LEU  98   5.182   7.652   7.652
  702    HA   LEU  98           HA       LEU  98   7.303   8.033   8.033
  703   1HB   LEU  98           HB2      LEU  98   5.895  10.097  10.097
  704   2HB   LEU  98           HB1      LEU  98   6.603  10.349  10.349
  705    HG   LEU  98           HG       LEU  98   4.085   8.820   8.820
  706   1HD1  LEU  98          HD11      LEU  98   4.731  11.290  11.290
  707   2HD1  LEU  98          HD13      LEU  98   3.188  10.447  10.447
  708   3HD1  LEU  98          HD12      LEU  98   3.671  11.145  11.145
  709   1HD2  LEU  98          HD22      LEU  98   5.690   8.874   8.874
  710   2HD2  LEU  98          HD21      LEU  98   5.142   7.466   7.466
  711   3HD2  LEU  98          HD23      LEU  98   3.976   8.457   8.457
  712    H    MET  99           HN       MET  99   8.824   6.851   6.851
  713    HA   MET  99           HA       MET  99   9.453   7.996   7.996
  714   1HB   MET  99           HB2      MET  99   9.595   5.598   5.598
  715   2HB   MET  99           HB1      MET  99  11.006   6.021   6.021
  716   1HG   MET  99           HG2      MET  99  12.362   6.189   6.189
  717   2HG   MET  99           HG1      MET  99  11.126   6.968   6.968
  718   1HE   MET  99           HE2      MET  99   9.191   5.959   5.959
  719   2HE   MET  99           HE1      MET  99   8.635   4.729   4.729
  720   3HE   MET  99           HE3      MET  99   9.002   4.294   4.294
  721    H    TYR 100           HN       TYR 100  10.900   8.218   8.218
  722    HA   TYR 100           HA       TYR 100  13.320   9.584   9.584
  723   1HB   TYR 100           HB2      TYR 100  12.276   8.863   8.863
  724   2HB   TYR 100           HB1      TYR 100  13.832   9.638   9.638
  725    HD1  TYR 100           HD2      TYR 100  15.672   8.449   8.449
  726    HD2  TYR 100           HD1      TYR 100  11.869   6.537   6.537
  727    HE1  TYR 100           HE2      TYR 100  16.694   6.223   6.223
  728    HE2  TYR 100           HE1      TYR 100  12.886   4.309   4.309
  729    HH   TYR 100           HH       TYR 100  15.484   3.783   3.783
  730    HA   PRO 101           HA       PRO 101  11.394  13.328  13.328
  731   1HB   PRO 101           HB2      PRO 101   8.880  13.242  13.242
  732   2HB   PRO 101           HB1      PRO 101  10.365  12.637  12.637
  733   1HG   PRO 101           HG2      PRO 101   8.121  11.134  11.134
  734   2HG   PRO 101           HG1      PRO 101   9.317  10.688  10.688
  735   1HD   PRO 101           HD2      PRO 101   9.296  10.057  10.057
  736   2HD   PRO 101           HD1      PRO 101  10.430   9.485   9.485
  737    HA   PRO 102           HA       PRO 102   8.830  14.073  14.073
  738   1HB   PRO 102           HB2      PRO 102   9.948  16.570  16.570
  739   2HB   PRO 102           HB1      PRO 102  10.721  14.964  14.964
  740   1HG   PRO 102           HG2      PRO 102  11.417  16.967  16.967
  741   2HG   PRO 102           HG1      PRO 102  12.494  15.884  15.884
  742   1HD   PRO 102           HD2      PRO 102  11.459  15.452  15.452
  743   2HD   PRO 102           HD1      PRO 102  12.269  14.246  14.246
  744    HA   PRO 103           HA       PRO 103   8.365  15.412  15.412
  745   1HB   PRO 103           HB2      PRO 103   6.281  15.491  15.491
  746   2HB   PRO 103           HB1      PRO 103   7.571  16.755  16.755
  747   1HG   PRO 103           HG2      PRO 103   4.988  17.023  17.023
  748   2HG   PRO 103           HG1      PRO 103   6.286  18.173  18.173
  749   1HD   PRO 103           HD2      PRO 103   5.432  15.696  15.696
  750   2HD   PRO 103           HD1      PRO 103   5.031  17.405  17.405
  751    H    TYR 104           HN       TYR 104   7.541  13.495  13.495
  752    HA   TYR 104           HA       TYR 104   6.540  11.493  11.493
  753   1HB   TYR 104           HB2      TYR 104   8.323  11.017  11.017
  754   2HB   TYR 104           HB1      TYR 104   7.403  11.421  11.421
  755    HD1  TYR 104           HD1      TYR 104   6.046   9.538   9.538
  756    HD2  TYR 104           HD2      TYR 104   7.712   9.204   9.204
  757    HE1  TYR 104           HE1      TYR 104   5.289   7.179   7.179
  758    HE2  TYR 104           HE2      TYR 104   6.992   6.786   6.786
  759    HH   TYR 104           HH       TYR 104   6.463   4.897   4.897
  760    H    TYR 105           HN       TYR 105   4.409  10.778  10.778
  761    HA   TYR 105           HA       TYR 105   2.524  10.675  10.675
  762   1HB   TYR 105           HB2      TYR 105   2.593  13.140  13.140
  763   2HB   TYR 105           HB1      TYR 105   2.138  12.672  12.672
  764    HD1  TYR 105           HD2      TYR 105  -0.046  11.755  11.755
  765    HD2  TYR 105           HD1      TYR 105   1.013  13.037  13.037
  766    HE1  TYR 105           HE2      TYR 105  -2.472  11.722  11.722
  767    HE2  TYR 105           HE1      TYR 105  -1.400  12.995  12.995
  768    HH   TYR 105           HH       TYR 105  -3.758  13.244  13.244
  769    H    LEU 106           HN       LEU 106   1.929   8.577   8.577
  770    HA   LEU 106           HA       LEU 106   0.381   8.373   8.373
  771   1HB   LEU 106           HB2      LEU 106   3.089   7.891   7.891
  772   2HB   LEU 106           HB1      LEU 106   2.445   6.271   6.271
  773    HG   LEU 106           HG       LEU 106   0.884   6.585   6.585
  774   1HD1  LEU 106          HD12      LEU 106   2.178   9.305   9.305
  775   2HD1  LEU 106          HD11      LEU 106   1.491   8.596   8.596
  776   3HD1  LEU 106          HD13      LEU 106   0.468   8.889   8.889
  777   1HD2  LEU 106          HD23      LEU 106   3.850   6.778   6.778
  778   2HD2  LEU 106          HD22      LEU 106   2.746   5.510   5.510
  779   3HD2  LEU 106          HD21      LEU 106   2.879   6.990   6.990
  780    H    GLY 108           HN       GLY 108   0.670   5.342   5.342
  781   1HA   GLY 108           HA2      GLY 108  -0.254   4.631   4.631
  782   2HA   GLY 108           HA1      GLY 108  -1.515   4.581   4.581
  783    H    ILE 109           HN       ILE 109  -1.014   2.268   2.268
  784    HA   ILE 109           HA       ILE 109   0.664   0.596   0.596
  785    HB   ILE 109           HB       ILE 109  -0.318   0.168   0.168
  786   1HG1  ILE 109          HG12      ILE 109   1.281   1.991   1.991
  787   2HG1  ILE 109          HG11      ILE 109   2.024   0.564   0.564
  788   1HG2  ILE 109          HG21      ILE 109   1.521  -1.401  -1.401
  789   2HG2  ILE 109          HG23      ILE 109   1.480  -1.607  -1.607
  790   3HG2  ILE 109          HG22      ILE 109   0.042  -1.946  -1.946
  791   1HD1  ILE 109          HD12      ILE 109   2.925   0.004   0.004
  792   2HD1  ILE 109          HD11      ILE 109   2.359   1.575   1.575
  793   3HD1  ILE 109          HD13      ILE 109   3.599   1.473   1.473
  794    H    GLY 110           HN       GLY 110  -0.390  -1.296  -1.296
  795   1HA   GLY 110           HA2      GLY 110  -3.300  -1.212  -1.212
  796   2HA   GLY 110           HA1      GLY 110  -2.254  -2.458  -2.458
  797    H    ASN 111           HN       ASN 111  -4.785  -2.558  -2.558
  798    HA   ASN 111           HA       ASN 111  -4.110  -3.550  -3.550
  799   1HB   ASN 111           HB2      ASN 111  -6.384  -2.895  -2.895
  800   2HB   ASN 111           HB1      ASN 111  -6.414  -4.475  -4.475
  801    HD2  ASN 111          HD22      ASN 111  -6.339  -3.003  -3.003
  802    H    GLY 112           HN       GLY 112  -4.096  -5.071  -5.071
  803   1HA   GLY 112           HA2      GLY 112  -2.444  -6.893  -6.893
  804   2HA   GLY 112           HA1      GLY 112  -3.009  -7.558  -7.558
  805    H    THR 113           HN       THR 113  -2.907  -8.515  -8.515
  806    HA   THR 113           HA       THR 113  -5.796  -9.259  -9.259
  807    HB   THR 113           HB       THR 113  -3.398  -9.272  -9.272
  808    HG1  THR 113           HG1      THR 113  -4.050  -7.372  -7.372
  809   1HG2  THR 113          HG23      THR 113  -6.308  -9.981  -9.981
  810   2HG2  THR 113          HG22      THR 113  -5.243  -9.562  -9.562
  811   3HG2  THR 113          HG21      THR 113  -4.889 -10.979 -10.979
  812    H    GLN 114           HN       GLN 114  -6.273 -11.495 -11.495
  813    HA   GLN 114           HA       GLN 114  -4.116 -13.293 -13.293
  814   1HB   GLN 114           HB2      GLN 114  -6.562 -13.252 -13.252
  815   2HB   GLN 114           HB1      GLN 114  -6.984 -13.997 -13.997
  816   1HG   GLN 114           HG2      GLN 114  -6.696 -15.849 -15.849
  817   2HG   GLN 114           HG1      GLN 114  -5.135 -15.726 -15.726
  818   1HE2  GLN 114          HE22      GLN 114  -3.854 -15.920 -15.920
  819   2HE2  GLN 114          HE21      GLN 114  -4.146 -16.807 -16.807
  820    H    ILE 115           HN       ILE 115  -2.810 -14.343 -14.343
  821    HA   ILE 115           HA       ILE 115  -3.872 -14.551 -14.551
  822    HB   ILE 115           HB       ILE 115  -1.096 -14.952 -14.952
  823   1HG1  ILE 115          HG12      ILE 115  -2.313 -12.779 -12.779
  824   2HG1  ILE 115          HG11      ILE 115  -1.876 -12.616 -12.616
  825   1HG2  ILE 115          HG22      ILE 115  -2.023 -15.028 -15.028
  826   2HG2  ILE 115          HG21      ILE 115  -0.342 -15.071 -15.071
  827   3HG2  ILE 115          HG23      ILE 115  -1.427 -16.404 -16.404
  828   1HD1  ILE 115          HD11      ILE 115   0.494 -13.451 -13.451
  829   2HD1  ILE 115          HD13      ILE 115  -0.116 -12.733 -12.733
  830   3HD1  ILE 115          HD12      ILE 115   0.040 -11.747 -11.747
  831    H    TYR 116           HN       TYR 116  -4.965 -16.430 -16.430
  832    HA   TYR 116           HA       TYR 116  -4.509 -18.841 -18.841
  833   1HB   TYR 116           HB2      TYR 116  -6.453 -17.904 -17.904
  834   2HB   TYR 116           HB1      TYR 116  -6.377 -19.623 -19.623
  835    HD1  TYR 116           HD1      TYR 116  -5.934 -19.806 -19.806
  836    HD2  TYR 116           HD2      TYR 116  -8.297 -16.849 -16.849
  837    HE1  TYR 116           HE1      TYR 116  -7.298 -19.400 -19.400
  838    HE2  TYR 116           HE2      TYR 116  -9.642 -16.449 -16.449
  839    HH   TYR 116           HH       TYR 116  -9.611 -18.532 -18.532
  840    H    VAL 117           HN       VAL 117  -3.535 -20.697 -20.697
  841    HA   VAL 117           HA       VAL 117  -2.629 -20.830 -20.830
  842    HB   VAL 117           HB       VAL 117  -1.172 -21.686 -21.686
  843   1HG1  VAL 117          HG13      VAL 117  -0.464 -21.956 -21.956
  844   2HG1  VAL 117          HG12      VAL 117   0.697 -22.187 -22.187
  845   3HG1  VAL 117          HG11      VAL 117  -0.692 -23.268 -23.268
  846   1HG2  VAL 117          HG23      VAL 117  -0.588 -19.527 -19.527
  847   2HG2  VAL 117          HG22      VAL 117  -1.130 -19.254 -19.254
  848   3HG2  VAL 117          HG21      VAL 117   0.461 -19.952 -19.952
  849    H    ILE 118           HN       ILE 118  -2.265 -23.125 -23.125
  850    HA   ILE 118           HA       ILE 118  -4.408 -24.856 -24.856
  851    HB   ILE 118           HB       ILE 118  -2.725 -24.945 -24.945
  852   1HG1  ILE 118          HG12      ILE 118  -4.017 -22.940 -22.940
  853   2HG1  ILE 118          HG11      ILE 118  -4.854 -24.124 -24.124
  854   1HG2  ILE 118          HG22      ILE 118  -5.090 -26.538 -26.538
  855   2HG2  ILE 118          HG21      ILE 118  -4.782 -26.345 -26.345
  856   3HG2  ILE 118          HG23      ILE 118  -3.578 -27.120 -27.120
  857   1HD1  ILE 118          HD11      ILE 118  -5.985 -24.579 -24.579
  858   2HD1  ILE 118          HD13      ILE 118  -5.712 -22.837 -22.837
  859   3HD1  ILE 118          HD12      ILE 118  -6.682 -23.534 -23.534
  860    H    ASP 119           HN       ASP 119  -3.757 -26.422 -26.422
  861    HA   ASP 119           HA       ASP 119  -1.124 -27.771 -27.771
  862   1HB   ASP 119           HB2      ASP 119  -1.076 -25.936 -25.936
  863   2HB   ASP 119           HB1      ASP 119  -2.242 -26.875 -26.875
  864    HA   PRO 120           HA       PRO 120  -3.989 -31.210 -31.210
  865   1HB   PRO 120           HB2      PRO 120  -2.151 -33.235 -33.235
  866   2HB   PRO 120           HB1      PRO 120  -2.765 -32.364 -32.364
  867   1HG   PRO 120           HG2      PRO 120  -0.203 -32.003 -32.003
  868   2HG   PRO 120           HG1      PRO 120  -0.513 -31.975 -31.975
  869   1HD   PRO 120           HD2      PRO 120  -0.189 -29.722 -29.722
  870   2HD   PRO 120           HD1      PRO 120  -1.224 -29.790 -29.790
  871    H    GLU 121           HN       GLU 121  -4.348 -32.900 -32.900
  872    HA   GLU 121           HA       GLU 121  -2.809 -32.383 -32.383
  873   1HB   GLU 121           HB2      GLU 121  -5.678 -33.223 -33.223
  874   2HB   GLU 121           HB1      GLU 121  -4.971 -33.056 -33.056
  875   1HG   GLU 121           HG2      GLU 121  -4.520 -30.689 -30.689
  876   2HG   GLU 121           HG1      GLU 121  -5.120 -30.833 -30.833
  877    HA   PRO 122           HA       PRO 122  -1.600 -36.631 -36.631
  878   1HB   PRO 122           HB2      PRO 122  -1.368 -37.143 -37.143
  879   2HB   PRO 122           HB1      PRO 122  -0.181 -36.191 -36.191
  880   1HG   PRO 122           HG2      PRO 122  -2.411 -35.257 -35.257
  881   2HG   PRO 122           HG1      PRO 122  -0.752 -34.650 -34.650
  882   1HD   PRO 122           HD2      PRO 122  -2.840 -33.408 -33.408
  883   2HD   PRO 122           HD1      PRO 122  -1.209 -33.410 -33.410
  884    H    CYS 123           HN       CYS 123  -4.468 -35.585 -35.585
  885    HA   CYS 123           HA       CYS 123  -5.448 -38.390 -38.390
  886   1HB   CYS 123           HB2      CYS 123  -6.417 -35.713 -35.713
  887   2HB   CYS 123           HB1      CYS 123  -7.199 -37.256 -37.256
  888    HG   CYS 123           HG       CYS 123  -4.917 -38.014 -38.014
  889    HA   PRO 124           HA       PRO 124  -7.717 -37.484 -37.484
  890   1HB   PRO 124           HB2      PRO 124  -9.128 -39.827 -39.827
  891   2HB   PRO 124           HB1      PRO 124  -7.428 -39.686 -39.686
  892   1HG   PRO 124           HG2      PRO 124  -8.582 -40.727 -40.727
  893   2HG   PRO 124           HG1      PRO 124  -7.228 -41.345 -41.345
  894   1HD   PRO 124           HD2      PRO 124  -6.879 -39.884 -39.884
  895   2HD   PRO 124           HD1      PRO 124  -5.735 -39.845 -39.845
  896    H    ASP 125           HN       ASP 125  -9.066 -38.196 -38.196
  897    HA   ASP 125           HA       ASP 125 -11.839 -37.610 -37.610
  898   1HB   ASP 125           HB2      ASP 125 -12.297 -38.104 -38.104
  899   2HB   ASP 125           HB1      ASP 125 -11.331 -39.372 -39.372
  900    H    SER 126           HN       SER 126 -13.000 -36.037 -36.037
  901    HA   SER 126           HA       SER 126 -11.722 -33.408 -33.408
  902   1HB   SER 126           HB2      SER 126 -13.917 -32.638 -32.638
  903   2HB   SER 126           HB1      SER 126 -14.129 -33.874 -33.874
  904    HG   SER 126           HG       SER 126 -15.126 -33.892 -33.892
  905    H    ASP 127           HN       ASP 127 -11.804 -31.897 -31.897
  906    HA   ASP 127           HA       ASP 127 -10.472 -33.236 -33.236
  907   1HB   ASP 127           HB2      ASP 127  -9.603 -31.172 -31.172
  908   2HB   ASP 127           HB1      ASP 127 -11.063 -30.319 -30.319
  909    H    GLN 128           HN       GLN 128 -11.960 -34.147 -34.147
  910    HA   GLN 128           HA       GLN 128 -14.156 -32.371 -32.371
  911   1HB   GLN 128           HB2      GLN 128 -14.178 -35.338 -35.338
  912   2HB   GLN 128           HB1      GLN 128 -15.508 -34.480 -34.480
  913   1HG   GLN 128           HG2      GLN 128 -14.364 -33.781 -33.781
  914   2HG   GLN 128           HG1      GLN 128 -15.839 -34.713 -34.713
  915   1HE2  GLN 128          HE22      GLN 128 -17.655 -31.835 -31.835
  916   2HE2  GLN 128          HE21      GLN 128 -17.475 -33.499 -33.499
  917    H    GLU 129           HN       GLU 129 -14.805 -32.897 -32.897
  918    HA   GLU 129           HA       GLU 129 -14.269 -33.289 -33.289
  919   1HB   GLU 129           HB2      GLU 129 -13.028 -35.691 -35.691
  920   2HB   GLU 129           HB1      GLU 129 -13.314 -35.582 -35.582
  921   1HG   GLU 129           HG2      GLU 129 -15.467 -35.324 -35.324
  922   2HG   GLU 129           HG1      GLU 129 -15.144 -36.787 -36.787
  923    HA   PRO 130           HA       PRO 130  -9.755 -32.062 -32.062
  924   1HB   PRO 130           HB2      PRO 130  -9.971 -29.354 -29.354
  925   2HB   PRO 130           HB1      PRO 130 -10.144 -30.143 -30.143
  926   1HG   PRO 130           HG2      PRO 130 -12.251 -29.173 -29.173
  927   2HG   PRO 130           HG1      PRO 130 -12.175 -29.066 -29.066
  928   1HD   PRO 130           HD2      PRO 130 -13.684 -30.908 -30.908
  929   2HD   PRO 130           HD1      PRO 130 -12.959 -31.204 -31.204
  930    H    LYS 131           HN       LYS 131  -8.314 -31.594 -31.594
  931    HA   LYS 131           HA       LYS 131  -9.536 -31.681 -31.681
  932   1HB   LYS 131           HB2      LYS 131  -6.690 -31.814 -31.814
  933   2HB   LYS 131           HB1      LYS 131  -7.139 -32.060 -32.060
  934   1HG   LYS 131           HG2      LYS 131  -8.532 -33.972 -33.972
  935   2HG   LYS 131           HG1      LYS 131  -8.198 -33.701 -33.701
  936   1HD   LYS 131           HD2      LYS 131  -5.772 -34.057 -34.057
  937   2HD   LYS 131           HD1      LYS 131  -6.167 -34.433 -34.433
  938   1HE   LYS 131           HE2      LYS 131  -7.402 -35.930 -35.930
  939   2HE   LYS 131           HE1      LYS 131  -5.921 -36.469 -36.469
  940   1HZ   LYS 131           HZ1      LYS 131  -7.150 -36.269 -36.269
  941   2HZ   LYS 131           HZ3      LYS 131  -8.571 -35.975 -35.975
  942   3HZ   LYS 131           HZ2      LYS 131  -7.776 -37.470 -37.470
  943    H1   NAG 132           H1       NAG 132  -5.203  -5.667  -5.667
  944    H2   NAG 132           H2       NAG 132  -4.746  -2.907  -2.907
  945    H3   NAG 132           H3       NAG 132  -3.246  -5.528  -5.528
  946    H4   NAG 132           H4       NAG 132  -5.211  -4.084  -4.084
  947    H5   NAG 132           H5       NAG 132  -5.596  -6.720  -6.720
  948   1H6   NAG 132           H61      NAG 132  -6.569  -6.090  -6.090
  949   2H6   NAG 132           H62      NAG 132  -7.778  -5.203  -5.203
  950   1H8   NAG 132           H81      NAG 132  -0.592  -3.007  -3.007
  951   2H8   NAG 132           H82      NAG 132  -1.371  -3.210  -3.210
  952   3H8   NAG 132           H83      NAG 132  -1.037  -1.572  -1.572
  953    HN2  NAG 132           HN2      NAG 132  -3.163  -4.424  -4.424
  954    HO3  NAG 132           HO3      NAG 132  -1.899  -4.046  -4.046
  955    H1   NAG 133           H1       NAG 133  -4.349  -4.244  -4.244
  956    H2   NAG 133           H2       NAG 133  -3.296  -6.997  -6.997
  957    H3   NAG 133           H3       NAG 133  -3.764  -4.535  -4.535
  958    H4   NAG 133           H4       NAG 133  -1.103  -5.790  -5.790
  959    H5   NAG 133           H5       NAG 133  -2.320  -3.125  -3.125
  960   1H6   NAG 133           H61      NAG 133   0.248  -4.566  -4.566
  961   2H6   NAG 133           H62      NAG 133   0.034  -2.963  -2.963
  962   1H8   NAG 133           H81      NAG 133  -5.569  -8.898  -8.898
  963   2H8   NAG 133           H82      NAG 133  -4.155  -8.907  -8.907
  964   3H8   NAG 133           H83      NAG 133  -5.769  -9.377  -9.377
  965    HN2  NAG 133           HN2      NAG 133  -5.923  -5.859  -5.859
  966    HO3  NAG 133           HO3      NAG 133  -2.686  -5.906  -5.906
  967    HO6  NAG 133           HO6      NAG 133   0.427  -3.228  -3.228
  968    H1   FUC 134           H1       FUC 134  -6.604  -8.139  -8.139
  969    H2   FUC 134           H2       FUC 134  -9.126  -8.651  -8.651
  970    H3   FUC 134           H3       FUC 134  -9.889  -6.695  -6.695
  971    H4   FUC 134           H4       FUC 134 -11.375  -8.728  -8.728
  972    H5   FUC 134           H5       FUC 134  -9.015  -8.791  -8.791
  973   1H6   FUC 134           H61      FUC 134  -9.806 -11.490 -11.490
  974   2H6   FUC 134           H62      FUC 134  -8.792 -11.168 -11.168
  975   3H6   FUC 134           H63      FUC 134 -10.537 -10.765 -10.765
  976    HO2  FUC 134           HO2      FUC 134  -8.506  -5.915  -5.915
  977    HO3  FUC 134           HO3      FUC 134 -11.840  -7.498  -7.498
  978    HO4  FUC 134           HO4      FUC 134 -11.776  -9.815  -9.815
  979    H1   MAN 135           H1       MAN 135  -0.247  -5.785  -5.785
  980    H2   MAN 135           H2       MAN 135   1.177  -4.697  -4.697
  981    H3   MAN 135           H3       MAN 135   2.397  -5.875  -5.875
  982    H4   MAN 135           H4       MAN 135   2.430  -3.269  -3.269
  983    H5   MAN 135           H5       MAN 135   0.858  -5.850  -5.850
  984   1H6   MAN 135           H61      MAN 135  -0.249  -4.398  -4.398
  985   2H6   MAN 135           H62      MAN 135   1.443  -4.823  -4.823
  986    HO2  MAN 135           HO2      MAN 135   1.385  -2.483  -2.483
  987    HO3  MAN 135           HO3      MAN 135   3.512  -3.297  -3.297
  988    HO4  MAN 135           HO4      MAN 135   3.312  -5.927  -5.927
  989    HO6  MAN 135           HO6      MAN 135   0.391  -2.337  -2.337
  990    H1   NAG 136           H1       NAG 136   0.773  -7.145  -7.145
  991    H2   NAG 136           H2       NAG 136  -1.724  -6.222  -6.222
  992    H3   NAG 136           H3       NAG 136  -0.331  -8.959  -8.959
  993    H4   NAG 136           H4       NAG 136  -0.259  -6.793  -6.793
  994    H5   NAG 136           H5       NAG 136   1.950  -7.623  -7.623
  995   1H6   NAG 136           H61      NAG 136   3.222  -6.019  -6.019
  996   2H6   NAG 136           H62      NAG 136   2.547  -7.046  -7.046
  997   1H8   NAG 136           H81      NAG 136  -3.658  -6.791  -6.791
  998   2H8   NAG 136           H82      NAG 136  -3.706  -5.625  -5.625
  999   3H8   NAG 136           H83      NAG 136  -5.021  -6.820  -6.820
 1000    HN2  NAG 136           HN2      NAG 136  -1.408  -7.973  -7.973
 1001    HO3  NAG 136           HO3      NAG 136  -2.488  -7.776  -7.776
 1002    H1   NAG 137           H1       NAG 137   2.180  -8.888  -8.888
 1003    H2   NAG 137           H2       NAG 137   0.571 -11.084 -11.084
 1004    H3   NAG 137           H3       NAG 137   3.134 -11.375 -11.375
 1005    H4   NAG 137           H4       NAG 137   2.829 -11.729 -11.729
 1006    H5   NAG 137           H5       NAG 137   4.222  -9.444  -9.444
 1007   1H6   NAG 137           H61      NAG 137   4.016  -8.516  -8.516
 1008   2H6   NAG 137           H62      NAG 137   3.955 -10.234 -10.234
 1009   1H8   NAG 137           H81      NAG 137  -1.830 -12.130 -12.130
 1010   2H8   NAG 137           H82      NAG 137  -1.021 -10.545 -10.545
 1011   3H8   NAG 137           H83      NAG 137  -2.355 -10.741 -10.741
 1012    HN2  NAG 137           HN2      NAG 137   0.969 -10.465 -10.465
 1013    HO3  NAG 137           HO3      NAG 137   1.713 -13.229 -13.229
 1014    HO6  NAG 137           HO6      NAG 137   6.043  -8.790  -8.790
 1015    H1   FUC 138           H1       FUC 138   1.172  -5.936  -5.936
 1016    H2   FUC 138           H2       FUC 138   1.588  -3.367  -3.367
 1017    H3   FUC 138           H3       FUC 138   1.521  -2.698  -2.698
 1018    H4   FUC 138           H4       FUC 138   3.970  -1.959  -1.959
 1019    H5   FUC 138           H5       FUC 138   3.890  -4.497  -4.497
 1020   1H6   FUC 138           H61      FUC 138   6.061  -4.384  -4.384
 1021   2H6   FUC 138           H62      FUC 138   5.519  -5.164  -5.164
 1022   3H6   FUC 138           H63      FUC 138   5.726  -3.386  -3.386
 1023    HO2  FUC 138           HO2      FUC 138  -0.351  -3.782  -3.782
 1024    HO3  FUC 138           HO3      FUC 138   1.707  -1.288  -1.288
 1025    HO4  FUC 138           HO4      FUC 138   3.580  -3.032  -3.032
 1026    H1   MAN 139           H1       MAN 139   3.789 -13.620 -13.620
 1027    H2   MAN 139           H2       MAN 139   4.758 -12.170 -12.170
 1028    H3   MAN 139           H3       MAN 139   4.761 -14.535 -14.535
 1029    H4   MAN 139           H4       MAN 139   7.513 -14.700 -14.700
 1030    H5   MAN 139           H5       MAN 139   4.828 -15.807 -15.807
 1031   1H6   MAN 139           H61      MAN 139   6.135 -16.235 -16.235
 1032   2H6   MAN 139           H62      MAN 139   6.602 -17.236 -17.236
 1033    HO2  MAN 139           HO2      MAN 139   7.259 -12.695 -12.695
 1034    HO3  MAN 139           HO3      MAN 139   6.415 -14.469 -14.469
 1035    HO4  MAN 139           HO4      MAN 139   5.729 -16.688 -16.688
 1036    HO6  MAN 139           HO6      MAN 139   8.177 -15.668 -15.668

  Start of MODEL   15
    1   1H    ALA   1           HT3      ALA   1  -9.843  12.227  12.227
    2   2H    ALA   1           HT2      ALA   1  -9.344  12.218  12.218
    3   3H    ALA   1           HT1      ALA   1 -10.892  12.784  12.784
    4    HA   ALA   1           HA       ALA   1 -11.626  10.607  10.607
    5   1HB   ALA   1           HB1      ALA   1 -11.041  11.533  11.533
    6   2HB   ALA   1           HB3      ALA   1 -10.117  10.031  10.031
    7   3HB   ALA   1           HB2      ALA   1 -11.856   9.996   9.996
    8    H    MET   1           HN       MET   1  -8.389  10.169  10.169
    9    HA   MET   1           HA       MET   1  -6.675   8.610   8.610
   10   1HB   MET   1           HB2      MET   1  -7.832   9.172   9.172
   11   2HB   MET   1           HB1      MET   1  -6.275   8.393   8.393
   12   1HG   MET   1           HG2      MET   1  -7.034  11.145  11.145
   13   2HG   MET   1           HG1      MET   1  -6.055  10.839  10.839
   14   1HE   MET   1           HE3      MET   1  -4.763  12.531  12.531
   15   2HE   MET   1           HE2      MET   1  -3.348  12.162  12.162
   16   3HE   MET   1           HE1      MET   1  -4.880  12.539  12.539
   17    H    HIS   2           HN       HIS   2  -8.069   6.951   6.951
   18    HA   HIS   2           HA       HIS   2  -9.261   4.941   4.941
   19   1HB   HIS   2           HB2      HIS   2  -9.624   5.507   5.507
   20   2HB   HIS   2           HB1      HIS   2 -10.444   4.210   4.210
   21    HD1  HIS   2           HD1      HIS   2 -11.496   5.377   5.377
   22    HD2  HIS   2           HD2      HIS   2 -11.365   7.635   7.635
   23    HE1  HIS   2           HE1      HIS   2 -13.178   7.247   7.247
   24    H    VAL   3           HN       VAL   3  -8.237   2.997   2.997
   25    HA   VAL   3           HA       VAL   3  -6.111   2.283   2.283
   26    HB   VAL   3           HB       VAL   3  -6.399   1.680   1.680
   27   1HG1  VAL   3          HG12      VAL   3  -4.257   0.935   0.935
   28   2HG1  VAL   3          HG11      VAL   3  -4.035   0.829   0.829
   29   3HG1  VAL   3          HG13      VAL   3  -5.255  -0.165  -0.165
   30   1HG2  VAL   3          HG21      VAL   3  -4.554   3.517   3.517
   31   2HG2  VAL   3          HG23      VAL   3  -5.790   4.002   4.002
   32   3HG2  VAL   3          HG22      VAL   3  -4.355   3.135   3.135
   33    H    ALA   4           HN       ALA   4  -6.530   0.413   0.413
   34    HA   ALA   4           HA       ALA   4  -8.700  -1.395  -1.395
   35   1HB   ALA   4           HB2      ALA   4  -8.431  -0.024  -0.024
   36   2HB   ALA   4           HB1      ALA   4  -7.794  -1.610  -1.610
   37   3HB   ALA   4           HB3      ALA   4  -9.427  -1.464  -1.464
   38    H    GLN   5           HN       GLN   5  -8.112  -3.431  -3.431
   39    HA   GLN   5           HA       GLN   5  -5.617  -4.613  -4.613
   40   1HB   GLN   5           HB2      GLN   5  -6.425  -4.351  -4.351
   41   2HB   GLN   5           HB1      GLN   5  -5.098  -5.373  -5.373
   42   1HG   GLN   5           HG2      GLN   5  -5.300  -2.391  -2.391
   43   2HG   GLN   5           HG1      GLN   5  -4.322  -3.128  -3.128
   44   1HE2  GLN   5          HE22      GLN   5  -1.960  -4.545  -4.545
   45   2HE2  GLN   5          HE21      GLN   5  -2.723  -4.893  -4.893
   46    HA   PRO   6           HA       PRO   6  -8.495  -8.082  -8.082
   47   1HB   PRO   6           HB2      PRO   6  -6.760  -9.921  -9.921
   48   2HB   PRO   6           HB1      PRO   6  -7.514  -8.658  -8.658
   49   1HG   PRO   6           HG2      PRO   6  -4.767  -8.801  -8.801
   50   2HG   PRO   6           HG1      PRO   6  -5.331  -8.140  -8.140
   51   1HD   PRO   6           HD2      PRO   6  -4.677  -6.622  -6.622
   52   2HD   PRO   6           HD1      PRO   6  -5.772  -6.096  -6.096
   53    H    ALA   7           HN       ALA   7  -8.953  -9.672  -9.672
   54    HA   ALA   7           HA       ALA   7  -7.248  -9.917  -9.917
   55   1HB   ALA   7           HB3      ALA   7  -9.790 -10.092 -10.092
   56   2HB   ALA   7           HB2      ALA   7  -9.555 -11.691 -11.691
   57   3HB   ALA   7           HB1      ALA   7  -9.017 -11.367 -11.367
   58    H    VAL   8           HN       VAL   8  -7.763 -11.895 -11.895
   59    HA   VAL   8           HA       VAL   8  -5.317 -13.358 -13.358
   60    HB   VAL   8           HB       VAL   8  -7.394 -14.397 -14.397
   61   1HG1  VAL   8          HG13      VAL   8  -8.041 -14.892 -14.892
   62   2HG1  VAL   8          HG12      VAL   8  -8.360 -16.187 -16.187
   63   3HG1  VAL   8          HG11      VAL   8  -9.124 -14.599 -14.599
   64   1HG2  VAL   8          HG22      VAL   8  -5.467 -15.857 -15.857
   65   2HG2  VAL   8          HG21      VAL   8  -5.398 -15.637 -15.637
   66   3HG2  VAL   8          HG23      VAL   8  -6.588 -16.695 -16.695
   67    H    VAL   9           HN       VAL   9  -4.487 -14.539 -14.539
   68    HA   VAL   9           HA       VAL   9  -5.711 -14.040 -14.040
   69    HB   VAL   9           HB       VAL   9  -2.984 -13.446 -13.446
   70   1HG1  VAL   9          HG13      VAL   9  -3.686 -14.211 -14.211
   71   2HG1  VAL   9          HG12      VAL   9  -2.473 -12.960 -12.960
   72   3HG1  VAL   9          HG11      VAL   9  -2.228 -14.582 -14.582
   73   1HG2  VAL   9          HG23      VAL   9  -5.073 -11.861 -11.861
   74   2HG2  VAL   9          HG22      VAL   9  -3.440 -11.288 -11.288
   75   3HG2  VAL   9          HG21      VAL   9  -4.479 -11.825 -11.825
   76    H    LEU  10           HN       LEU  10  -5.108 -15.674 -15.674
   77    HA   LEU  10           HA       LEU  10  -4.242 -18.248 -18.248
   78   1HB   LEU  10           HB2      LEU  10  -5.979 -17.674 -17.674
   79   2HB   LEU  10           HB1      LEU  10  -5.620 -19.280 -19.280
   80    HG   LEU  10           HG       LEU  10  -7.006 -17.072 -17.072
   81   1HD1  LEU  10          HD12      LEU  10  -8.405 -17.936 -17.936
   82   2HD1  LEU  10          HD11      LEU  10  -8.123 -19.586 -19.586
   83   3HD1  LEU  10          HD13      LEU  10  -9.031 -18.460 -18.460
   84   1HD2  LEU  10          HD23      LEU  10  -5.728 -19.532 -19.532
   85   2HD2  LEU  10          HD22      LEU  10  -6.548 -18.336 -18.336
   86   3HD2  LEU  10          HD21      LEU  10  -7.463 -19.661 -19.661
   87    H    ALA  11           HN       ALA  11  -2.361 -19.135 -19.135
   88    HA   ALA  11           HA       ALA  11  -0.857 -17.794 -17.794
   89   1HB   ALA  11           HB3      ALA  11  -0.408 -20.064 -20.064
   90   2HB   ALA  11           HB2      ALA  11   0.768 -19.708 -19.708
   91   3HB   ALA  11           HB1      ALA  11   0.386 -18.489 -18.489
   92    H    SER  12           HN       SER  12  -0.245 -18.769 -18.769
   93    HA   SER  12           HA       SER  12  -2.132 -20.792 -20.792
   94   1HB   SER  12           HB2      SER  12  -1.652 -18.767 -18.767
   95   2HB   SER  12           HB1      SER  12   0.076 -19.106 -19.106
   96    HG   SER  12           HG       SER  12  -1.549 -19.840 -19.840
   97    H    SER  13           HN       SER  13  -1.007 -22.409 -22.409
   98    HA   SER  13           HA       SER  13   0.559 -24.284 -24.284
   99   1HB   SER  13           HB2      SER  13  -0.869 -24.736 -24.736
  100   2HB   SER  13           HB1      SER  13   0.303 -23.888 -23.888
  101    HG   SER  13           HG       SER  13   0.408 -26.398 -26.398
  102    H    ARG  14           HN       ARG  14   1.492 -21.621 -21.621
  103    HA   ARG  14           HA       ARG  14   4.233 -22.270 -22.270
  104   1HB   ARG  14           HB2      ARG  14   2.900 -20.482 -20.482
  105   2HB   ARG  14           HB1      ARG  14   2.910 -19.566 -19.566
  106   1HG   ARG  14           HG2      ARG  14   4.723 -18.622 -18.622
  107   2HG   ARG  14           HG1      ARG  14   5.518 -19.870 -19.870
  108   1HD   ARG  14           HD2      ARG  14   4.522 -20.548 -20.548
  109   2HD   ARG  14           HD1      ARG  14   6.073 -19.710 -19.710
  110    HE   ARG  14           HE       ARG  14   6.115 -21.792 -21.792
  111   1HH1  ARG  14          HH21      ARG  14   5.813 -21.514 -21.514
  112   2HH1  ARG  14          HH22      ARG  14   6.549 -23.052 -23.052
  113   1HH2  ARG  14          HH11      ARG  14   7.061 -23.774 -23.774
  114   2HH2  ARG  14          HH12      ARG  14   7.248 -24.319 -24.319
  115    H    GLY  15           HN       GLY  15   2.586 -20.923 -20.923
  116   1HA   GLY  15           HA2      GLY  15   3.481 -21.021 -21.021
  117   2HA   GLY  15           HA1      GLY  15   5.104 -21.143 -21.143
  118    H    ILE  16           HN       ILE  16   2.937 -18.770 -18.770
  119    HA   ILE  16           HA       ILE  16   4.491 -16.640 -16.640
  120    HB   ILE  16           HB       ILE  16   3.427 -17.015 -17.015
  121   1HG1  ILE  16          HG12      ILE  16   5.734 -16.196 -16.196
  122   2HG1  ILE  16          HG11      ILE  16   6.049 -16.115 -16.115
  123   1HG2  ILE  16          HG21      ILE  16   4.030 -14.381 -14.381
  124   2HG2  ILE  16          HG23      ILE  16   4.142 -14.574 -14.574
  125   3HG2  ILE  16          HG22      ILE  16   2.598 -14.816 -14.816
  126   1HD1  ILE  16          HD13      ILE  16   5.012 -18.701 -18.701
  127   2HD1  ILE  16          HD12      ILE  16   6.661 -18.263 -18.263
  128   3HD1  ILE  16          HD11      ILE  16   6.225 -18.371 -18.371
  129    H    ALA  17           HN       ALA  17   3.288 -15.688 -15.688
  130    HA   ALA  17           HA       ALA  17   0.332 -15.396 -15.396
  131   1HB   ALA  17           HB1      ALA  17   1.235 -16.649 -16.649
  132   2HB   ALA  17           HB3      ALA  17   1.970 -15.135 -15.135
  133   3HB   ALA  17           HB2      ALA  17   0.216 -15.267 -15.267
  134    H    SER  18           HN       SER  18  -0.305 -13.350 -13.350
  135    HA   SER  18           HA       SER  18   1.390 -11.058 -11.058
  136   1HB   SER  18           HB2      SER  18   1.089 -10.090 -10.090
  137   2HB   SER  18           HB1      SER  18   1.809 -11.692 -11.692
  138    HG   SER  18           HG       SER  18   0.091 -12.350 -12.350
  139    H    PHE  19           HN       PHE  19   0.264  -9.144  -9.144
  140    HA   PHE  19           HA       PHE  19  -2.655  -9.006  -9.006
  141   1HB   PHE  19           HB2      PHE  19  -3.013  -8.613  -8.613
  142   2HB   PHE  19           HB1      PHE  19  -2.445 -10.237 -10.237
  143    HD1  PHE  19           HD2      PHE  19  -0.001 -10.820 -10.820
  144    HD2  PHE  19           HD1      PHE  19  -1.723  -7.097  -7.097
  145    HE1  PHE  19           HE2      PHE  19   1.948 -10.494 -10.494
  146    HE2  PHE  19           HE1      PHE  19   0.229  -6.771  -6.771
  147    HZ   PHE  19           HZ       PHE  19   2.062  -8.476  -8.476
  148    H    VAL  20           HN       VAL  20  -3.449  -6.797  -6.797
  149    HA   VAL  20           HA       VAL  20  -1.229  -4.804  -4.804
  150    HB   VAL  20           HB       VAL  20  -4.032  -4.793  -4.793
  151   1HG1  VAL  20          HG13      VAL  20  -1.769  -2.798  -2.798
  152   2HG1  VAL  20          HG12      VAL  20  -3.289  -2.752  -2.752
  153   3HG1  VAL  20          HG11      VAL  20  -3.288  -2.515  -2.515
  154   1HG2  VAL  20          HG21      VAL  20  -2.342  -6.349  -6.349
  155   2HG2  VAL  20          HG23      VAL  20  -2.973  -5.113  -5.113
  156   3HG2  VAL  20          HG22      VAL  20  -1.369  -4.927  -4.927
  157    H    CYS  21           HN       CYS  21  -1.054  -3.486  -3.486
  158    HA   CYS  21           HA       CYS  21  -3.379  -3.121  -3.121
  159   1HB   CYS  21           HB2      CYS  21  -1.245  -3.932  -3.932
  160   2HB   CYS  21           HB1      CYS  21  -0.401  -2.556  -2.556
  161    H    GLU  22           HN       GLU  22  -4.572  -1.440  -1.440
  162    HA   GLU  22           HA       GLU  22  -3.231   0.835   0.835
  163   1HB   GLU  22           HB2      GLU  22  -5.492   1.542   1.542
  164   2HB   GLU  22           HB1      GLU  22  -5.369  -0.194  -0.194
  165   1HG   GLU  22           HG2      GLU  22  -6.298  -0.551  -0.551
  166   2HG   GLU  22           HG1      GLU  22  -6.541   1.188   1.188
  167    H    TYR  23           HN       TYR  23  -3.239   2.988   2.988
  168    HA   TYR  23           HA       TYR  23  -4.003   3.422   3.422
  169   1HB   TYR  23           HB2      TYR  23  -1.842   4.486   4.486
  170   2HB   TYR  23           HB1      TYR  23  -1.534   2.917   2.917
  171    HD1  TYR  23           HD2      TYR  23  -1.650   6.586   6.586
  172    HD2  TYR  23           HD1      TYR  23  -0.594   2.722   2.722
  173    HE1  TYR  23           HE2      TYR  23  -0.418   7.717   7.717
  174    HE2  TYR  23           HE1      TYR  23   0.638   3.854   3.854
  175    HH   TYR  23           HH       TYR  23   1.549   7.050   7.050
  176    H    ALA  24           HN       ALA  24  -3.954   5.943   5.943
  177    HA   ALA  24           HA       ALA  24  -4.928   7.334   7.334
  178   1HB   ALA  24           HB3      ALA  24  -6.128   7.215   7.215
  179   2HB   ALA  24           HB2      ALA  24  -6.676   8.334   8.334
  180   3HB   ALA  24           HB1      ALA  24  -6.837   6.595   6.595
  181    H    SER  25           HN       SER  25  -3.689   9.130   9.130
  182    HA   SER  25           HA       SER  25  -3.031  10.894  10.894
  183   1HB   SER  25           HB2      SER  25  -1.165   9.395   9.395
  184   2HB   SER  25           HB1      SER  25  -1.003   9.514   9.514
  185    HG   SER  25           HG       SER  25  -0.313  11.322  11.322
  186    HA   PRO  26           HA       PRO  26  -3.685  13.909  13.909
  187   1HB   PRO  26           HB2      PRO  26  -2.504  16.076  16.076
  188   2HB   PRO  26           HB1      PRO  26  -4.060  15.419  15.419
  189   1HG   PRO  26           HG2      PRO  26  -1.357  15.102  15.102
  190   2HG   PRO  26           HG1      PRO  26  -2.931  15.247  15.247
  191   1HD   PRO  26           HD2      PRO  26  -1.573  12.871  12.871
  192   2HD   PRO  26           HD1      PRO  26  -3.329  13.008  13.008
  193    H    GLY  27           HN       GLY  27  -2.549  14.873  14.873
  194   1HA   GLY  27           HA2      GLY  27  -0.778  15.158  15.158
  195   2HA   GLY  27           HA1      GLY  27   0.154  15.633  15.633
  196    H    LYS  28           HN       LYS  28   1.761  14.514  14.514
  197    HA   LYS  28           HA       LYS  28   2.049  11.651  11.651
  198   1HB   LYS  28           HB2      LYS  28   2.513  12.942  12.942
  199   2HB   LYS  28           HB1      LYS  28   2.920  11.270  11.270
  200   1HG   LYS  28           HG2      LYS  28   0.580  10.774  10.774
  201   2HG   LYS  28           HG1      LYS  28   0.140  12.460  12.460
  202   1HD   LYS  28           HD2      LYS  28   0.955  12.259  12.259
  203   2HD   LYS  28           HD1      LYS  28   1.274  10.548  10.548
  204   1HE   LYS  28           HE2      LYS  28  -1.097  10.140  10.140
  205   2HE   LYS  28           HE1      LYS  28  -1.449  11.871  11.871
  206   1HZ   LYS  28           HZ1      LYS  28  -0.209  10.158  10.158
  207   2HZ   LYS  28           HZ3      LYS  28  -1.833  10.649  10.649
  208   3HZ   LYS  28           HZ2      LYS  28  -0.599  11.804  11.804
  209    H    ALA  29           HN       ALA  29   4.357  10.946  10.946
  210    HA   ALA  29           HA       ALA  29   6.387  13.123  13.123
  211   1HB   ALA  29           HB1      ALA  29   5.690  11.435  11.435
  212   2HB   ALA  29           HB3      ALA  29   7.117  12.466  12.466
  213   3HB   ALA  29           HB2      ALA  29   5.506  13.182  13.182
  214    H    THR  30           HN       THR  30   8.636  12.141  12.141
  215    HA   THR  30           HA       THR  30   8.981   9.708   9.708
  216    HB   THR  30           HB       THR  30  11.420  10.257  10.257
  217    HG1  THR  30           HG1      THR  30  11.738  12.028  12.028
  218   1HG2  THR  30          HG23      THR  30   9.621  11.569  11.569
  219   2HG2  THR  30          HG22      THR  30  11.093  12.469  12.469
  220   3HG2  THR  30          HG21      THR  30  11.200  10.816  10.816
  221    H    GLU  31           HN       GLU  31   8.533  10.245  10.245
  222    HA   GLU  31           HA       GLU  31  10.113   7.744   7.744
  223   1HB   GLU  31           HB2      GLU  31   9.728  10.223  10.223
  224   2HB   GLU  31           HB1      GLU  31  10.680   8.824   8.824
  225   1HG   GLU  31           HG2      GLU  31  11.402  10.018  10.018
  226   2HG   GLU  31           HG1      GLU  31  11.711  11.035  11.035
  227    H    VAL  32           HN       VAL  32   7.879   6.696   6.696
  228    HA   VAL  32           HA       VAL  32   6.058   7.084   7.084
  229    HB   VAL  32           HB       VAL  32   5.973   5.337   5.337
  230   1HG1  VAL  32          HG13      VAL  32   4.303   5.435   5.435
  231   2HG1  VAL  32          HG12      VAL  32   3.399   5.469   5.469
  232   3HG1  VAL  32          HG11      VAL  32   4.499   4.134   4.134
  233   1HG2  VAL  32          HG23      VAL  32   5.739   7.890   7.890
  234   2HG2  VAL  32          HG22      VAL  32   4.440   6.922   6.922
  235   3HG2  VAL  32          HG21      VAL  32   4.217   7.698   7.698
  236    H    ARG  33           HN       ARG  33   7.610   6.317   6.317
  237    HA   ARG  33           HA       ARG  33   9.099   3.904   3.904
  238   1HB   ARG  33           HB2      ARG  33   9.394   5.854   5.854
  239   2HB   ARG  33           HB1      ARG  33   8.013   5.240   5.240
  240   1HG   ARG  33           HG2      ARG  33   9.160   3.155   3.155
  241   2HG   ARG  33           HG1      ARG  33  10.494   3.607   3.607
  242   1HD   ARG  33           HD2      ARG  33   9.927   5.606   5.606
  243   2HD   ARG  33           HD1      ARG  33  10.479   4.039   4.039
  244    HE   ARG  33           HE       ARG  33  12.044   5.876   5.876
  245   1HH1  ARG  33          HH21      ARG  33  11.608   2.556   2.556
  246   2HH1  ARG  33          HH22      ARG  33  13.249   2.134   2.134
  247   1HH2  ARG  33          HH11      ARG  33  14.159   5.281   5.281
  248   2HH2  ARG  33          HH12      ARG  33  14.679   3.656   3.656
  249    H    VAL  34           HN       VAL  34   8.409   1.836   1.836
  250    HA   VAL  34           HA       VAL  34   5.921   1.175   1.175
  251    HB   VAL  34           HB       VAL  34   5.502  -0.493  -0.493
  252   1HG1  VAL  34          HG12      VAL  34   4.789   2.056   2.056
  253   2HG1  VAL  34          HG11      VAL  34   5.849   2.133   2.133
  254   3HG1  VAL  34          HG13      VAL  34   4.463   1.042   1.042
  255   1HG2  VAL  34          HG23      VAL  34   8.144  -0.173  -0.173
  256   2HG2  VAL  34          HG22      VAL  34   6.950  -0.877  -0.877
  257   3HG2  VAL  34          HG21      VAL  34   7.381   0.827   0.827
  258    H    THR  35           HN       THR  35   5.906  -1.096  -1.096
  259    HA   THR  35           HA       THR  35   8.499  -2.525  -2.525
  260    HB   THR  35           HB       THR  35   7.108  -1.534  -1.534
  261    HG1  THR  35           HG1      THR  35   8.856  -0.145  -0.145
  262   1HG2  THR  35          HG21      THR  35   9.624  -3.139  -3.139
  263   2HG2  THR  35          HG23      THR  35   9.286  -2.335  -2.335
  264   3HG2  THR  35          HG22      THR  35   8.215  -3.609  -3.609
  265    H    VAL  36           HN       VAL  36   8.170  -4.725  -4.725
  266    HA   VAL  36           HA       VAL  36   5.368  -5.639  -5.639
  267    HB   VAL  36           HB       VAL  36   7.728  -6.861  -6.861
  268   1HG1  VAL  36          HG11      VAL  36   4.977  -7.884  -7.884
  269   2HG1  VAL  36          HG13      VAL  36   5.745  -8.359  -8.359
  270   3HG1  VAL  36          HG12      VAL  36   6.518  -8.743  -8.743
  271   1HG2  VAL  36          HG22      VAL  36   5.398  -5.182  -5.182
  272   2HG2  VAL  36          HG21      VAL  36   6.998  -5.292  -5.292
  273   3HG2  VAL  36          HG23      VAL  36   5.783  -6.523  -6.523
  274    H    LEU  37           HN       LEU  37   4.997  -6.838  -6.838
  275    HA   LEU  37           HA       LEU  37   7.454  -7.947  -7.947
  276   1HB   LEU  37           HB2      LEU  37   4.927  -6.735  -6.735
  277   2HB   LEU  37           HB1      LEU  37   6.262  -7.384  -7.384
  278    HG   LEU  37           HG       LEU  37   6.845  -5.287  -5.287
  279   1HD1  LEU  37          HD12      LEU  37   4.833  -4.830  -4.830
  280   2HD1  LEU  37          HD11      LEU  37   6.252  -4.295  -4.295
  281   3HD1  LEU  37          HD13      LEU  37   5.883  -3.575  -3.575
  282   1HD2  LEU  37          HD23      LEU  37   8.184  -6.634  -6.634
  283   2HD2  LEU  37          HD22      LEU  37   8.863  -5.535  -5.535
  284   3HD2  LEU  37          HD21      LEU  37   8.173  -4.892  -4.892
  285    H    ARG  38           HN       ARG  38   6.968  -9.732  -9.732
  286    HA   ARG  38           HA       ARG  38   4.552 -11.331 -11.331
  287   1HB   ARG  38           HB2      ARG  38   6.636 -12.143 -12.143
  288   2HB   ARG  38           HB1      ARG  38   7.395 -12.288 -12.288
  289   1HG   ARG  38           HG2      ARG  38   5.663 -13.915 -13.915
  290   2HG   ARG  38           HG1      ARG  38   4.917 -13.778 -13.778
  291   1HD   ARG  38           HD2      ARG  38   6.370 -15.764 -15.764
  292   2HD   ARG  38           HD1      ARG  38   7.082 -14.552 -14.552
  293    HE   ARG  38           HE       ARG  38   7.983 -14.186 -14.186
  294   1HH1  ARG  38          HH21      ARG  38   8.490 -16.083 -16.083
  295   2HH1  ARG  38          HH22      ARG  38  10.130 -16.446 -16.446
  296   1HH2  ARG  38          HH11      ARG  38  10.108 -14.681 -14.681
  297   2HH2  ARG  38          HH12      ARG  38  11.039 -15.662 -15.662
  298    H    GLN  39           HN       GLN  39   3.327 -11.643 -11.643
  299    HA   GLN  39           HA       GLN  39   4.700 -11.450 -11.450
  300   1HB   GLN  39           HB2      GLN  39   1.849 -11.125 -11.125
  301   2HB   GLN  39           HB1      GLN  39   2.270 -11.169 -11.169
  302   1HG   GLN  39           HG2      GLN  39   3.772  -9.260  -9.260
  303   2HG   GLN  39           HG1      GLN  39   3.432  -9.233  -9.233
  304   1HE2  GLN  39          HE22      GLN  39   0.046  -7.990  -7.990
  305   2HE2  GLN  39          HE21      GLN  39   0.900  -9.083  -9.083
  306    H    ALA  40           HN       ALA  40   4.875 -13.194 -13.194
  307    HA   ALA  40           HA       ALA  40   3.665 -15.768 -15.768
  308   1HB   ALA  40           HB3      ALA  40   6.196 -15.013 -15.013
  309   2HB   ALA  40           HB2      ALA  40   5.568 -15.654 -15.654
  310   3HB   ALA  40           HB1      ALA  40   5.599 -16.672 -16.672
  311    H    ASP  41           HN       ASP  41   3.396 -17.200 -17.200
  312    HA   ASP  41           HA       ASP  41   1.026 -16.275 -16.275
  313   1HB   ASP  41           HB2      ASP  41   3.099 -18.329 -18.329
  314   2HB   ASP  41           HB1      ASP  41   1.615 -18.150 -18.150
  315    H    SER  42           HN       SER  42   4.406 -16.226 -16.226
  316    HA   SER  42           HA       SER  42   3.547 -14.217 -14.217
  317   1HB   SER  42           HB2      SER  42   5.506 -16.515 -16.515
  318   2HB   SER  42           HB1      SER  42   5.162 -15.337 -15.337
  319    HG   SER  42           HG       SER  42   3.397 -17.214 -17.214
  320    H    GLN  43           HN       GLN  43   5.561 -14.742 -14.742
  321    HA   GLN  43           HA       GLN  43   7.395 -12.551 -12.551
  322   1HB   GLN  43           HB2      GLN  43   7.992 -15.150 -15.150
  323   2HB   GLN  43           HB1      GLN  43   9.150 -13.822 -13.822
  324   1HG   GLN  43           HG2      GLN  43   9.103 -13.908 -13.908
  325   2HG   GLN  43           HG1      GLN  43   7.865 -15.164 -15.164
  326   1HE2  GLN  43          HE22      GLN  43  11.638 -16.215 -16.215
  327   2HE2  GLN  43          HE21      GLN  43  11.081 -14.638 -14.638
  328    H    VAL  44           HN       VAL  44   8.124 -11.150 -11.150
  329    HA   VAL  44           HA       VAL  44   6.806 -11.467 -11.467
  330    HB   VAL  44           HB       VAL  44   6.916  -9.008  -9.008
  331   1HG1  VAL  44          HG12      VAL  44   5.716  -9.389  -9.389
  332   2HG1  VAL  44          HG11      VAL  44   5.549  -7.940  -7.940
  333   3HG1  VAL  44          HG13      VAL  44   7.135  -8.414  -8.414
  334   1HG2  VAL  44          HG21      VAL  44   5.244 -10.769 -10.769
  335   2HG2  VAL  44          HG23      VAL  44   4.497  -9.252  -9.252
  336   3HG2  VAL  44          HG22      VAL  44   4.540 -10.620 -10.620
  337    H    THR  45           HN       THR  45   8.151 -10.905 -10.905
  338    HA   THR  45           HA       THR  45  10.705  -9.462  -9.462
  339    HB   THR  45           HB       THR  45  11.870 -11.164 -11.164
  340    HG1  THR  45           HG1      THR  45  10.559 -12.168 -12.168
  341   1HG2  THR  45          HG23      THR  45  11.380 -11.395 -11.395
  342   2HG2  THR  45          HG22      THR  45  10.264 -12.667 -12.667
  343   3HG2  THR  45          HG21      THR  45  11.982 -12.802 -12.802
  344    H    GLU  46           HN       GLU  46  11.725  -8.576  -8.576
  345    HA   GLU  46           HA       GLU  46   9.735  -7.434  -7.434
  346   1HB   GLU  46           HB2      GLU  46  12.746  -7.266  -7.266
  347   2HB   GLU  46           HB1      GLU  46  11.845  -6.354  -6.354
  348   1HG   GLU  46           HG2      GLU  46  10.539  -5.251  -5.251
  349   2HG   GLU  46           HG1      GLU  46  11.332  -6.221  -6.221
  350    H    VAL  47           HN       VAL  47   9.748  -7.721  -7.721
  351    HA   VAL  47           HA       VAL  47  11.003 -10.294 -10.294
  352    HB   VAL  47           HB       VAL  47   8.361  -8.974  -8.974
  353   1HG1  VAL  47          HG12      VAL  47   9.863 -11.242 -11.242
  354   2HG1  VAL  47          HG11      VAL  47   8.122 -11.446 -11.446
  355   3HG1  VAL  47          HG13      VAL  47   8.746 -10.105 -10.105
  356   1HG2  VAL  47          HG21      VAL  47   8.931 -10.345 -10.345
  357   2HG2  VAL  47          HG23      VAL  47   7.360 -10.443 -10.443
  358   3HG2  VAL  47          HG22      VAL  47   8.567 -11.699 -11.699
  359    H    CYS  48           HN       CYS  48   9.752  -7.154  -7.154
  360    HA   CYS  48           HA       CYS  48  12.141  -6.880  -6.880
  361   1HB   CYS  48           HB2      CYS  48   9.490  -6.753  -6.753
  362   2HB   CYS  48           HB1      CYS  48  11.057  -7.257  -7.257
  363    H    ALA  49           HN       ALA  49  12.642  -4.721  -4.721
  364    HA   ALA  49           HA       ALA  49  10.439  -2.726  -2.726
  365   1HB   ALA  49           HB1      ALA  49  12.413  -3.524  -3.524
  366   2HB   ALA  49           HB3      ALA  49  12.835  -1.893  -1.893
  367   3HB   ALA  49           HB2      ALA  49  11.241  -2.213  -2.213
  368    H    ALA  50           HN       ALA  50  10.671  -0.920  -0.920
  369    HA   ALA  50           HA       ALA  50  13.219   0.028   0.028
  370   1HB   ALA  50           HB2      ALA  50  11.405  -1.757  -1.757
  371   2HB   ALA  50           HB1      ALA  50  12.363  -0.526  -0.526
  372   3HB   ALA  50           HB3      ALA  50  13.164  -1.786  -1.786
  373    H    THR  51           HN       THR  51  12.895   2.030   2.030
  374    HA   THR  51           HA       THR  51  10.308   3.338   3.338
  375    HB   THR  51           HB       THR  51  12.667   4.596   4.596
  376    HG1  THR  51           HG1      THR  51  13.753   3.857   3.857
  377   1HG2  THR  51          HG21      THR  51  10.260   5.460   5.460
  378   2HG2  THR  51          HG23      THR  51  11.736   6.309   6.309
  379   3HG2  THR  51          HG22      THR  51  11.211   6.305   6.305
  380    H    TYR  52           HN       TYR  52   8.685   3.409   3.409
  381    HA   TYR  52           HA       TYR  52   9.138   2.430   2.430
  382   1HB   TYR  52           HB2      TYR  52   6.966   2.077   2.077
  383   2HB   TYR  52           HB1      TYR  52   6.901   3.622   3.622
  384    HD1  TYR  52           HD2      TYR  52   7.910   3.317   3.317
  385    HD2  TYR  52           HD1      TYR  52   4.728   4.261   4.261
  386    HE1  TYR  52           HE2      TYR  52   6.555   4.275   4.275
  387    HE2  TYR  52           HE1      TYR  52   3.386   5.233   5.233
  388    HH   TYR  52           HH       TYR  52   4.439   6.252   6.252
  389    H    MET  53           HN       MET  53  10.821   3.751   3.751
  390    HA   MET  53           HA       MET  53  10.350   6.660   6.660
  391   1HB   MET  53           HB2      MET  53  12.527   4.884   4.884
  392   2HB   MET  53           HB1      MET  53  12.578   6.644   6.644
  393   1HG   MET  53           HG2      MET  53  12.629   4.598   4.598
  394   2HG   MET  53           HG1      MET  53  13.874   5.777   5.777
  395   1HE   MET  53           HE1      MET  53  13.536   7.981   7.981
  396   2HE   MET  53           HE3      MET  53  12.499   9.093   9.093
  397   3HE   MET  53           HE2      MET  53  13.863   8.294   8.294
  398    H    MET  54           HN       MET  54   9.099   7.353   7.353
  399    HA   MET  54           HA       MET  54   8.026   5.553   5.553
  400   1HB   MET  54           HB2      MET  54   8.432   8.564   8.564
  401   2HB   MET  54           HB1      MET  54   7.479   7.741   7.741
  402   1HG   MET  54           HG2      MET  54   5.769   8.107   8.107
  403   2HG   MET  54           HG1      MET  54   6.396   6.642   6.642
  404   1HE   MET  54           HE3      MET  54   6.959   6.343   6.343
  405   2HE   MET  54           HE2      MET  54   7.120   7.495   7.495
  406   3HE   MET  54           HE1      MET  54   5.553   7.263   7.263
  407    H    GLY  55           HN       GLY  55  11.037   7.373   7.373
  408   1HA   GLY  55           HA2      GLY  55  11.567   6.885   6.885
  409   2HA   GLY  55           HA1      GLY  55  12.655   7.676   7.676
  410    H    ASN  56           HN       ASN  56  12.804   5.637   5.637
  411    HA   ASN  56           HA       ASN  56  14.331   3.558   3.558
  412   1HB   ASN  56           HB2      ASN  56  14.581   4.661   4.661
  413   2HB   ASN  56           HB1      ASN  56  15.602   3.384   3.384
  414   1HD2  ASN  56          HD22      ASN  56  16.680   7.133   7.133
  415   2HD2  ASN  56          HD21      ASN  56  15.676   6.625   6.625
  416    H    GLU  57           HN       GLU  57  14.175   1.367   1.367
  417    HA   GLU  57           HA       GLU  57  11.581   0.507   0.507
  418   1HB   GLU  57           HB2      GLU  57  12.865  -0.601  -0.601
  419   2HB   GLU  57           HB1      GLU  57  14.113  -1.034  -1.034
  420   1HG   GLU  57           HG2      GLU  57  12.508  -2.362  -2.362
  421   2HG   GLU  57           HG1      GLU  57  11.204  -1.868  -1.868
  422    H    LEU  58           HN       LEU  58  11.222  -0.670  -0.670
  423    HA   LEU  58           HA       LEU  58  12.803   0.131   0.131
  424   1HB   LEU  58           HB2      LEU  58  10.568  -1.863  -1.863
  425   2HB   LEU  58           HB1      LEU  58  11.207  -1.497  -1.497
  426    HG   LEU  58           HG       LEU  58  10.782   1.018   1.018
  427   1HD1  LEU  58          HD11      LEU  58   8.998  -0.821  -0.821
  428   2HD1  LEU  58          HD13      LEU  58   8.352   0.729   0.729
  429   3HD1  LEU  58          HD12      LEU  58   9.769   0.681   0.681
  430   1HD2  LEU  58          HD22      LEU  58   8.782  -0.873  -0.873
  431   2HD2  LEU  58          HD21      LEU  58   9.933   0.171   0.171
  432   3HD2  LEU  58          HD23      LEU  58   8.582   0.879   0.879
  433    H    THR  59           HN       THR  59  14.441  -1.006  -1.006
  434    HA   THR  59           HA       THR  59  15.183  -3.678  -3.678
  435    HB   THR  59           HB       THR  59  17.451  -2.881  -2.881
  436    HG1  THR  59           HG1      THR  59  17.660  -1.104  -1.104
  437   1HG2  THR  59          HG22      THR  59  16.234  -2.450  -2.450
  438   2HG2  THR  59          HG21      THR  59  16.258  -0.771  -0.771
  439   3HG2  THR  59          HG23      THR  59  17.771  -1.654  -1.654
  440    H    PHE  60           HN       PHE  60  15.507  -5.322  -5.322
  441    HA   PHE  60           HA       PHE  60  15.018  -4.685  -4.685
  442   1HB   PHE  60           HB2      PHE  60  14.789  -7.254  -7.254
  443   2HB   PHE  60           HB1      PHE  60  14.352  -7.078  -7.078
  444    HD1  PHE  60           HD1      PHE  60  12.630  -5.139  -5.139
  445    HD2  PHE  60           HD2      PHE  60  13.157  -6.896  -6.896
  446    HE1  PHE  60           HE1      PHE  60  10.360  -4.322  -4.322
  447    HE2  PHE  60           HE2      PHE  60  10.890  -6.081  -6.081
  448    HZ   PHE  60           HZ       PHE  60   9.492  -4.794  -4.794
  449    H    LEU  61           HN       LEU  61  16.985  -4.501  -4.501
  450    HA   LEU  61           HA       LEU  61  19.459  -5.594  -5.594
  451   1HB   LEU  61           HB2      LEU  61  19.165  -3.590  -3.590
  452   2HB   LEU  61           HB1      LEU  61  18.687  -4.646  -4.646
  453    HG   LEU  61           HG       LEU  61  21.270  -5.210  -5.210
  454   1HD1  LEU  61          HD11      LEU  61  20.759  -2.956  -2.956
  455   2HD1  LEU  61          HD13      LEU  61  22.358  -3.662  -3.662
  456   3HD1  LEU  61          HD12      LEU  61  21.539  -2.864  -2.864
  457   1HD2  LEU  61          HD23      LEU  61  20.004  -5.653  -5.653
  458   2HD2  LEU  61          HD22      LEU  61  20.865  -6.796  -6.796
  459   3HD2  LEU  61          HD21      LEU  61  21.764  -5.596  -5.596
  460    H    ASP  62           HN       ASP  62  17.289  -6.699  -6.699
  461    HA   ASP  62           HA       ASP  62  18.604  -9.378  -9.378
  462   1HB   ASP  62           HB2      ASP  62  18.884  -9.373  -9.373
  463   2HB   ASP  62           HB1      ASP  62  19.702  -7.985  -7.985
  464    H    ASP  63           HN       ASP  63  17.258 -10.460 -10.460
  465    HA   ASP  63           HA       ASP  63  15.247 -11.535 -11.535
  466   1HB   ASP  63           HB2      ASP  63  14.200  -8.878  -8.878
  467   2HB   ASP  63           HB1      ASP  63  13.239 -10.048 -10.048
  468    H    SER  64           HN       SER  64  16.192 -12.566 -12.566
  469    HA   SER  64           HA       SER  64  15.653 -13.741 -13.741
  470   1HB   SER  64           HB2      SER  64  13.527 -14.711 -14.711
  471   2HB   SER  64           HB1      SER  64  13.726 -14.203 -14.203
  472    HG   SER  64           HG       SER  64  11.897 -13.439 -13.439
  473    H    ILE  67           HN       ILE  67  14.545 -13.513 -13.513
  474    HA   ILE  67           HA       ILE  67  14.707 -10.724 -10.724
  475    HB   ILE  67           HB       ILE  67  14.241 -13.376 -13.376
  476   1HG1  ILE  67          HG12      ILE  67  16.674 -11.572 -11.572
  477   2HG1  ILE  67          HG11      ILE  67  16.435 -13.042 -13.042
  478   1HG2  ILE  67          HG23      ILE  67  14.768 -10.604 -10.604
  479   2HG2  ILE  67          HG22      ILE  67  14.860 -12.094 -12.094
  480   3HG2  ILE  67          HG21      ILE  67  13.320 -11.580 -11.580
  481   1HD1  ILE  67          HD13      ILE  67  16.158 -14.268 -14.268
  482   2HD1  ILE  67          HD12      ILE  67  16.719 -12.798 -12.798
  483   3HD1  ILE  67          HD11      ILE  67  17.780 -13.657 -13.657
  484    H    CYS  68           HN       CYS  68  12.959  -9.432  -9.432
  485    HA   CYS  68           HA       CYS  68  10.233 -10.687 -10.687
  486   1HB   CYS  68           HB2      CYS  68  11.107  -8.143  -8.143
  487   2HB   CYS  68           HB1      CYS  68   9.450  -8.736  -8.736
  488    H    THR  69           HN       THR  69   8.674  -9.185  -9.185
  489    HA   THR  69           HA       THR  69   9.999  -7.200  -7.200
  490    HB   THR  69           HB       THR  69   9.809  -9.342  -9.342
  491    HG1  THR  69           HG1      THR  69   8.972  -8.455  -8.455
  492   1HG2  THR  69          HG21      THR  69   6.974  -9.190  -9.190
  493   2HG2  THR  69          HG23      THR  69   7.364 -10.089 -10.089
  494   3HG2  THR  69          HG22      THR  69   8.102 -10.541 -10.541
  495    H    GLY  70           HN       GLY  70   8.704  -5.368  -5.368
  496   1HA   GLY  70           HA2      GLY  70   5.865  -5.446  -5.446
  497   2HA   GLY  70           HA1      GLY  70   6.923  -4.368  -4.368
  498    H    THR  71           HN       THR  71   4.661  -3.644  -3.644
  499    HA   THR  71           HA       THR  71   6.003  -1.757  -1.757
  500    HB   THR  71           HB       THR  71   3.546  -3.396  -3.396
  501    HG1  THR  71           HG1      THR  71   6.204  -3.645  -3.645
  502   1HG2  THR  71          HG22      THR  71   4.465  -1.029  -1.029
  503   2HG2  THR  71          HG21      THR  71   4.733  -2.343  -2.343
  504   3HG2  THR  71          HG23      THR  71   3.121  -2.056  -2.056
  505    H    SER  72           HN       SER  72   4.667   0.179   0.179
  506    HA   SER  72           HA       SER  72   2.285   0.462   0.462
  507   1HB   SER  72           HB2      SER  72   4.390   1.062   1.062
  508   2HB   SER  72           HB1      SER  72   4.648   2.351   2.351
  509    HG   SER  72           HG       SER  72   2.527   3.115   3.115
  510    H    SER  73           HN       SER  73   0.819   1.036   1.036
  511    HA   SER  73           HA       SER  73   1.333   3.530   3.530
  512   1HB   SER  73           HB2      SER  73   2.108   1.648   1.648
  513   2HB   SER  73           HB1      SER  73   0.550   0.850   0.850
  514    HG   SER  73           HG       SER  73   1.288   2.885   2.885
  515    H    GLY  74           HN       GLY  74  -0.631   4.618   4.618
  516   1HA   GLY  74           HA2      GLY  74  -2.906   5.171   5.171
  517   2HA   GLY  74           HA1      GLY  74  -3.236   3.439   3.439
  518    H    ASN  75           HN       ASN  75  -1.256   5.124   5.124
  519    HA   ASN  75           HA       ASN  75  -1.427   5.230   5.230
  520   1HB   ASN  75           HB2      ASN  75  -4.335   5.304   5.304
  521   2HB   ASN  75           HB1      ASN  75  -3.821   5.562   5.562
  522   1HD2  ASN  75          HD22      ASN  75  -2.235   8.722   8.722
  523   2HD2  ASN  75          HD21      ASN  75  -2.093   7.364   7.364
  524    H    GLN  76           HN       GLN  76  -1.418   2.575   2.575
  525    HA   GLN  76           HA       GLN  76  -2.505   0.924   0.924
  526   1HB   GLN  76           HB2      GLN  76  -2.683   0.556   0.556
  527   2HB   GLN  76           HB1      GLN  76  -3.000  -0.757  -0.757
  528   1HG   GLN  76           HG2      GLN  76  -4.785   0.526   0.526
  529   2HG   GLN  76           HG1      GLN  76  -4.435   1.912   1.912
  530   1HE2  GLN  76          HE21      GLN  76  -5.015  -1.627  -1.627
  531   2HE2  GLN  76          HE22      GLN  76  -6.083  -1.410  -1.410
  532    H    VAL  77           HN       VAL  77  -0.881  -0.368  -0.368
  533    HA   VAL  77           HA       VAL  77   1.611  -0.650  -0.650
  534    HB   VAL  77           HB       VAL  77   2.710  -0.773  -0.773
  535   1HG1  VAL  77          HG13      VAL  77   1.190   1.411   1.411
  536   2HG1  VAL  77          HG12      VAL  77   0.679   1.063   1.063
  537   3HG1  VAL  77          HG11      VAL  77   2.385   1.345   1.345
  538   1HG2  VAL  77          HG21      VAL  77   0.098  -1.700  -1.700
  539   2HG2  VAL  77          HG23      VAL  77   1.724  -2.249  -2.249
  540   3HG2  VAL  77          HG22      VAL  77   1.089  -0.756  -0.756
  541    H    ASN  78           HN       ASN  78   1.946  -2.593  -2.593
  542    HA   ASN  78           HA       ASN  78   0.449  -4.977  -4.977
  543   1HB   ASN  78           HB2      ASN  78   0.345  -4.135  -4.135
  544   2HB   ASN  78           HB1      ASN  78   2.054  -4.543  -4.543
  545    HD2  ASN  78          HD22      ASN  78  -0.582  -6.161  -6.161
  546    H    LEU  79           HN       LEU  79   1.623  -6.121  -6.121
  547    HA   LEU  79           HA       LEU  79   4.580  -6.430  -6.430
  548   1HB   LEU  79           HB2      LEU  79   2.656  -6.877  -6.877
  549   2HB   LEU  79           HB1      LEU  79   4.360  -7.316  -7.316
  550    HG   LEU  79           HG       LEU  79   3.379  -4.516  -4.516
  551   1HD1  LEU  79          HD12      LEU  79   3.903  -5.928  -5.928
  552   2HD1  LEU  79          HD11      LEU  79   4.472  -4.265  -4.265
  553   3HD1  LEU  79          HD13      LEU  79   2.761  -4.634  -4.634
  554   1HD2  LEU  79          HD21      LEU  79   6.090  -5.682  -5.682
  555   2HD2  LEU  79          HD23      LEU  79   5.625  -5.001  -5.001
  556   3HD2  LEU  79          HD22      LEU  79   5.752  -3.956  -3.956
  557    H    THR  80           HN       THR  80   5.362  -8.434  -8.434
  558    HA   THR  80           HA       THR  80   3.499 -10.777 -10.777
  559    HB   THR  80           HB       THR  80   5.297  -9.912  -9.912
  560    HG1  THR  80           HG1      THR  80   3.535  -8.689  -8.689
  561   1HG2  THR  80          HG22      THR  80   3.632 -12.363 -12.363
  562   2HG2  THR  80          HG21      THR  80   3.898 -11.786 -11.786
  563   3HG2  THR  80          HG23      THR  80   5.271 -12.249 -12.249
  564    H    ILE  81           HN       ILE  81   4.498 -12.804 -12.804
  565    HA   ILE  81           HA       ILE  81   7.416 -12.773 -12.773
  566    HB   ILE  81           HB       ILE  81   5.030 -14.230 -14.230
  567   1HG1  ILE  81          HG12      ILE  81   6.862 -12.296 -12.296
  568   2HG1  ILE  81          HG11      ILE  81   5.472 -11.719 -11.719
  569   1HG2  ILE  81          HG22      ILE  81   7.087 -15.628 -15.628
  570   2HG2  ILE  81          HG21      ILE  81   7.948 -14.316 -14.316
  571   3HG2  ILE  81          HG23      ILE  81   6.610 -15.131 -15.131
  572   1HD1  ILE  81          HD13      ILE  81   4.212 -13.617 -13.617
  573   2HD1  ILE  81          HD12      ILE  81   5.537 -13.346 -13.346
  574   3HD1  ILE  81          HD11      ILE  81   4.470 -12.013 -12.013
  575    H    GLN  82           HN       GLN  82   8.621 -14.531 -14.531
  576    HA   GLN  82           HA       GLN  82   7.094 -16.589 -16.589
  577   1HB   GLN  82           HB2      GLN  82   9.823 -15.359 -15.359
  578   2HB   GLN  82           HB1      GLN  82   9.155 -16.715 -16.715
  579   1HG   GLN  82           HG2      GLN  82   7.648 -15.412 -15.412
  580   2HG   GLN  82           HG1      GLN  82   7.455 -14.281 -14.281
  581   1HE2  GLN  82          HE22      GLN  82   9.951 -13.324 -13.324
  582   2HE2  GLN  82          HE21      GLN  82   8.788 -14.555 -14.555
  583    H    GLY  83           HN       GLY  83   7.284 -18.544 -18.544
  584   1HA   GLY  83           HA2      GLY  83   8.791 -20.427 -20.427
  585   2HA   GLY  83           HA1      GLY  83   9.815 -19.257 -19.257
  586    H    LEU  84           HN       LEU  84   6.271 -19.555 -19.555
  587    HA   LEU  84           HA       LEU  84   6.411 -19.561 -19.561
  588   1HB   LEU  84           HB2      LEU  84   4.211 -19.422 -19.422
  589   2HB   LEU  84           HB1      LEU  84   3.895 -19.416 -19.416
  590    HG   LEU  84           HG       LEU  84   5.784 -17.461 -17.461
  591   1HD1  LEU  84          HD12      LEU  84   2.840 -17.158 -17.158
  592   2HD1  LEU  84          HD11      LEU  84   3.905 -15.837 -15.837
  593   3HD1  LEU  84          HD13      LEU  84   3.556 -17.144 -17.144
  594   1HD2  LEU  84          HD23      LEU  84   4.681 -17.943 -17.943
  595   2HD2  LEU  84          HD22      LEU  84   6.261 -17.323 -17.323
  596   3HD2  LEU  84          HD21      LEU  84   4.854 -16.261 -16.261
  597    H    ARG  85           HN       ARG  85   6.203 -21.351 -21.351
  598    HA   ARG  85           HA       ARG  85   5.225 -23.890 -23.890
  599   1HB   ARG  85           HB2      ARG  85   7.184 -23.361 -23.361
  600   2HB   ARG  85           HB1      ARG  85   6.720 -24.961 -24.961
  601   1HG   ARG  85           HG2      ARG  85   7.502 -24.169 -24.169
  602   2HG   ARG  85           HG1      ARG  85   8.267 -22.823 -22.823
  603   1HD   ARG  85           HD2      ARG  85   9.504 -24.457 -24.457
  604   2HD   ARG  85           HD1      ARG  85   8.803 -25.777 -25.777
  605    HE   ARG  85           HE       ARG  85  10.877 -23.913 -23.913
  606   1HH1  ARG  85          HH21      ARG  85   8.303 -26.072 -26.072
  607   2HH1  ARG  85          HH22      ARG  85   8.983 -26.329 -26.329
  608   1HH2  ARG  85          HH11      ARG  85  11.716 -24.273 -24.273
  609   2HH2  ARG  85          HH12      ARG  85  10.892 -25.322 -25.322
  610    H    ALA  86           HN       ALA  86   4.461 -25.396 -25.396
  611    HA   ALA  86           HA       ALA  86   2.101 -24.245 -24.245
  612   1HB   ALA  86           HB3      ALA  86   2.758 -26.694 -26.694
  613   2HB   ALA  86           HB2      ALA  86   3.688 -26.572 -26.572
  614   3HB   ALA  86           HB1      ALA  86   1.939 -26.348 -26.348
  615    H    MET  87           HN       MET  87   5.363 -24.660 -24.660
  616    HA   MET  87           HA       MET  87   4.794 -23.797 -23.797
  617   1HB   MET  87           HB2      MET  87   6.763 -25.114 -25.114
  618   2HB   MET  87           HB1      MET  87   7.355 -23.693 -23.693
  619   1HG   MET  87           HG2      MET  87   7.396 -22.444 -22.444
  620   2HG   MET  87           HG1      MET  87   6.909 -23.921 -23.921
  621   1HE   MET  87           HE1      MET  87   9.130 -22.102 -22.102
  622   2HE   MET  87           HE3      MET  87  10.783 -22.624 -22.624
  623   3HE   MET  87           HE2      MET  87   9.822 -23.480 -23.480
  624    H    ASP  88           HN       ASP  88   5.777 -22.061 -22.061
  625    HA   ASP  88           HA       ASP  88   6.401 -19.543 -19.543
  626   1HB   ASP  88           HB2      ASP  88   5.393 -20.282 -20.282
  627   2HB   ASP  88           HB1      ASP  88   6.075 -18.713 -18.713
  628    H    THR  89           HN       THR  89   3.319 -21.038 -21.038
  629    HA   THR  89           HA       THR  89   1.557 -18.949 -18.949
  630    HB   THR  89           HB       THR  89   1.166 -21.218 -21.218
  631    HG1  THR  89           HG1      THR  89   1.422 -22.477 -22.477
  632   1HG2  THR  89          HG23      THR  89  -0.567 -19.204 -19.204
  633   2HG2  THR  89          HG22      THR  89  -1.006 -20.666 -20.666
  634   3HG2  THR  89          HG21      THR  89  -1.010 -20.666 -20.666
  635    H    GLY  90           HN       GLY  90   0.622 -17.385 -17.385
  636   1HA   GLY  90           HA2      GLY  90   0.410 -17.179 -17.179
  637   2HA   GLY  90           HA1      GLY  90   2.072 -16.675 -16.675
  638    H    LEU  91           HN       LEU  91   1.207 -14.574 -14.574
  639    HA   LEU  91           HA       LEU  91  -0.522 -13.038 -13.038
  640   1HB   LEU  91           HB2      LEU  91  -0.972 -13.172 -13.172
  641   2HB   LEU  91           HB1      LEU  91   0.585 -12.400 -12.400
  642    HG   LEU  91           HG       LEU  91  -0.233 -10.508 -10.508
  643   1HD1  LEU  91          HD13      LEU  91  -2.852 -11.926 -11.926
  644   2HD1  LEU  91          HD12      LEU  91  -2.705 -10.308 -10.308
  645   3HD1  LEU  91          HD11      LEU  91  -2.099 -11.706 -11.706
  646   1HD2  LEU  91          HD21      LEU  91  -0.237 -10.706 -10.706
  647   2HD2  LEU  91          HD23      LEU  91  -1.043  -9.350  -9.350
  648   3HD2  LEU  91          HD22      LEU  91  -1.988 -10.725 -10.725
  649    H    TYR  92           HN       TYR  92   0.229 -11.494 -11.494
  650    HA   TYR  92           HA       TYR  92   3.023 -10.481 -10.481
  651   1HB   TYR  92           HB2      TYR  92   1.286 -10.932 -10.932
  652   2HB   TYR  92           HB1      TYR  92   2.812 -10.047 -10.047
  653    HD1  TYR  92           HD2      TYR  92   1.239 -13.365 -13.365
  654    HD2  TYR  92           HD1      TYR  92   4.959 -11.166 -11.166
  655    HE1  TYR  92           HE2      TYR  92   2.505 -15.520 -15.520
  656    HE2  TYR  92           HE1      TYR  92   6.225 -13.318 -13.318
  657    HH   TYR  92           HH       TYR  92   5.766 -15.699 -15.699
  658    H    ILE  93           HN       ILE  93   3.232  -8.215  -8.215
  659    HA   ILE  93           HA       ILE  93   0.671  -6.669  -6.669
  660    HB   ILE  93           HB       ILE  93   3.393  -6.254  -6.254
  661   1HG1  ILE  93          HG12      ILE  93   1.878  -6.466  -6.466
  662   2HG1  ILE  93          HG11      ILE  93   0.717  -7.210  -7.210
  663   1HG2  ILE  93          HG22      ILE  93   1.161  -4.388  -4.388
  664   2HG2  ILE  93          HG21      ILE  93   1.585  -4.564  -4.564
  665   3HG2  ILE  93          HG23      ILE  93   2.809  -4.062  -4.062
  666   1HD1  ILE  93          HD12      ILE  93   3.561  -8.173  -8.173
  667   2HD1  ILE  93          HD11      ILE  93   2.446  -8.717  -8.717
  668   3HD1  ILE  93          HD13      ILE  93   2.101  -9.053  -9.053
  669    H    CYS  94           HN       CYS  94   0.427  -4.823  -4.823
  670    HA   CYS  94           HA       CYS  94   2.619  -4.115  -4.115
  671   1HB   CYS  94           HB2      CYS  94   0.829  -3.234  -3.234
  672   2HB   CYS  94           HB1      CYS  94   0.261  -4.791  -4.791
  673    H    LYS  95           HN       LYS  95   3.826  -2.435  -2.435
  674    HA   LYS  95           HA       LYS  95   2.468  -0.465  -0.465
  675   1HB   LYS  95           HB2      LYS  95   5.350  -1.179  -1.179
  676   2HB   LYS  95           HB1      LYS  95   4.873   0.160   0.160
  677   1HG   LYS  95           HG2      LYS  95   3.454  -2.212  -2.212
  678   2HG   LYS  95           HG1      LYS  95   5.178  -2.562  -2.562
  679   1HD   LYS  95           HD2      LYS  95   5.741  -0.847  -0.847
  680   2HD   LYS  95           HD1      LYS  95   4.193  -0.038  -0.038
  681   1HE   LYS  95           HE2      LYS  95   3.331  -1.173  -1.173
  682   2HE   LYS  95           HE1      LYS  95   3.747  -2.722  -2.722
  683   1HZ   LYS  95           HZ1      LYS  95   6.133  -2.132  -2.132
  684   2HZ   LYS  95           HZ3      LYS  95   5.403  -1.025  -1.025
  685   3HZ   LYS  95           HZ2      LYS  95   5.062  -2.682  -2.682
  686    H    VAL  96           HN       VAL  96   2.413   1.726   1.726
  687    HA   VAL  96           HA       VAL  96   3.695   2.556   2.556
  688    HB   VAL  96           HB       VAL  96   0.792   2.969   2.969
  689   1HG1  VAL  96          HG12      VAL  96   1.842   4.737   4.737
  690   2HG1  VAL  96          HG11      VAL  96   2.173   3.490   3.490
  691   3HG1  VAL  96          HG13      VAL  96   0.508   3.886   3.886
  692   1HG2  VAL  96          HG23      VAL  96   2.170   0.908   0.908
  693   2HG2  VAL  96          HG22      VAL  96   0.830   0.709   0.709
  694   3HG2  VAL  96          HG21      VAL  96   0.549   1.447   1.447
  695    H    GLU  97           HN       GLU  97   5.060   4.160   4.160
  696    HA   GLU  97           HA       GLU  97   3.746   6.246   6.246
  697   1HB   GLU  97           HB2      GLU  97   6.494   4.994   4.994
  698   2HB   GLU  97           HB1      GLU  97   5.951   6.361   6.361
  699   1HG   GLU  97           HG2      GLU  97   5.443   4.575   4.575
  700   2HG   GLU  97           HG1      GLU  97   3.920   4.733   4.733
  701    H    LEU  98           HN       LEU  98   4.000   8.279   8.279
  702    HA   LEU  98           HA       LEU  98   5.852   8.862   8.862
  703   1HB   LEU  98           HB2      LEU  98   4.101  10.758  10.758
  704   2HB   LEU  98           HB1      LEU  98   4.642  10.966  10.966
  705    HG   LEU  98           HG       LEU  98   2.564   9.041   9.041
  706   1HD1  LEU  98          HD12      LEU  98   2.601  11.422  11.422
  707   2HD1  LEU  98          HD11      LEU  98   1.362  10.186  10.186
  708   3HD1  LEU  98          HD13      LEU  98   1.496  11.036  11.036
  709   1HD2  LEU  98          HD23      LEU  98   4.031   9.013   9.013
  710   2HD2  LEU  98          HD22      LEU  98   3.751   7.676   7.676
  711   3HD2  LEU  98          HD21      LEU  98   2.412   8.325   8.325
  712    H    MET  99           HN       MET  99   7.728   8.270   8.270
  713    HA   MET  99           HA       MET  99   8.155   9.633   9.633
  714   1HB   MET  99           HB2      MET  99   8.912   7.331   7.331
  715   2HB   MET  99           HB1      MET  99  10.139   8.113   8.113
  716   1HG   MET  99           HG2      MET  99  10.976   7.442   7.442
  717   2HG   MET  99           HG1      MET  99  11.136   9.166   9.166
  718   1HE   MET  99           HE3      MET  99   8.555   6.636   6.636
  719   2HE   MET  99           HE2      MET  99   9.284   6.488   6.488
  720   3HE   MET  99           HE1      MET  99   7.686   7.215   7.215
  721    H    TYR 100           HN       TYR 100   9.906   9.811   9.811
  722    HA   TYR 100           HA       TYR 100  11.650  11.942  11.942
  723   1HB   TYR 100           HB2      TYR 100  10.797  10.847  10.847
  724   2HB   TYR 100           HB1      TYR 100  12.065  12.050  12.050
  725    HD1  TYR 100           HD1      TYR 100  11.078   8.528   8.528
  726    HD2  TYR 100           HD2      TYR 100  14.224  11.484  11.484
  727    HE1  TYR 100           HE1      TYR 100  12.714   6.712   6.712
  728    HE2  TYR 100           HE2      TYR 100  15.856   9.666   9.666
  729    HH   TYR 100           HH       TYR 100  15.337   6.951   6.951
  730    HA   PRO 101           HA       PRO 101   8.793  14.995  14.995
  731   1HB   PRO 101           HB2      PRO 101   6.269  14.212  14.212
  732   2HB   PRO 101           HB1      PRO 101   7.678  13.858  13.858
  733   1HG   PRO 101           HG2      PRO 101   6.188  12.078  12.078
  734   2HG   PRO 101           HG1      PRO 101   6.931  11.724  11.724
  735   1HD   PRO 101           HD2      PRO 101   8.042  11.095  11.095
  736   2HD   PRO 101           HD1      PRO 101   8.944  11.255  11.255
  737    HA   PRO 102           HA       PRO 102   6.819  15.539  15.539
  738   1HB   PRO 102           HB2      PRO 102   7.451  18.138  18.138
  739   2HB   PRO 102           HB1      PRO 102   8.625  16.820  16.820
  740   1HG   PRO 102           HG2      PRO 102   8.454  18.707  18.707
  741   2HG   PRO 102           HG1      PRO 102   9.890  17.943  17.943
  742   1HD   PRO 102           HD2      PRO 102   8.581  17.246  17.246
  743   2HD   PRO 102           HD1      PRO 102   9.749  16.282  16.282
  744    HA   PRO 103           HA       PRO 103   5.969  16.475  16.475
  745   1HB   PRO 103           HB2      PRO 103   4.232  16.300  16.300
  746   2HB   PRO 103           HB1      PRO 103   5.308  17.675  17.675
  747   1HG   PRO 103           HG2      PRO 103   2.545  17.854  17.854
  748   2HG   PRO 103           HG1      PRO 103   3.637  18.908  18.908
  749   1HD   PRO 103           HD2      PRO 103   2.778  16.150  16.150
  750   2HD   PRO 103           HD1      PRO 103   2.251  17.672  17.672
  751    H    TYR 104           HN       TYR 104   5.481  14.357  14.357
  752    HA   TYR 104           HA       TYR 104   4.582  12.371  12.371
  753   1HB   TYR 104           HB2      TYR 104   6.580  11.966  11.966
  754   2HB   TYR 104           HB1      TYR 104   5.797  12.402  12.402
  755    HD1  TYR 104           HD1      TYR 104   4.357  10.217  10.217
  756    HD2  TYR 104           HD2      TYR 104   6.163  10.428  10.428
  757    HE1  TYR 104           HE1      TYR 104   3.698   7.856   7.856
  758    HE2  TYR 104           HE2      TYR 104   5.512   8.031   8.031
  759    HH   TYR 104           HH       TYR 104   3.364   6.414   6.414
  760    H    TYR 105           HN       TYR 105   2.542  11.417  11.417
  761    HA   TYR 105           HA       TYR 105   1.013  11.151  11.151
  762   1HB   TYR 105           HB2      TYR 105   0.744  13.510  13.510
  763   2HB   TYR 105           HB1      TYR 105   0.064  12.890  12.890
  764    HD1  TYR 105           HD2      TYR 105  -2.113  11.754  11.754
  765    HD2  TYR 105           HD1      TYR 105  -0.455  13.413  13.413
  766    HE1  TYR 105           HE2      TYR 105  -4.353  11.572  11.572
  767    HE2  TYR 105           HE1      TYR 105  -2.688  13.243  13.243
  768    HH   TYR 105           HH       TYR 105  -4.904  11.485  11.485
  769    H    LEU 106           HN       LEU 106   1.004   8.921   8.921
  770    HA   LEU 106           HA       LEU 106  -0.931   8.259   8.259
  771   1HB   LEU 106           HB2      LEU 106   1.872   8.151   8.151
  772   2HB   LEU 106           HB1      LEU 106   1.380   6.481   6.481
  773    HG   LEU 106           HG       LEU 106   1.378   7.077   7.077
  774   1HD1  LEU 106          HD11      LEU 106  -1.336   6.611   6.611
  775   2HD1  LEU 106          HD13      LEU 106  -1.031   6.477   6.477
  776   3HD1  LEU 106          HD12      LEU 106  -0.208   5.399   5.399
  777   1HD2  LEU 106          HD22      LEU 106   0.697   9.533   9.533
  778   2HD2  LEU 106          HD21      LEU 106   0.239   8.889   8.889
  779   3HD2  LEU 106          HD23      LEU 106  -0.938   8.924   8.924
  780    H    GLY 108           HN       GLY 108  -0.134   5.339   5.339
  781   1HA   GLY 108           HA2      GLY 108  -0.492   4.613   4.613
  782   2HA   GLY 108           HA1      GLY 108  -1.958   4.373   4.373
  783    H    ILE 109           HN       ILE 109  -1.124   2.095   2.095
  784    HA   ILE 109           HA       ILE 109   0.520   0.780   0.780
  785    HB   ILE 109           HB       ILE 109   0.125   0.223   0.223
  786   1HG1  ILE 109          HG12      ILE 109   2.677   0.533   0.533
  787   2HG1  ILE 109          HG11      ILE 109   2.404   1.294   1.294
  788   1HG2  ILE 109          HG23      ILE 109   0.363  -1.834  -1.834
  789   2HG2  ILE 109          HG22      ILE 109   1.926  -1.209  -1.209
  790   3HG2  ILE 109          HG21      ILE 109   1.650  -1.619  -1.619
  791   1HD1  ILE 109          HD11      ILE 109   0.647   2.245   2.245
  792   2HD1  ILE 109          HD13      ILE 109   2.358   2.605   2.605
  793   3HD1  ILE 109          HD12      ILE 109   1.527   3.155   3.155
  794    H    GLY 110           HN       GLY 110  -0.228  -1.460  -1.460
  795   1HA   GLY 110           HA2      GLY 110  -3.170  -1.736  -1.736
  796   2HA   GLY 110           HA1      GLY 110  -2.069  -2.781  -2.781
  797    H    ASN 111           HN       ASN 111  -4.184  -3.440  -3.440
  798    HA   ASN 111           HA       ASN 111  -2.932  -4.227  -4.227
  799   1HB   ASN 111           HB2      ASN 111  -5.346  -5.135  -5.135
  800   2HB   ASN 111           HB1      ASN 111  -4.893  -5.961  -5.961
  801    HD2  ASN 111          HD22      ASN 111  -4.652  -2.684  -2.684
  802    H    GLY 112           HN       GLY 112  -3.130  -5.861  -5.861
  803   1HA   GLY 112           HA2      GLY 112  -1.125  -7.285  -7.285
  804   2HA   GLY 112           HA1      GLY 112  -1.368  -8.013  -8.013
  805    H    THR 113           HN       THR 113  -1.511  -8.914  -8.914
  806    HA   THR 113           HA       THR 113  -4.219 -10.213 -10.213
  807    HB   THR 113           HB       THR 113  -2.098  -9.875  -9.875
  808    HG1  THR 113           HG1      THR 113  -4.571  -8.567  -8.567
  809   1HG2  THR 113          HG23      THR 113  -4.907 -11.011 -11.011
  810   2HG2  THR 113          HG22      THR 113  -3.977 -10.590 -10.590
  811   3HG2  THR 113          HG21      THR 113  -3.402 -11.867 -11.867
  812    H    GLN 114           HN       GLN 114  -4.221 -12.441 -12.441
  813    HA   GLN 114           HA       GLN 114  -1.616 -13.753 -13.753
  814   1HB   GLN 114           HB2      GLN 114  -3.643 -14.002 -14.002
  815   2HB   GLN 114           HB1      GLN 114  -4.395 -14.940 -14.940
  816   1HG   GLN 114           HG2      GLN 114  -2.332 -16.411 -16.411
  817   2HG   GLN 114           HG1      GLN 114  -1.841 -15.578 -15.578
  818   1HE2  GLN 114          HE22      GLN 114  -3.743 -18.650 -18.650
  819   2HE2  GLN 114          HE21      GLN 114  -2.338 -18.349 -18.349
  820    H    ILE 115           HN       ILE 115  -0.613 -14.863 -14.863
  821    HA   ILE 115           HA       ILE 115  -2.106 -15.345 -15.345
  822    HB   ILE 115           HB       ILE 115   0.778 -15.825 -15.825
  823   1HG1  ILE 115          HG12      ILE 115  -0.465 -13.727 -13.727
  824   2HG1  ILE 115          HG11      ILE 115   0.014 -13.449 -13.449
  825   1HG2  ILE 115          HG22      ILE 115  -0.544 -16.069 -16.069
  826   2HG2  ILE 115          HG21      ILE 115   1.199 -16.067 -16.067
  827   3HG2  ILE 115          HG23      ILE 115   0.209 -17.370 -17.370
  828   1HD1  ILE 115          HD13      ILE 115   2.347 -14.205 -14.205
  829   2HD1  ILE 115          HD12      ILE 115   1.805 -14.162 -14.162
  830   3HD1  ILE 115          HD11      ILE 115   1.830 -12.679 -12.679
  831    H    TYR 116           HN       TYR 116  -3.099 -17.269 -17.269
  832    HA   TYR 116           HA       TYR 116  -2.672 -19.593 -19.593
  833   1HB   TYR 116           HB2      TYR 116  -4.721 -18.653 -18.653
  834   2HB   TYR 116           HB1      TYR 116  -4.677 -20.352 -20.352
  835    HD1  TYR 116           HD1      TYR 116  -3.613 -18.812 -18.812
  836    HD2  TYR 116           HD2      TYR 116  -7.172 -19.187 -19.187
  837    HE1  TYR 116           HE1      TYR 116  -5.045 -18.370 -18.370
  838    HE2  TYR 116           HE2      TYR 116  -8.593 -18.754 -18.754
  839    HH   TYR 116           HH       TYR 116  -7.399 -17.497 -17.497
  840    H    VAL 117           HN       VAL 117  -2.391 -21.733 -21.733
  841    HA   VAL 117           HA       VAL 117  -1.001 -21.689 -21.689
  842    HB   VAL 117           HB       VAL 117  -0.766 -23.559 -23.559
  843   1HG1  VAL 117          HG12      VAL 117   0.587 -23.580 -23.580
  844   2HG1  VAL 117          HG11      VAL 117   1.163 -24.516 -24.516
  845   3HG1  VAL 117          HG13      VAL 117  -0.427 -24.846 -24.846
  846   1HG2  VAL 117          HG21      VAL 117   0.281 -21.262 -21.262
  847   2HG2  VAL 117          HG23      VAL 117   1.434 -22.592 -22.592
  848   3HG2  VAL 117          HG22      VAL 117   1.276 -21.679 -21.679
  849    H    ILE 118           HN       ILE 118  -1.340 -23.785 -23.785
  850    HA   ILE 118           HA       ILE 118  -4.212 -24.525 -24.525
  851    HB   ILE 118           HB       ILE 118  -2.002 -24.900 -24.900
  852   1HG1  ILE 118          HG12      ILE 118  -2.425 -22.554 -22.554
  853   2HG1  ILE 118          HG11      ILE 118  -3.248 -23.083 -23.083
  854   1HG2  ILE 118          HG23      ILE 118  -4.057 -26.483 -26.483
  855   2HG2  ILE 118          HG22      ILE 118  -4.948 -25.060 -25.060
  856   3HG2  ILE 118          HG21      ILE 118  -3.602 -25.672 -25.672
  857   1HD1  ILE 118          HD13      ILE 118  -5.190 -23.492 -23.492
  858   2HD1  ILE 118          HD12      ILE 118  -4.374 -22.082 -22.082
  859   3HD1  ILE 118          HD11      ILE 118  -5.043 -22.019 -22.019
  860    H    ASP 119           HN       ASP 119  -4.635 -26.357 -26.357
  861    HA   ASP 119           HA       ASP 119  -2.874 -28.739 -28.739
  862   1HB   ASP 119           HB2      ASP 119  -2.282 -27.496 -27.496
  863   2HB   ASP 119           HB1      ASP 119  -3.946 -27.674 -27.674
  864    HA   PRO 120           HA       PRO 120  -7.047 -30.311 -30.311
  865   1HB   PRO 120           HB2      PRO 120  -6.381 -32.937 -32.937
  866   2HB   PRO 120           HB1      PRO 120  -6.210 -31.686 -31.686
  867   1HG   PRO 120           HG2      PRO 120  -4.142 -32.861 -32.861
  868   2HG   PRO 120           HG1      PRO 120  -4.037 -32.442 -32.442
  869   1HD   PRO 120           HD2      PRO 120  -3.003 -30.876 -30.876
  870   2HD   PRO 120           HD1      PRO 120  -3.641 -30.219 -30.219
  871    H    GLU 121           HN       GLU 121  -8.536 -31.491 -31.491
  872    HA   GLU 121           HA       GLU 121  -7.620 -32.012 -32.012
  873   1HB   GLU 121           HB2      GLU 121 -10.303 -32.054 -32.054
  874   2HB   GLU 121           HB1      GLU 121 -10.106 -32.305 -32.305
  875   1HG   GLU 121           HG2      GLU 121  -9.094 -30.095 -30.095
  876   2HG   GLU 121           HG1      GLU 121  -9.172 -29.842 -29.842
  877    HA   PRO 122           HA       PRO 122  -7.223 -36.384 -36.384
  878   1HB   PRO 122           HB2      PRO 122  -6.914 -37.281 -37.281
  879   2HB   PRO 122           HB1      PRO 122  -5.610 -36.506 -36.506
  880   1HG   PRO 122           HG2      PRO 122  -7.410 -35.343 -35.343
  881   2HG   PRO 122           HG1      PRO 122  -5.674 -35.099 -35.099
  882   1HD   PRO 122           HD2      PRO 122  -7.533 -33.297 -33.297
  883   2HD   PRO 122           HD1      PRO 122  -5.994 -33.534 -33.534
  884    H    CYS 123           HN       CYS 123  -9.720 -34.885 -34.885
  885    HA   CYS 123           HA       CYS 123 -11.236 -37.434 -37.434
  886   1HB   CYS 123           HB2      CYS 123 -10.925 -35.888 -35.888
  887   2HB   CYS 123           HB1      CYS 123 -11.754 -34.623 -34.623
  888    HG   CYS 123           HG       CYS 123 -13.134 -37.237 -37.237
  889    HA   PRO 124           HA       PRO 124 -13.362 -36.071 -36.071
  890   1HB   PRO 124           HB2      PRO 124 -15.170 -38.127 -38.127
  891   2HB   PRO 124           HB1      PRO 124 -13.487 -38.278 -38.278
  892   1HG   PRO 124           HG2      PRO 124 -14.723 -39.137 -39.137
  893   2HG   PRO 124           HG1      PRO 124 -13.545 -39.979 -39.979
  894   1HD   PRO 124           HD2      PRO 124 -12.829 -38.659 -38.659
  895   2HD   PRO 124           HD1      PRO 124 -11.765 -38.771 -38.771
  896    H    ASP 125           HN       ASP 125 -14.748 -36.665 -36.665
  897    HA   ASP 125           HA       ASP 125 -16.949 -34.754 -34.754
  898   1HB   ASP 125           HB2      ASP 125 -18.527 -36.275 -36.275
  899   2HB   ASP 125           HB1      ASP 125 -17.771 -37.074 -37.074
  900    H    SER 126           HN       SER 126 -18.027 -34.011 -34.011
  901    HA   SER 126           HA       SER 126 -15.918 -33.423 -33.423
  902   1HB   SER 126           HB2      SER 126 -17.522 -31.690 -31.690
  903   2HB   SER 126           HB1      SER 126 -17.299 -31.644 -31.644
  904    HG   SER 126           HG       SER 126 -19.468 -31.633 -31.633
  905    H    ASP 127           HN       ASP 127 -16.717 -33.406 -33.406
  906    HA   ASP 127           HA       ASP 127 -17.796 -36.043 -36.043
  907   1HB   ASP 127           HB2      ASP 127 -15.940 -34.775 -34.775
  908   2HB   ASP 127           HB1      ASP 127 -17.168 -33.663 -33.663
  909    H    GLN 128           HN       GLN 128 -19.948 -36.453 -36.453
  910    HA   GLN 128           HA       GLN 128 -21.984 -34.425 -34.425
  911   1HB   GLN 128           HB2      GLN 128 -22.024 -37.311 -37.311
  912   2HB   GLN 128           HB1      GLN 128 -23.466 -36.369 -36.369
  913   1HG   GLN 128           HG2      GLN 128 -21.202 -36.915 -36.915
  914   2HG   GLN 128           HG1      GLN 128 -22.731 -37.794 -37.794
  915   1HE2  GLN 128          HE22      GLN 128 -24.625 -34.922 -34.922
  916   2HE2  GLN 128          HE21      GLN 128 -24.750 -36.207 -36.207
  917    H    GLU 129           HN       GLU 129 -20.532 -36.122 -36.122
  918    HA   GLU 129           HA       GLU 129 -22.229 -34.491 -34.491
  919   1HB   GLU 129           HB2      GLU 129 -22.333 -36.974 -36.974
  920   2HB   GLU 129           HB1      GLU 129 -20.603 -37.010 -37.010
  921   1HG   GLU 129           HG2      GLU 129 -20.942 -35.724 -35.724
  922   2HG   GLU 129           HG1      GLU 129 -22.663 -35.569 -35.569
  923    HA   PRO 130           HA       PRO 130 -18.357 -32.312 -32.312
  924   1HB   PRO 130           HB2      PRO 130 -19.272 -30.639 -30.639
  925   2HB   PRO 130           HB1      PRO 130 -19.578 -30.362 -30.362
  926   1HG   PRO 130           HG2      PRO 130 -21.365 -31.538 -31.538
  927   2HG   PRO 130           HG1      PRO 130 -21.748 -30.416 -30.416
  928   1HD   PRO 130           HD2      PRO 130 -22.288 -33.073 -33.073
  929   2HD   PRO 130           HD1      PRO 130 -21.919 -32.093 -32.093
  930    H    LYS 131           HN       LYS 131 -16.838 -32.153 -32.153
  931    HA   LYS 131           HA       LYS 131 -17.346 -34.259 -34.259
  932   1HB   LYS 131           HB2      LYS 131 -14.837 -33.001 -33.001
  933   2HB   LYS 131           HB1      LYS 131 -14.829 -34.204 -34.204
  934   1HG   LYS 131           HG2      LYS 131 -16.035 -35.782 -35.782
  935   2HG   LYS 131           HG1      LYS 131 -15.966 -34.587 -34.587
  936   1HD   LYS 131           HD2      LYS 131 -13.523 -34.635 -34.635
  937   2HD   LYS 131           HD1      LYS 131 -13.541 -35.749 -35.749
  938   1HE   LYS 131           HE2      LYS 131 -14.929 -36.439 -36.439
  939   2HE   LYS 131           HE1      LYS 131 -13.215 -36.811 -36.811
  940   1HZ   LYS 131           HZ1      LYS 131 -13.864 -37.881 -37.881
  941   2HZ   LYS 131           HZ3      LYS 131 -15.496 -37.633 -37.633
  942   3HZ   LYS 131           HZ2      LYS 131 -14.543 -38.654 -38.654
  943    H1   NAG 132           H1       NAG 132  -4.628  -5.572  -5.572
  944    H2   NAG 132           H2       NAG 132  -3.567  -3.225  -3.225
  945    H3   NAG 132           H3       NAG 132  -2.926  -6.237  -6.237
  946    H4   NAG 132           H4       NAG 132  -4.605  -4.564  -4.564
  947    H5   NAG 132           H5       NAG 132  -5.571  -6.700  -6.700
  948   1H6   NAG 132           H61      NAG 132  -6.789  -5.199  -5.199
  949   2H6   NAG 132           H62      NAG 132  -7.739  -5.278  -5.278
  950   1H8   NAG 132           H81      NAG 132  -0.320  -3.691  -3.691
  951   2H8   NAG 132           H82      NAG 132  -0.093  -2.008  -2.008
  952   3H8   NAG 132           H83      NAG 132   0.332  -3.365  -3.365
  953    HN2  NAG 132           HN2      NAG 132  -1.892  -5.033  -5.033
  954    HO3  NAG 132           HO3      NAG 132  -1.275  -5.126  -5.126
  955    H1   NAG 133           H1       NAG 133  -4.838  -6.181  -6.181
  956    H2   NAG 133           H2       NAG 133  -2.223  -7.658  -7.658
  957    H3   NAG 133           H3       NAG 133  -3.457  -7.144  -7.144
  958    H4   NAG 133           H4       NAG 133  -0.947  -5.877  -5.877
  959    H5   NAG 133           H5       NAG 133  -3.680  -4.573  -4.573
  960   1H6   NAG 133           H61      NAG 133  -1.447  -3.289  -3.289
  961   2H6   NAG 133           H62      NAG 133  -2.830  -2.607  -2.607
  962   1H8   NAG 133           H81      NAG 133  -6.145 -10.066 -10.066
  963   2H8   NAG 133           H82      NAG 133  -6.152  -8.388  -8.388
  964   3H8   NAG 133           H83      NAG 133  -5.595  -8.725  -8.725
  965    HN2  NAG 133           HN2      NAG 133  -4.199  -9.062  -9.062
  966    HO3  NAG 133           HO3      NAG 133  -2.135  -8.726  -8.726
  967    HO6  NAG 133           HO6      NAG 133  -1.368  -2.429  -2.429
  968    H1   FUC 134           H1       FUC 134  -8.224  -7.532  -7.532
  969    H2   FUC 134           H2       FUC 134  -7.509  -9.595  -9.595
  970    H3   FUC 134           H3       FUC 134 -10.532  -9.404  -9.404
  971    H4   FUC 134           H4       FUC 134 -10.322  -9.470  -9.470
  972    H5   FUC 134           H5       FUC 134 -10.212  -7.074  -7.074
  973   1H6   FUC 134           H61      FUC 134  -8.241  -6.397  -6.397
  974   2H6   FUC 134           H62      FUC 134  -9.976  -6.578  -6.578
  975   3H6   FUC 134           H63      FUC 134  -8.836  -7.927  -7.927
  976    HO2  FUC 134           HO2      FUC 134  -8.902 -10.485 -10.485
  977    HO3  FUC 134           HO3      FUC 134 -10.429 -11.457 -11.457
  978    HO4  FUC 134           HO4      FUC 134  -8.482 -10.670 -10.670
  979    H1   MAN 135           H1       MAN 135   0.273  -6.196  -6.196
  980    H2   MAN 135           H2       MAN 135   0.382  -3.711  -3.711
  981    H3   MAN 135           H3       MAN 135   2.414  -4.755  -4.755
  982    H4   MAN 135           H4       MAN 135   1.332  -4.486  -4.486
  983    H5   MAN 135           H5       MAN 135   1.702  -7.025  -7.025
  984   1H6   MAN 135           H61      MAN 135   1.875  -6.842  -6.842
  985   2H6   MAN 135           H62      MAN 135   0.110  -6.962  -6.962
  986    HO2  MAN 135           HO2      MAN 135  -0.623  -3.870  -3.870
  987    HO3  MAN 135           HO3      MAN 135   2.912  -2.711  -2.711
  988    HO4  MAN 135           HO4      MAN 135   3.533  -4.427  -4.427
  989    HO6  MAN 135           HO6      MAN 135   2.038  -8.759  -8.759
  990    H1   NAG 136           H1       NAG 136   1.886  -7.773  -7.773
  991    H2   NAG 136           H2       NAG 136  -0.766  -8.056  -8.056
  992    H3   NAG 136           H3       NAG 136   1.674  -9.943  -9.943
  993    H4   NAG 136           H4       NAG 136   0.811  -8.068  -8.068
  994    H5   NAG 136           H5       NAG 136   3.147  -7.738  -7.738
  995   1H6   NAG 136           H61      NAG 136   2.483  -6.801  -6.801
  996   2H6   NAG 136           H62      NAG 136   2.331  -5.476  -5.476
  997   1H8   NAG 136           H81      NAG 136  -3.393  -9.595  -9.595
  998   2H8   NAG 136           H82      NAG 136  -2.202 -10.930 -10.930
  999   3H8   NAG 136           H83      NAG 136  -2.997 -10.443 -10.443
 1000    HN2  NAG 136           HN2      NAG 136   0.255 -10.039 -10.039
 1001    HO3  NAG 136           HO3      NAG 136  -0.599  -9.889  -9.889
 1002    H1   NAG 137           H1       NAG 137   3.956  -8.552  -8.552
 1003    H2   NAG 137           H2       NAG 137   3.726 -11.487 -11.487
 1004    H3   NAG 137           H3       NAG 137   6.099 -10.007 -10.007
 1005    H4   NAG 137           H4       NAG 137   5.978 -11.064 -11.064
 1006    H5   NAG 137           H5       NAG 137   5.869  -8.145  -8.145
 1007   1H6   NAG 137           H61      NAG 137   5.019  -8.185  -8.185
 1008   2H6   NAG 137           H62      NAG 137   6.201  -9.513  -9.513
 1009   1H8   NAG 137           H81      NAG 137   1.761 -11.981 -11.981
 1010   2H8   NAG 137           H82      NAG 137   1.387 -12.159 -12.159
 1011   3H8   NAG 137           H83      NAG 137   1.936 -13.574 -13.574
 1012    HN2  NAG 137           HN2      NAG 137   3.648 -10.193 -10.193
 1013    HO3  NAG 137           HO3      NAG 137   6.853 -11.975 -11.975
 1014    HO6  NAG 137           HO6      NAG 137   7.700  -8.014  -8.014
 1015    H1   FUC 138           H1       FUC 138   4.372  -6.263  -6.263
 1016    H2   FUC 138           H2       FUC 138   6.570  -4.345  -4.345
 1017    H3   FUC 138           H3       FUC 138   6.185  -5.427  -5.427
 1018    H4   FUC 138           H4       FUC 138   5.510  -2.885  -2.885
 1019    H5   FUC 138           H5       FUC 138   3.479  -4.258  -4.258
 1020   1H6   FUC 138           H61      FUC 138   2.430  -2.438  -2.438
 1021   2H6   FUC 138           H62      FUC 138   3.902  -1.494  -1.494
 1022   3H6   FUC 138           H63      FUC 138   2.813  -2.080  -2.080
 1023    HO2  FUC 138           HO2      FUC 138   7.095  -6.574  -6.574
 1024    HO3  FUC 138           HO3      FUC 138   8.182  -4.937  -4.937
 1025    HO4  FUC 138           HO4      FUC 138   6.839  -1.976  -1.976
 1026    H1   MAN 139           H1       MAN 139   7.806 -12.118 -12.118
 1027    H2   MAN 139           H2       MAN 139   8.385 -11.256 -11.256
 1028    H3   MAN 139           H3       MAN 139   9.550 -13.280 -13.280
 1029    H4   MAN 139           H4       MAN 139  11.736 -11.515 -11.515
 1030    H5   MAN 139           H5       MAN 139   9.674 -13.280 -13.280
 1031   1H6   MAN 139           H61      MAN 139  10.633 -11.779 -11.779
 1032   2H6   MAN 139           H62      MAN 139  11.419 -13.303 -13.303
 1033    HO2  MAN 139           HO2      MAN 139   9.214  -9.212  -9.212
 1034    HO3  MAN 139           HO3      MAN 139  11.441 -11.429 -11.429
 1035    HO4  MAN 139           HO4      MAN 139  12.742 -13.353 -13.353
 1036    HO6  MAN 139           HO6      MAN 139  12.729 -11.208 -11.208

  Start of MODEL   16
    1   1H    ALA   1           HT2      ALA   1  -8.921   2.024   2.024
    2   2H    ALA   1           HT1      ALA   1  -7.418   2.054   2.054
    3   3H    ALA   1           HT3      ALA   1  -8.355   3.465   3.465
    4    HA   ALA   1           HA       ALA   1  -6.522   3.545   3.545
    5   1HB   ALA   1           HB2      ALA   1  -6.662   0.950   0.950
    6   2HB   ALA   1           HB1      ALA   1  -7.888   1.189   1.189
    7   3HB   ALA   1           HB3      ALA   1  -6.246   1.782   1.782
    8    H    MET   1           HN       MET   1  -7.352   5.413   5.413
    9    HA   MET   1           HA       MET   1  -9.980   5.305   5.305
   10   1HB   MET   1           HB2      MET   1  -8.275   7.567   7.567
   11   2HB   MET   1           HB1      MET   1  -9.827   7.792   7.792
   12   1HG   MET   1           HG2      MET   1  -9.411   6.115   6.115
   13   2HG   MET   1           HG1      MET   1 -10.046   7.760   7.760
   14   1HE   MET   1           HE1      MET   1 -12.027   8.554   8.554
   15   2HE   MET   1           HE3      MET   1 -11.831   7.776   7.776
   16   3HE   MET   1           HE2      MET   1 -13.342   7.604   7.604
   17    H    HIS   2           HN       HIS   2  -6.558   6.121   6.121
   18    HA   HIS   2           HA       HIS   2  -7.070   6.696   6.696
   19   1HB   HIS   2           HB2      HIS   2  -4.747   7.383   7.383
   20   2HB   HIS   2           HB1      HIS   2  -4.881   7.874   7.874
   21    HD1  HIS   2           HD1      HIS   2  -6.126   8.670   8.670
   22    HD2  HIS   2           HD2      HIS   2  -6.945   9.836   9.836
   23    HE1  HIS   2           HE1      HIS   2  -7.551  10.758  10.758
   24    H    VAL   3           HN       VAL   3  -6.869   4.015   4.015
   25    HA   VAL   3           HA       VAL   3  -4.724   2.948   2.948
   26    HB   VAL   3           HB       VAL   3  -4.969   2.433   2.433
   27   1HG1  VAL   3          HG11      VAL   3  -3.094   1.258   1.258
   28   2HG1  VAL   3          HG13      VAL   3  -2.906   1.058   1.058
   29   3HG1  VAL   3          HG12      VAL   3  -4.316   0.384   0.384
   30   1HG2  VAL   3          HG23      VAL   3  -2.955   3.904   3.904
   31   2HG2  VAL   3          HG22      VAL   3  -3.876   4.531   4.531
   32   3HG2  VAL   3          HG21      VAL   3  -2.584   3.362   3.362
   33    H    ALA   4           HN       ALA   4  -5.353   0.995   0.995
   34    HA   ALA   4           HA       ALA   4  -7.868  -0.269  -0.269
   35   1HB   ALA   4           HB3      ALA   4  -6.861   0.507   0.507
   36   2HB   ALA   4           HB2      ALA   4  -7.662  -1.064  -1.064
   37   3HB   ALA   4           HB1      ALA   4  -8.521   0.390   0.390
   38    H    GLN   5           HN       GLN   5  -7.598  -2.337  -2.337
   39    HA   GLN   5           HA       GLN   5  -5.364  -3.982  -3.982
   40   1HB   GLN   5           HB2      GLN   5  -5.982  -3.232  -3.232
   41   2HB   GLN   5           HB1      GLN   5  -5.050  -4.682  -4.682
   42   1HG   GLN   5           HG2      GLN   5  -4.239  -2.139  -2.139
   43   2HG   GLN   5           HG1      GLN   5  -3.860  -2.323  -2.323
   44   1HE2  GLN   5          HE22      GLN   5  -1.819  -4.503  -4.503
   45   2HE2  GLN   5          HE21      GLN   5  -3.062  -3.447  -3.447
   46    HA   PRO   6           HA       PRO   6  -8.738  -6.986  -6.986
   47   1HB   PRO   6           HB2      PRO   6  -7.312  -9.128  -9.128
   48   2HB   PRO   6           HB1      PRO   6  -7.894  -7.841  -7.841
   49   1HG   PRO   6           HG2      PRO   6  -5.176  -8.290  -8.290
   50   2HG   PRO   6           HG1      PRO   6  -5.659  -7.702  -7.702
   51   1HD   PRO   6           HD2      PRO   6  -4.760  -6.087  -6.087
   52   2HD   PRO   6           HD1      PRO   6  -5.837  -5.542  -5.542
   53    H    ALA   7           HN       ALA   7  -9.375  -8.404  -8.404
   54    HA   ALA   7           HA       ALA   7  -7.685  -8.710  -8.710
   55   1HB   ALA   7           HB3      ALA   7 -10.318  -9.904  -9.904
   56   2HB   ALA   7           HB2      ALA   7  -9.622 -10.262 -10.262
   57   3HB   ALA   7           HB1      ALA   7 -10.076  -8.607  -8.607
   58    H    VAL   8           HN       VAL   8  -8.451 -10.802 -10.802
   59    HA   VAL   8           HA       VAL   8  -6.180 -12.483 -12.483
   60    HB   VAL   8           HB       VAL   8  -8.372 -13.233 -13.233
   61   1HG1  VAL   8          HG13      VAL   8  -9.047 -13.765 -13.765
   62   2HG1  VAL   8          HG12      VAL   8  -9.483 -15.003 -15.003
   63   3HG1  VAL   8          HG11      VAL   8 -10.106 -13.348 -13.348
   64   1HG2  VAL   8          HG23      VAL   8  -6.610 -14.988 -14.988
   65   2HG2  VAL   8          HG22      VAL   8  -6.520 -14.682 -14.682
   66   3HG2  VAL   8          HG21      VAL   8  -7.821 -15.630 -15.630
   67    H    VAL   9           HN       VAL   9  -5.452 -13.830 -13.830
   68    HA   VAL   9           HA       VAL   9  -6.578 -13.373 -13.373
   69    HB   VAL   9           HB       VAL   9  -3.829 -12.930 -12.930
   70   1HG1  VAL   9          HG11      VAL   9  -4.553 -13.806 -13.806
   71   2HG1  VAL   9          HG13      VAL   9  -3.232 -12.659 -12.659
   72   3HG1  VAL   9          HG12      VAL   9  -3.153 -14.258 -14.258
   73   1HG2  VAL   9          HG23      VAL   9  -5.682 -11.172 -11.172
   74   2HG2  VAL   9          HG22      VAL   9  -4.068 -10.810 -10.810
   75   3HG2  VAL   9          HG21      VAL   9  -5.322 -11.384 -11.384
   76    H    LEU  10           HN       LEU  10  -6.342 -15.161 -15.161
   77    HA   LEU  10           HA       LEU  10  -5.625 -17.720 -17.720
   78   1HB   LEU  10           HB2      LEU  10  -7.268 -17.109 -17.109
   79   2HB   LEU  10           HB1      LEU  10  -7.066 -18.708 -18.708
   80    HG   LEU  10           HG       LEU  10  -8.269 -16.312 -16.312
   81   1HD1  LEU  10          HD13      LEU  10  -9.705 -17.144 -17.144
   82   2HD1  LEU  10          HD12      LEU  10  -9.597 -18.776 -18.776
   83   3HD1  LEU  10          HD11      LEU  10 -10.408 -17.506 -17.506
   84   1HD2  LEU  10          HD23      LEU  10  -7.358 -18.964 -18.964
   85   2HD2  LEU  10          HD22      LEU  10  -7.774 -17.548 -17.548
   86   3HD2  LEU  10          HD21      LEU  10  -9.040 -18.648 -18.648
   87    H    ALA  11           HN       ALA  11  -3.778 -18.740 -18.740
   88    HA   ALA  11           HA       ALA  11  -2.289 -17.700 -17.700
   89   1HB   ALA  11           HB2      ALA  11  -1.613 -19.674 -19.674
   90   2HB   ALA  11           HB1      ALA  11  -0.468 -19.056 -19.056
   91   3HB   ALA  11           HB3      ALA  11  -1.196 -17.960 -17.960
   92    H    SER  12           HN       SER  12  -1.059 -19.535 -19.535
   93    HA   SER  12           HA       SER  12  -3.066 -21.622 -21.622
   94   1HB   SER  12           HB2      SER  12  -2.391 -19.901 -19.901
   95   2HB   SER  12           HB1      SER  12  -0.716 -20.420 -20.420
   96    HG   SER  12           HG       SER  12  -2.923 -21.983 -21.983
   97    H    SER  13           HN       SER  13  -1.856 -23.619 -23.619
   98    HA   SER  13           HA       SER  13  -0.375 -24.968 -24.968
   99   1HB   SER  13           HB2      SER  13  -1.687 -26.000 -26.000
  100   2HB   SER  13           HB1      SER  13  -0.462 -25.457 -25.457
  101    HG   SER  13           HG       SER  13  -0.417 -27.524 -27.524
  102    H    ARG  14           HN       ARG  14   0.691 -23.164 -23.164
  103    HA   ARG  14           HA       ARG  14   3.465 -23.820 -23.820
  104   1HB   ARG  14           HB2      ARG  14   1.892 -21.375 -21.375
  105   2HB   ARG  14           HB1      ARG  14   3.618 -21.552 -21.552
  106   1HG   ARG  14           HG2      ARG  14   1.800 -23.801 -23.801
  107   2HG   ARG  14           HG1      ARG  14   1.821 -22.358 -22.358
  108   1HD   ARG  14           HD2      ARG  14   4.309 -22.552 -22.552
  109   2HD   ARG  14           HD1      ARG  14   4.220 -24.067 -24.067
  110    HE   ARG  14           HE       ARG  14   3.260 -25.122 -25.122
  111   1HH1  ARG  14          HH21      ARG  14   3.195 -21.644 -21.644
  112   2HH1  ARG  14          HH22      ARG  14   2.697 -21.740 -21.740
  113   1HH2  ARG  14          HH11      ARG  14   2.612 -25.195 -25.195
  114   2HH2  ARG  14          HH12      ARG  14   2.368 -23.725 -23.725
  115    H    GLY  15           HN       GLY  15   1.573 -21.555 -21.555
  116   1HA   GLY  15           HA2      GLY  15   2.274 -20.785 -20.785
  117   2HA   GLY  15           HA1      GLY  15   3.951 -21.076 -21.076
  118    H    ILE  16           HN       ILE  16   1.751 -19.441 -19.441
  119    HA   ILE  16           HA       ILE  16   3.370 -16.962 -16.962
  120    HB   ILE  16           HB       ILE  16   1.683 -18.206 -18.206
  121   1HG1  ILE  16          HG12      ILE  16   3.683 -18.081 -18.081
  122   2HG1  ILE  16          HG11      ILE  16   4.469 -17.029 -17.029
  123   1HG2  ILE  16          HG23      ILE  16   2.385 -15.324 -15.324
  124   2HG2  ILE  16          HG22      ILE  16   2.513 -15.968 -15.968
  125   3HG2  ILE  16          HG21      ILE  16   0.972 -16.036 -16.036
  126   1HD1  ILE  16          HD11      ILE  16   3.625 -19.809 -19.809
  127   2HD1  ILE  16          HD13      ILE  16   5.141 -19.541 -19.541
  128   3HD1  ILE  16          HD12      ILE  16   4.877 -18.784 -18.784
  129    H    ALA  17           HN       ALA  17   2.328 -15.863 -15.863
  130    HA   ALA  17           HA       ALA  17  -0.613 -15.359 -15.359
  131   1HB   ALA  17           HB2      ALA  17   1.213 -15.389 -15.389
  132   2HB   ALA  17           HB1      ALA  17  -0.469 -14.859 -14.859
  133   3HB   ALA  17           HB3      ALA  17  -0.082 -16.530 -16.530
  134    H    SER  18           HN       SER  18  -0.961 -13.331 -13.331
  135    HA   SER  18           HA       SER  18   0.862 -11.144 -11.144
  136   1HB   SER  18           HB2      SER  18   1.414 -11.848 -11.848
  137   2HB   SER  18           HB1      SER  18  -0.260 -11.607 -11.607
  138    HG   SER  18           HG       SER  18   1.752  -9.799  -9.799
  139    H    PHE  19           HN       PHE  19  -0.173  -9.394  -9.394
  140    HA   PHE  19           HA       PHE  19  -3.049  -8.967  -8.967
  141   1HB   PHE  19           HB2      PHE  19  -3.381  -8.347  -8.347
  142   2HB   PHE  19           HB1      PHE  19  -2.931 -10.032 -10.032
  143    HD1  PHE  19           HD1      PHE  19  -0.585 -10.797 -10.797
  144    HD2  PHE  19           HD2      PHE  19  -1.929  -6.784  -6.784
  145    HE1  PHE  19           HE1      PHE  19   1.386 -10.487 -10.487
  146    HE2  PHE  19           HE2      PHE  19   0.046  -6.473  -6.473
  147    HZ   PHE  19           HZ       PHE  19   1.702  -8.329  -8.329
  148    H    VAL  20           HN       VAL  20  -3.699  -6.657  -6.657
  149    HA   VAL  20           HA       VAL  20  -1.353  -4.851  -4.851
  150    HB   VAL  20           HB       VAL  20  -4.179  -4.687  -4.687
  151   1HG1  VAL  20          HG11      VAL  20  -1.748  -2.939  -2.939
  152   2HG1  VAL  20          HG13      VAL  20  -3.213  -2.867  -2.867
  153   3HG1  VAL  20          HG12      VAL  20  -3.278  -2.453  -2.453
  154   1HG2  VAL  20          HG23      VAL  20  -2.355  -6.421  -6.421
  155   2HG2  VAL  20          HG22      VAL  20  -3.416  -5.562  -5.562
  156   3HG2  VAL  20          HG21      VAL  20  -1.769  -4.993  -4.993
  157    H    CYS  21           HN       CYS  21  -1.021  -3.410  -3.410
  158    HA   CYS  21           HA       CYS  21  -3.267  -2.712  -2.712
  159   1HB   CYS  21           HB2      CYS  21  -1.103  -3.619  -3.619
  160   2HB   CYS  21           HB1      CYS  21  -0.271  -2.236  -2.236
  161    H    GLU  22           HN       GLU  22  -4.343  -0.951  -0.951
  162    HA   GLU  22           HA       GLU  22  -2.907   1.095   1.095
  163   1HB   GLU  22           HB2      GLU  22  -5.043   0.325   0.325
  164   2HB   GLU  22           HB1      GLU  22  -5.774   0.621   0.621
  165   1HG   GLU  22           HG2      GLU  22  -5.673   2.980   2.980
  166   2HG   GLU  22           HG1      GLU  22  -4.555   2.848   2.848
  167    H    TYR  23           HN       TYR  23  -2.446   3.163   3.163
  168    HA   TYR  23           HA       TYR  23  -3.091   3.861   3.861
  169   1HB   TYR  23           HB2      TYR  23  -0.818   4.742   4.742
  170   2HB   TYR  23           HB1      TYR  23  -0.735   3.088   3.088
  171    HD1  TYR  23           HD2      TYR  23  -0.459   6.693   6.693
  172    HD2  TYR  23           HD1      TYR  23  -0.014   2.585   2.585
  173    HE1  TYR  23           HE2      TYR  23   0.760   7.477   7.477
  174    HE2  TYR  23           HE1      TYR  23   1.203   3.376   3.376
  175    HH   TYR  23           HH       TYR  23   1.168   6.536   6.536
  176    H    ALA  24           HN       ALA  24  -2.594   6.362   6.362
  177    HA   ALA  24           HA       ALA  24  -3.629   7.811   7.811
  178   1HB   ALA  24           HB1      ALA  24  -5.132   7.152   7.152
  179   2HB   ALA  24           HB3      ALA  24  -4.507   8.722   8.722
  180   3HB   ALA  24           HB2      ALA  24  -5.431   8.579   8.579
  181    H    SER  25           HN       SER  25  -2.252   9.454   9.454
  182    HA   SER  25           HA       SER  25  -0.570  10.629  10.629
  183   1HB   SER  25           HB2      SER  25  -0.114  10.097  10.097
  184   2HB   SER  25           HB1      SER  25   0.949  11.150  11.150
  185    HG   SER  25           HG       SER  25   1.696   9.000   9.000
  186    HA   PRO  26           HA       PRO  26  -2.906  14.315  14.315
  187   1HB   PRO  26           HB2      PRO  26  -1.374  16.124  16.124
  188   2HB   PRO  26           HB1      PRO  26  -2.505  15.008  15.008
  189   1HG   PRO  26           HG2      PRO  26   0.452  14.806  14.806
  190   2HG   PRO  26           HG1      PRO  26  -0.570  14.412  14.412
  191   1HD   PRO  26           HD2      PRO  26   0.426  12.528  12.528
  192   2HD   PRO  26           HD1      PRO  26  -1.119  12.340  12.340
  193    H    GLY  27           HN       GLY  27   0.359  13.765  13.765
  194   1HA   GLY  27           HA2      GLY  27   0.028  15.751  15.751
  195   2HA   GLY  27           HA1      GLY  27   1.381  16.043  16.043
  196    H    LYS  28           HN       LYS  28   2.332  15.729  15.729
  197    HA   LYS  28           HA       LYS  28   2.873  12.838  12.838
  198   1HB   LYS  28           HB2      LYS  28   3.257  15.385  15.385
  199   2HB   LYS  28           HB1      LYS  28   3.659  13.770  13.770
  200   1HG   LYS  28           HG2      LYS  28   1.303  13.079  13.079
  201   2HG   LYS  28           HG1      LYS  28   0.905  14.707  14.707
  202   1HD   LYS  28           HD2      LYS  28   1.707  15.606  15.606
  203   2HD   LYS  28           HD1      LYS  28   1.981  13.952  13.952
  204   1HE   LYS  28           HE2      LYS  28  -0.400  13.430  13.430
  205   2HE   LYS  28           HE1      LYS  28  -0.706  15.052  15.052
  206   1HZ   LYS  28           HZ2      LYS  28   0.499  14.489  14.489
  207   2HZ   LYS  28           HZ1      LYS  28  -1.120  14.936  14.936
  208   3HZ   LYS  28           HZ3      LYS  28   0.126  16.022  16.022
  209    H    ALA  29           HN       ALA  29   4.939  12.038  12.038
  210    HA   ALA  29           HA       ALA  29   7.270  13.847  13.847
  211   1HB   ALA  29           HB3      ALA  29   6.241  12.175  12.175
  212   2HB   ALA  29           HB2      ALA  29   7.800  12.998  12.998
  213   3HB   ALA  29           HB1      ALA  29   6.308  13.936  13.936
  214    H    THR  30           HN       THR  30   9.316  12.532  12.532
  215    HA   THR  30           HA       THR  30   9.114  10.044  10.044
  216    HB   THR  30           HB       THR  30  11.558  10.188  10.188
  217    HG1  THR  30           HG1      THR  30  12.526  11.238  11.238
  218   1HG2  THR  30          HG22      THR  30   9.872  12.440  12.440
  219   2HG2  THR  30          HG21      THR  30  11.571  12.845  12.845
  220   3HG2  THR  30          HG23      THR  30  11.126  11.584  11.584
  221    H    GLU  31           HN       GLU  31   8.543  10.449  10.449
  222    HA   GLU  31           HA       GLU  31  10.087   7.970   7.970
  223   1HB   GLU  31           HB2      GLU  31   9.778  10.566  10.566
  224   2HB   GLU  31           HB1      GLU  31  10.497   9.123   9.123
  225   1HG   GLU  31           HG2      GLU  31  11.593  10.181  10.181
  226   2HG   GLU  31           HG1      GLU  31  12.000  11.007  11.007
  227    H    VAL  32           HN       VAL  32   8.252   6.612   6.612
  228    HA   VAL  32           HA       VAL  32   6.345   7.161   7.161
  229    HB   VAL  32           HB       VAL  32   5.874   5.946   5.946
  230   1HG1  VAL  32          HG12      VAL  32   4.484   5.451   5.451
  231   2HG1  VAL  32          HG11      VAL  32   3.441   5.795   5.795
  232   3HG1  VAL  32          HG13      VAL  32   4.565   4.434   4.434
  233   1HG2  VAL  32          HG23      VAL  32   4.599   8.193   8.193
  234   2HG2  VAL  32          HG22      VAL  32   5.627   8.363   8.363
  235   3HG2  VAL  32          HG21      VAL  32   4.029   7.629   7.629
  236    H    ARG  33           HN       ARG  33   8.050   6.134   6.134
  237    HA   ARG  33           HA       ARG  33   9.237   3.624   3.624
  238   1HB   ARG  33           HB2      ARG  33   9.875   5.364   5.364
  239   2HB   ARG  33           HB1      ARG  33   8.484   4.881   4.881
  240   1HG   ARG  33           HG2      ARG  33   9.610   3.134   3.134
  241   2HG   ARG  33           HG1      ARG  33  10.030   2.542   2.542
  242   1HD   ARG  33           HD2      ARG  33  11.915   4.192   4.192
  243   2HD   ARG  33           HD1      ARG  33  11.536   4.642   4.642
  244    HE   ARG  33           HE       ARG  33  12.752   2.119   2.119
  245   1HH1  ARG  33          HH21      ARG  33  10.880   3.721   3.721
  246   2HH1  ARG  33          HH22      ARG  33  11.367   2.602   2.602
  247   1HH2  ARG  33          HH11      ARG  33  13.349   0.696   0.696
  248   2HH2  ARG  33          HH12      ARG  33  12.748   0.908   0.908
  249    H    VAL  34           HN       VAL  34   8.521   1.556   1.556
  250    HA   VAL  34           HA       VAL  34   6.063   1.014   1.014
  251    HB   VAL  34           HB       VAL  34   5.397  -0.558  -0.558
  252   1HG1  VAL  34          HG11      VAL  34   4.770   1.908   1.908
  253   2HG1  VAL  34          HG13      VAL  34   6.040   2.114   2.114
  254   3HG1  VAL  34          HG12      VAL  34   4.665   1.064   1.064
  255   1HG2  VAL  34          HG22      VAL  34   8.122  -0.047  -0.047
  256   2HG2  VAL  34          HG21      VAL  34   7.031  -1.371  -1.371
  257   3HG2  VAL  34          HG23      VAL  34   6.944   0.155   0.155
  258    H    THR  35           HN       THR  35   5.951  -1.326  -1.326
  259    HA   THR  35           HA       THR  35   8.442  -2.894  -2.894
  260    HB   THR  35           HB       THR  35   7.370  -1.692  -1.692
  261    HG1  THR  35           HG1      THR  35   8.538  -0.105  -0.105
  262   1HG2  THR  35          HG21      THR  35   8.359  -3.986  -3.986
  263   2HG2  THR  35          HG23      THR  35   9.858  -3.356  -3.356
  264   3HG2  THR  35          HG22      THR  35   9.270  -2.751  -2.751
  265    H    VAL  36           HN       VAL  36   8.114  -5.033  -5.033
  266    HA   VAL  36           HA       VAL  36   5.238  -5.738  -5.738
  267    HB   VAL  36           HB       VAL  36   7.477  -7.266  -7.266
  268   1HG1  VAL  36          HG12      VAL  36   4.568  -7.973  -7.973
  269   2HG1  VAL  36          HG11      VAL  36   5.626  -8.850  -8.850
  270   3HG1  VAL  36          HG13      VAL  36   5.981  -8.824  -8.824
  271   1HG2  VAL  36          HG21      VAL  36   5.288  -5.486  -5.486
  272   2HG2  VAL  36          HG23      VAL  36   6.847  -5.832  -5.832
  273   3HG2  VAL  36          HG22      VAL  36   5.512  -6.970  -6.970
  274    H    LEU  37           HN       LEU  37   4.846  -6.873  -6.873
  275    HA   LEU  37           HA       LEU  37   7.317  -7.916  -7.916
  276   1HB   LEU  37           HB2      LEU  37   4.917  -6.461  -6.461
  277   2HB   LEU  37           HB1      LEU  37   6.267  -7.087  -7.087
  278    HG   LEU  37           HG       LEU  37   6.877  -5.231  -5.231
  279   1HD1  LEU  37          HD12      LEU  37   4.894  -4.473  -4.473
  280   2HD1  LEU  37          HD11      LEU  37   6.314  -3.964  -3.964
  281   3HD1  LEU  37          HD13      LEU  37   6.049  -3.342  -3.342
  282   1HD2  LEU  37          HD22      LEU  37   8.189  -6.395  -6.395
  283   2HD2  LEU  37          HD21      LEU  37   8.891  -5.419  -5.419
  284   3HD2  LEU  37          HD23      LEU  37   8.226  -4.635  -4.635
  285    H    ARG  38           HN       ARG  38   6.829  -9.523  -9.523
  286    HA   ARG  38           HA       ARG  38   4.301 -11.069 -11.069
  287   1HB   ARG  38           HB2      ARG  38   7.158 -11.988 -11.988
  288   2HB   ARG  38           HB1      ARG  38   5.775 -13.077 -13.077
  289   1HG   ARG  38           HG2      ARG  38   5.125 -12.419 -12.419
  290   2HG   ARG  38           HG1      ARG  38   6.602 -11.468 -11.468
  291   1HD   ARG  38           HD2      ARG  38   6.485 -14.468 -14.468
  292   2HD   ARG  38           HD1      ARG  38   6.934 -13.695 -13.695
  293    HE   ARG  38           HE       ARG  38   8.962 -12.903 -12.903
  294   1HH1  ARG  38          HH21      ARG  38   6.972 -14.633 -14.633
  295   2HH1  ARG  38          HH22      ARG  38   8.262 -14.781 -14.781
  296   1HH2  ARG  38          HH11      ARG  38  10.586 -13.125 -13.125
  297   2HH2  ARG  38          HH12      ARG  38  10.280 -13.941 -13.941
  298    H    GLN  39           HN       GLN  39   3.087 -11.013 -11.013
  299    HA   GLN  39           HA       GLN  39   4.545 -10.551 -10.551
  300   1HB   GLN  39           HB2      GLN  39   1.726 -10.053 -10.053
  301   2HB   GLN  39           HB1      GLN  39   2.191  -9.884  -9.884
  302   1HG   GLN  39           HG2      GLN  39   3.830  -8.197  -8.197
  303   2HG   GLN  39           HG1      GLN  39   3.589  -8.453  -8.453
  304   1HE2  GLN  39          HE22      GLN  39   0.160  -7.004  -7.004
  305   2HE2  GLN  39          HE21      GLN  39   0.806  -8.485  -8.485
  306    H    ALA  40           HN       ALA  40   4.630 -12.093 -12.093
  307    HA   ALA  40           HA       ALA  40   2.707 -14.389 -14.389
  308   1HB   ALA  40           HB2      ALA  40   5.610 -14.231 -14.231
  309   2HB   ALA  40           HB1      ALA  40   5.144 -15.260 -15.260
  310   3HB   ALA  40           HB3      ALA  40   4.552 -15.618 -15.618
  311    H    ASP  41           HN       ASP  41   2.233 -15.310 -15.310
  312    HA   ASP  41           HA       ASP  41   1.888 -13.426 -13.426
  313   1HB   ASP  41           HB2      ASP  41   1.935 -16.424 -16.424
  314   2HB   ASP  41           HB1      ASP  41   1.481 -15.560 -15.560
  315    H    SER  42           HN       SER  42   4.393 -15.926 -15.926
  316    HA   SER  42           HA       SER  42   5.757 -15.422 -15.422
  317   1HB   SER  42           HB2      SER  42   6.552 -16.677 -16.677
  318   2HB   SER  42           HB1      SER  42   7.589 -16.698 -16.698
  319    HG   SER  42           HG       SER  42   6.216 -18.019 -18.019
  320    H    GLN  43           HN       GLN  43   6.522 -14.394 -14.394
  321    HA   GLN  43           HA       GLN  43   7.774 -11.919 -11.919
  322   1HB   GLN  43           HB2      GLN  43   9.238 -14.167 -14.167
  323   2HB   GLN  43           HB1      GLN  43   9.888 -12.532 -12.532
  324   1HG   GLN  43           HG2      GLN  43   9.627 -12.681 -12.681
  325   2HG   GLN  43           HG1      GLN  43   9.256 -14.392 -14.392
  326   1HE2  GLN  43          HE22      GLN  43  12.614 -15.182 -15.182
  327   2HE2  GLN  43          HE21      GLN  43  10.996 -15.580 -15.580
  328    H    VAL  44           HN       VAL  44   8.390 -10.442 -10.442
  329    HA   VAL  44           HA       VAL  44   6.994 -11.019 -11.019
  330    HB   VAL  44           HB       VAL  44   7.155  -8.454  -8.454
  331   1HG1  VAL  44          HG13      VAL  44   5.827  -9.031  -9.031
  332   2HG1  VAL  44          HG12      VAL  44   5.611  -7.548  -7.548
  333   3HG1  VAL  44          HG11      VAL  44   7.197  -7.956  -7.956
  334   1HG2  VAL  44          HG21      VAL  44   5.488 -10.561 -10.561
  335   2HG2  VAL  44          HG23      VAL  44   5.043  -8.887  -8.887
  336   3HG2  VAL  44          HG22      VAL  44   4.547  -9.654  -9.654
  337    H    THR  45           HN       THR  45   8.299 -10.621 -10.621
  338    HA   THR  45           HA       THR  45  10.839  -9.076  -9.076
  339    HB   THR  45           HB       THR  45  11.980 -10.824 -10.824
  340    HG1  THR  45           HG1      THR  45   9.459 -12.114 -12.114
  341   1HG2  THR  45          HG23      THR  45  11.498 -10.952 -10.952
  342   2HG2  THR  45          HG22      THR  45  10.452 -12.297 -12.297
  343   3HG2  THR  45          HG21      THR  45  12.175 -12.352 -12.352
  344    H    GLU  46           HN       GLU  46  11.784  -8.210  -8.210
  345    HA   GLU  46           HA       GLU  46   9.781  -7.220  -7.220
  346   1HB   GLU  46           HB2      GLU  46  12.758  -6.872  -6.872
  347   2HB   GLU  46           HB1      GLU  46  11.876  -6.079  -6.079
  348   1HG   GLU  46           HG2      GLU  46  10.507  -4.860  -4.860
  349   2HG   GLU  46           HG1      GLU  46  11.066  -5.828  -5.828
  350    H    VAL  47           HN       VAL  47  10.068  -7.415  -7.415
  351    HA   VAL  47           HA       VAL  47  11.395  -9.981  -9.981
  352    HB   VAL  47           HB       VAL  47   8.711  -8.802  -8.802
  353   1HG1  VAL  47          HG12      VAL  47  10.281 -11.097 -11.097
  354   2HG1  VAL  47          HG11      VAL  47   8.517 -11.159 -11.159
  355   3HG1  VAL  47          HG13      VAL  47   9.342  -9.869  -9.869
  356   1HG2  VAL  47          HG21      VAL  47   9.636 -10.824 -10.824
  357   2HG2  VAL  47          HG23      VAL  47   8.156  -9.865  -9.865
  358   3HG2  VAL  47          HG22      VAL  47   8.268 -11.322 -11.322
  359    H    CYS  48           HN       CYS  48   9.739  -7.266  -7.266
  360    HA   CYS  48           HA       CYS  48  12.261  -6.801  -6.801
  361   1HB   CYS  48           HB2      CYS  48   9.469  -7.397  -7.397
  362   2HB   CYS  48           HB1      CYS  48  10.694  -6.675  -6.675
  363    H    ALA  49           HN       ALA  49  12.440  -4.694  -4.694
  364    HA   ALA  49           HA       ALA  49  10.344  -2.685  -2.685
  365   1HB   ALA  49           HB2      ALA  49  12.419  -3.261  -3.261
  366   2HB   ALA  49           HB1      ALA  49  12.636  -1.624  -1.624
  367   3HB   ALA  49           HB3      ALA  49  11.105  -2.091  -2.091
  368    H    ALA  50           HN       ALA  50  10.565  -1.052  -1.052
  369    HA   ALA  50           HA       ALA  50  13.196  -0.353  -0.353
  370   1HB   ALA  50           HB1      ALA  50  12.393  -2.347  -2.347
  371   2HB   ALA  50           HB3      ALA  50  10.906  -1.484  -1.484
  372   3HB   ALA  50           HB2      ALA  50  12.448  -0.914  -0.914
  373    H    THR  51           HN       THR  51  13.118   1.782   1.782
  374    HA   THR  51           HA       THR  51  10.811   3.400   3.400
  375    HB   THR  51           HB       THR  51  13.128   4.299   4.299
  376    HG1  THR  51           HG1      THR  51  14.397   3.660   3.660
  377   1HG2  THR  51          HG23      THR  51  11.002   5.646   5.646
  378   2HG2  THR  51          HG22      THR  51  12.164   5.829   5.829
  379   3HG2  THR  51          HG21      THR  51  12.575   6.382   6.382
  380    H    TYR  52           HN       TYR  52   9.094   3.857   3.857
  381    HA   TYR  52           HA       TYR  52   8.969   2.924   2.924
  382   1HB   TYR  52           HB2      TYR  52   7.113   2.892   2.892
  383   2HB   TYR  52           HB1      TYR  52   7.133   4.642   4.642
  384    HD1  TYR  52           HD1      TYR  52   7.062   5.589   5.589
  385    HD2  TYR  52           HD2      TYR  52   5.356   1.945   1.945
  386    HE1  TYR  52           HE1      TYR  52   5.412   5.535   5.535
  387    HE2  TYR  52           HE2      TYR  52   3.694   1.911   1.911
  388    HH   TYR  52           HH       TYR  52   2.971   4.472   4.472
  389    H    MET  53           HN       MET  53  10.312   4.225   4.225
  390    HA   MET  53           HA       MET  53  10.134   7.173   7.173
  391   1HB   MET  53           HB2      MET  53  11.822   5.446   5.446
  392   2HB   MET  53           HB1      MET  53  12.015   7.181   7.181
  393   1HG   MET  53           HG2      MET  53  12.093   6.154   6.154
  394   2HG   MET  53           HG1      MET  53  12.973   4.952   4.952
  395   1HE   MET  53           HE2      MET  53  12.838   7.872   7.872
  396   2HE   MET  53           HE1      MET  53  14.210   8.919   8.919
  397   3HE   MET  53           HE3      MET  53  12.741   9.008   9.008
  398    H    MET  54           HN       MET  54   8.820   8.336   8.336
  399    HA   MET  54           HA       MET  54   6.946   7.026   7.026
  400   1HB   MET  54           HB2      MET  54   8.008   9.872   9.872
  401   2HB   MET  54           HB1      MET  54   6.548   9.363   9.363
  402   1HG   MET  54           HG2      MET  54   7.011   9.022   9.022
  403   2HG   MET  54           HG1      MET  54   6.052  10.313  10.313
  404   1HE   MET  54           HE2      MET  54   4.823   9.061   9.061
  405   2HE   MET  54           HE1      MET  54   3.646   7.776   7.776
  406   3HE   MET  54           HE3      MET  54   5.351   7.380   7.380
  407    H    GLY  55           HN       GLY  55  10.135   8.406   8.406
  408   1HA   GLY  55           HA2      GLY  55   9.918   8.217   8.217
  409   2HA   GLY  55           HA1      GLY  55  11.422   8.380   8.380
  410    H    ASN  56           HN       ASN  56  11.590   6.110   6.110
  411    HA   ASN  56           HA       ASN  56  11.340   3.867   3.867
  412   1HB   ASN  56           HB2      ASN  56  13.654   4.680   4.680
  413   2HB   ASN  56           HB1      ASN  56  13.601   3.167   3.167
  414   1HD2  ASN  56          HD22      ASN  56  14.000   4.788   4.788
  415   2HD2  ASN  56          HD21      ASN  56  13.303   3.429   3.429
  416    H    GLU  57           HN       GLU  57  11.310   1.709   1.709
  417    HA   GLU  57           HA       GLU  57  10.071   1.787   1.787
  418   1HB   GLU  57           HB2      GLU  57   8.821   0.844   0.844
  419   2HB   GLU  57           HB1      GLU  57  10.100  -0.352  -0.352
  420   1HG   GLU  57           HG2      GLU  57   9.672  -1.261  -1.261
  421   2HG   GLU  57           HG1      GLU  57   8.458  -0.017  -0.017
  422    H    LEU  58           HN       LEU  58  11.195   0.892   0.892
  423    HA   LEU  58           HA       LEU  58  13.777  -0.423  -0.423
  424   1HB   LEU  58           HB2      LEU  58  13.657   1.485   1.485
  425   2HB   LEU  58           HB1      LEU  58  12.384   0.697   0.697
  426    HG   LEU  58           HG       LEU  58  13.941  -1.145  -1.145
  427   1HD1  LEU  58          HD12      LEU  58  15.981   0.676   0.676
  428   2HD1  LEU  58          HD11      LEU  58  16.365  -0.802  -0.802
  429   3HD1  LEU  58          HD13      LEU  58  15.443  -0.886  -0.886
  430   1HD2  LEU  58          HD21      LEU  58  14.292   1.651   1.651
  431   2HD2  LEU  58          HD23      LEU  58  13.997   0.197   0.197
  432   3HD2  LEU  58          HD22      LEU  58  15.628   0.570   0.570
  433    H    THR  59           HN       THR  59  14.223  -2.514  -2.514
  434    HA   THR  59           HA       THR  59  11.837  -4.198  -4.198
  435    HB   THR  59           HB       THR  59  13.480  -5.950  -5.950
  436    HG1  THR  59           HG1      THR  59  15.324  -4.783  -4.783
  437   1HG2  THR  59          HG22      THR  59  12.044  -4.453  -4.453
  438   2HG2  THR  59          HG21      THR  59  13.607  -3.772  -3.772
  439   3HG2  THR  59          HG23      THR  59  13.294  -5.492  -5.492
  440    H    PHE  60           HN       PHE  60  12.234  -6.022  -6.022
  441    HA   PHE  60           HA       PHE  60  13.509  -4.979  -4.979
  442   1HB   PHE  60           HB2      PHE  60  11.831  -7.447  -7.447
  443   2HB   PHE  60           HB1      PHE  60  12.246  -6.838  -6.838
  444    HD1  PHE  60           HD1      PHE  60  11.816  -4.033  -4.033
  445    HD2  PHE  60           HD2      PHE  60   9.600  -7.029  -7.029
  446    HE1  PHE  60           HE1      PHE  60   9.834  -2.509  -2.509
  447    HE2  PHE  60           HE2      PHE  60   7.619  -5.506  -5.506
  448    HZ   PHE  60           HZ       PHE  60   7.736  -3.245  -3.245
  449    H    LEU  61           HN       LEU  61  15.748  -5.368  -5.368
  450    HA   LEU  61           HA       LEU  61  16.625  -8.103  -8.103
  451   1HB   LEU  61           HB2      LEU  61  18.044  -5.440  -5.440
  452   2HB   LEU  61           HB1      LEU  61  18.828  -6.930  -6.930
  453    HG   LEU  61           HG       LEU  61  16.434  -5.687  -5.687
  454   1HD1  LEU  61          HD11      LEU  61  19.401  -5.430  -5.430
  455   2HD1  LEU  61          HD13      LEU  61  18.292  -5.311  -5.311
  456   3HD1  LEU  61          HD12      LEU  61  18.165  -4.172  -4.172
  457   1HD2  LEU  61          HD22      LEU  61  18.290  -7.991  -7.991
  458   2HD2  LEU  61          HD21      LEU  61  16.548  -8.065  -8.065
  459   3HD2  LEU  61          HD23      LEU  61  17.187  -7.274  -7.274
  460    H    ASP  62           HN       ASP  62  15.900  -6.565  -6.565
  461    HA   ASP  62           HA       ASP  62  18.219  -7.177  -7.177
  462   1HB   ASP  62           HB2      ASP  62  16.733  -6.734  -6.734
  463   2HB   ASP  62           HB1      ASP  62  16.477  -5.540  -5.540
  464    H    ASP  63           HN       ASP  63  15.304  -8.933  -8.933
  465    HA   ASP  63           HA       ASP  63  16.461 -11.298 -11.298
  466   1HB   ASP  63           HB2      ASP  63  13.631 -10.416 -10.416
  467   2HB   ASP  63           HB1      ASP  63  14.015 -12.059 -12.059
  468    H    SER  64           HN       SER  64  16.365 -10.042 -10.042
  469    HA   SER  64           HA       SER  64  16.140 -10.838 -10.838
  470   1HB   SER  64           HB2      SER  64  17.753 -12.882 -12.882
  471   2HB   SER  64           HB1      SER  64  17.752 -12.745 -12.745
  472    HG   SER  64           HG       SER  64  19.084 -11.290 -11.290
  473    H    ILE  67           HN       ILE  67  13.772 -11.805 -11.805
  474    HA   ILE  67           HA       ILE  67  13.182 -14.199 -14.199
  475    HB   ILE  67           HB       ILE  67  12.998 -13.960 -13.960
  476   1HG1  ILE  67          HG12      ILE  67  15.167 -14.672 -14.672
  477   2HG1  ILE  67          HG11      ILE  67  14.394 -15.978 -15.978
  478   1HG2  ILE  67          HG22      ILE  67  11.607 -15.875 -15.875
  479   2HG2  ILE  67          HG21      ILE  67  12.106 -16.401 -16.401
  480   3HG2  ILE  67          HG23      ILE  67  10.975 -15.059 -15.059
  481   1HD1  ILE  67          HD12      ILE  67  13.427 -16.193 -16.193
  482   2HD1  ILE  67          HD11      ILE  67  15.150 -15.864 -15.864
  483   3HD1  ILE  67          HD13      ILE  67  14.604 -17.246 -17.246
  484    H    CYS  68           HN       CYS  68  12.235 -11.143 -11.143
  485    HA   CYS  68           HA       CYS  68   9.328 -11.835 -11.835
  486   1HB   CYS  68           HB2      CYS  68   8.919  -9.699  -9.699
  487   2HB   CYS  68           HB1      CYS  68   9.742 -10.947 -10.947
  488    H    THR  69           HN       THR  69   8.256 -10.795 -10.795
  489    HA   THR  69           HA       THR  69   9.554  -8.500  -8.500
  490    HB   THR  69           HB       THR  69  10.189 -10.612 -10.612
  491    HG1  THR  69           HG1      THR  69   9.998  -9.331  -9.331
  492   1HG2  THR  69          HG21      THR  69   8.190 -11.909 -11.909
  493   2HG2  THR  69          HG23      THR  69   7.215 -11.032 -11.032
  494   3HG2  THR  69          HG22      THR  69   8.514 -12.092 -12.092
  495    H    GLY  70           HN       GLY  70   7.937  -7.211  -7.211
  496   1HA   GLY  70           HA2      GLY  70   5.147  -7.939  -7.939
  497   2HA   GLY  70           HA1      GLY  70   5.488  -6.834  -6.834
  498    H    THR  71           HN       THR  71   3.805  -5.771  -5.771
  499    HA   THR  71           HA       THR  71   5.298  -4.042  -4.042
  500    HB   THR  71           HB       THR  71   2.428  -4.910  -4.910
  501    HG1  THR  71           HG1      THR  71   3.650  -6.597  -6.597
  502   1HG2  THR  71          HG23      THR  71   3.915  -3.025  -3.025
  503   2HG2  THR  71          HG22      THR  71   2.591  -3.974  -3.974
  504   3HG2  THR  71          HG21      THR  71   2.292  -2.883  -2.883
  505    H    SER  72           HN       SER  72   4.407  -1.838  -1.838
  506    HA   SER  72           HA       SER  72   2.797  -0.832  -0.832
  507   1HB   SER  72           HB2      SER  72   4.565   0.215   0.215
  508   2HB   SER  72           HB1      SER  72   5.468  -1.096  -1.096
  509    HG   SER  72           HG       SER  72   6.296   1.102   1.102
  510    H    SER  73           HN       SER  73   1.310   0.412   0.412
  511    HA   SER  73           HA       SER  73   2.412   2.341   2.341
  512   1HB   SER  73           HB2      SER  73   0.261   0.249   0.249
  513   2HB   SER  73           HB1      SER  73   0.536   1.585   1.585
  514    HG   SER  73           HG       SER  73   2.032   0.367   0.367
  515    H    GLY  74           HN       GLY  74   1.160   4.231   4.231
  516   1HA   GLY  74           HA2      GLY  74  -0.308   5.909   5.909
  517   2HA   GLY  74           HA1      GLY  74  -1.515   4.624   4.624
  518    H    ASN  75           HN       ASN  75  -2.484   4.549   4.549
  519    HA   ASN  75           HA       ASN  75  -0.890   5.217   5.217
  520   1HB   ASN  75           HB2      ASN  75  -3.859   5.269   5.269
  521   2HB   ASN  75           HB1      ASN  75  -3.167   5.683   5.683
  522   1HD2  ASN  75          HD22      ASN  75  -1.403   8.577   8.577
  523   2HD2  ASN  75          HD21      ASN  75  -0.909   7.188   7.188
  524    H    GLN  76           HN       GLN  76  -1.307   2.482   2.482
  525    HA   GLN  76           HA       GLN  76  -2.205   0.978   0.978
  526   1HB   GLN  76           HB2      GLN  76  -3.181  -0.666  -0.666
  527   2HB   GLN  76           HB1      GLN  76  -3.867   0.935   0.935
  528   1HG   GLN  76           HG2      GLN  76  -2.246   1.282   1.282
  529   2HG   GLN  76           HG1      GLN  76  -1.669  -0.368  -0.368
  530   1HE2  GLN  76          HE22      GLN  76  -5.130  -1.563  -1.563
  531   2HE2  GLN  76          HE21      GLN  76  -4.215  -1.633  -1.633
  532    H    VAL  77           HN       VAL  77  -0.672  -0.439  -0.439
  533    HA   VAL  77           HA       VAL  77   1.658  -1.013  -1.013
  534    HB   VAL  77           HB       VAL  77   2.947  -1.036  -1.036
  535   1HG1  VAL  77          HG12      VAL  77   1.540   1.208   1.208
  536   2HG1  VAL  77          HG11      VAL  77   1.151   1.022   1.022
  537   3HG1  VAL  77          HG13      VAL  77   2.835   1.149   1.149
  538   1HG2  VAL  77          HG22      VAL  77   0.388  -1.635  -1.635
  539   2HG2  VAL  77          HG21      VAL  77   1.983  -2.356  -2.356
  540   3HG2  VAL  77          HG23      VAL  77   1.619  -0.761  -0.761
  541    H    ASN  78           HN       ASN  78   1.897  -3.124  -3.124
  542    HA   ASN  78           HA       ASN  78   0.246  -5.212  -5.212
  543   1HB   ASN  78           HB2      ASN  78   0.024  -4.579  -4.579
  544   2HB   ASN  78           HB1      ASN  78   1.589  -5.361  -5.361
  545    HD2  ASN  78          HD22      ASN  78  -1.687  -6.771  -6.771
  546    H    LEU  79           HN       LEU  79   1.357  -6.575  -6.575
  547    HA   LEU  79           HA       LEU  79   4.291  -7.000  -7.000
  548   1HB   LEU  79           HB2      LEU  79   2.462  -7.236  -7.236
  549   2HB   LEU  79           HB1      LEU  79   4.146  -7.755  -7.755
  550    HG   LEU  79           HG       LEU  79   3.309  -4.945  -4.945
  551   1HD1  LEU  79          HD13      LEU  79   3.714  -6.201  -6.201
  552   2HD1  LEU  79          HD12      LEU  79   4.409  -4.599  -4.599
  553   3HD1  LEU  79          HD11      LEU  79   2.677  -4.854  -4.854
  554   1HD2  LEU  79          HD23      LEU  79   5.915  -6.337  -6.337
  555   2HD2  LEU  79          HD22      LEU  79   5.505  -5.435  -5.435
  556   3HD2  LEU  79          HD21      LEU  79   5.756  -4.577  -4.577
  557    H    THR  80           HN       THR  80   4.931  -9.082  -9.082
  558    HA   THR  80           HA       THR  80   2.873 -11.273 -11.273
  559    HB   THR  80           HB       THR  80   5.089 -10.815 -10.815
  560    HG1  THR  80           HG1      THR  80   3.708  -9.497  -9.497
  561   1HG2  THR  80          HG22      THR  80   3.069 -12.954 -12.954
  562   2HG2  THR  80          HG21      THR  80   3.388 -12.486 -12.486
  563   3HG2  THR  80          HG23      THR  80   4.703 -13.072 -13.072
  564    H    ILE  81           HN       ILE  81   3.533 -13.223 -13.223
  565    HA   ILE  81           HA       ILE  81   6.385 -13.437 -13.437
  566    HB   ILE  81           HB       ILE  81   3.777 -14.493 -14.493
  567   1HG1  ILE  81          HG12      ILE  81   5.714 -12.574 -12.574
  568   2HG1  ILE  81          HG11      ILE  81   4.426 -12.001 -12.001
  569   1HG2  ILE  81          HG22      ILE  81   5.670 -16.071 -16.071
  570   2HG2  ILE  81          HG21      ILE  81   6.606 -14.756 -14.756
  571   3HG2  ILE  81          HG23      ILE  81   5.139 -15.330 -15.330
  572   1HD1  ILE  81          HD12      ILE  81   2.939 -13.598 -13.598
  573   2HD1  ILE  81          HD11      ILE  81   4.231 -13.297 -13.297
  574   3HD1  ILE  81          HD13      ILE  81   3.309 -11.947 -11.947
  575    H    GLN  82           HN       GLN  82   7.497 -15.230 -15.230
  576    HA   GLN  82           HA       GLN  82   5.875 -17.417 -17.417
  577   1HB   GLN  82           HB2      GLN  82   8.622 -16.359 -16.359
  578   2HB   GLN  82           HB1      GLN  82   7.800 -17.706 -17.706
  579   1HG   GLN  82           HG2      GLN  82   5.977 -16.234 -16.234
  580   2HG   GLN  82           HG1      GLN  82   6.721 -14.878 -14.878
  581   1HE2  GLN  82          HE22      GLN  82   8.167 -14.123 -14.123
  582   2HE2  GLN  82          HE21      GLN  82   6.994 -13.670 -13.670
  583    H    GLY  83           HN       GLY  83   6.037 -19.240 -19.240
  584   1HA   GLY  83           HA2      GLY  83   7.558 -21.092 -21.092
  585   2HA   GLY  83           HA1      GLY  83   8.586 -19.856 -19.856
  586    H    LEU  84           HN       LEU  84   5.042 -20.060 -20.060
  587    HA   LEU  84           HA       LEU  84   5.223 -19.925 -19.925
  588   1HB   LEU  84           HB2      LEU  84   3.029 -19.618 -19.618
  589   2HB   LEU  84           HB1      LEU  84   2.733 -19.522 -19.522
  590    HG   LEU  84           HG       LEU  84   4.801 -17.821 -17.821
  591   1HD1  LEU  84          HD12      LEU  84   1.877 -17.294 -17.294
  592   2HD1  LEU  84          HD11      LEU  84   3.039 -16.004 -16.004
  593   3HD1  LEU  84          HD13      LEU  84   2.704 -17.207 -17.207
  594   1HD2  LEU  84          HD21      LEU  84   3.744 -18.136 -18.136
  595   2HD2  LEU  84          HD23      LEU  84   5.330 -17.589 -17.589
  596   3HD2  LEU  84          HD22      LEU  84   3.965 -16.474 -16.474
  597    H    ARG  85           HN       ARG  85   5.134 -21.786 -21.786
  598    HA   ARG  85           HA       ARG  85   3.816 -24.197 -24.197
  599   1HB   ARG  85           HB2      ARG  85   5.734 -23.748 -23.748
  600   2HB   ARG  85           HB1      ARG  85   5.106 -25.326 -25.326
  601   1HG   ARG  85           HG2      ARG  85   6.334 -23.661 -23.661
  602   2HG   ARG  85           HG1      ARG  85   7.429 -24.373 -24.373
  603   1HD   ARG  85           HD2      ARG  85   6.513 -26.613 -26.613
  604   2HD   ARG  85           HD1      ARG  85   5.370 -25.911 -25.911
  605    HE   ARG  85           HE       ARG  85   7.155 -25.596 -25.596
  606   1HH1  ARG  85          HH21      ARG  85   8.395 -26.295 -26.295
  607   2HH1  ARG  85          HH22      ARG  85  10.019 -26.474 -26.474
  608   1HH2  ARG  85          HH11      ARG  85   9.271 -25.835 -25.835
  609   2HH2  ARG  85          HH12      ARG  85  10.513 -26.216 -26.216
  610    H    ALA  86           HN       ALA  86   2.801 -25.564 -25.564
  611    HA   ALA  86           HA       ALA  86   0.511 -24.160 -24.160
  612   1HB   ALA  86           HB3      ALA  86   1.935 -26.719 -26.719
  613   2HB   ALA  86           HB2      ALA  86   0.444 -26.224 -26.224
  614   3HB   ALA  86           HB1      ALA  86   0.451 -26.535 -26.535
  615    H    MET  87           HN       MET  87   3.635 -24.885 -24.885
  616    HA   MET  87           HA       MET  87   3.031 -23.871 -23.871
  617   1HB   MET  87           HB2      MET  87   4.876 -25.424 -25.424
  618   2HB   MET  87           HB1      MET  87   5.665 -24.108 -24.108
  619   1HG   MET  87           HG2      MET  87   5.669 -22.796 -22.796
  620   2HG   MET  87           HG1      MET  87   5.094 -24.249 -24.249
  621   1HE   MET  87           HE2      MET  87   5.960 -26.382 -26.382
  622   2HE   MET  87           HE1      MET  87   7.010 -26.680 -26.680
  623   3HE   MET  87           HE3      MET  87   7.662 -26.757 -26.757
  624    H    ASP  88           HN       ASP  88   4.283 -22.370 -22.370
  625    HA   ASP  88           HA       ASP  88   5.145 -19.889 -19.889
  626   1HB   ASP  88           HB2      ASP  88   4.267 -20.673 -20.673
  627   2HB   ASP  88           HB1      ASP  88   5.050 -19.142 -19.142
  628    H    THR  89           HN       THR  89   1.947 -21.060 -21.060
  629    HA   THR  89           HA       THR  89   0.482 -18.795 -18.795
  630    HB   THR  89           HB       THR  89  -0.278 -20.879 -20.879
  631    HG1  THR  89           HG1      THR  89  -0.696 -22.193 -22.193
  632   1HG2  THR  89          HG23      THR  89  -1.762 -18.822 -18.822
  633   2HG2  THR  89          HG22      THR  89  -2.046 -19.609 -19.609
  634   3HG2  THR  89          HG21      THR  89  -2.509 -20.417 -20.417
  635    H    GLY  90           HN       GLY  90  -0.087 -16.955 -16.955
  636   1HA   GLY  90           HA2      GLY  90  -0.387 -16.681 -16.681
  637   2HA   GLY  90           HA1      GLY  90   1.270 -16.234 -16.234
  638    H    LEU  91           HN       LEU  91   0.789 -14.049 -14.049
  639    HA   LEU  91           HA       LEU  91  -1.038 -12.523 -12.523
  640   1HB   LEU  91           HB2      LEU  91  -1.457 -12.556 -12.556
  641   2HB   LEU  91           HB1      LEU  91   0.146 -11.868 -11.868
  642    HG   LEU  91           HG       LEU  91  -0.631  -9.994  -9.994
  643   1HD1  LEU  91          HD12      LEU  91  -2.680 -11.305 -11.305
  644   2HD1  LEU  91          HD11      LEU  91  -3.328 -10.989 -10.989
  645   3HD1  LEU  91          HD13      LEU  91  -2.998  -9.646  -9.646
  646   1HD2  LEU  91          HD21      LEU  91  -0.420 -10.057 -10.057
  647   2HD2  LEU  91          HD23      LEU  91  -1.208  -8.693  -8.693
  648   3HD2  LEU  91          HD22      LEU  91  -2.181  -9.972  -9.972
  649    H    TYR  92           HN       TYR  92  -0.179 -11.136 -11.136
  650    HA   TYR  92           HA       TYR  92   2.651 -10.239 -10.239
  651   1HB   TYR  92           HB2      TYR  92   0.922 -10.869 -10.869
  652   2HB   TYR  92           HB1      TYR  92   2.333  -9.822  -9.822
  653    HD1  TYR  92           HD1      TYR  92   1.175 -13.255 -13.255
  654    HD2  TYR  92           HD2      TYR  92   4.602 -10.670 -10.670
  655    HE1  TYR  92           HE1      TYR  92   2.678 -15.255 -15.255
  656    HE2  TYR  92           HE2      TYR  92   6.106 -12.666 -12.666
  657    HH   TYR  92           HH       TYR  92   5.363 -15.518 -15.518
  658    H    ILE  93           HN       ILE  93   3.028  -7.989  -7.989
  659    HA   ILE  93           HA       ILE  93   0.570  -6.286  -6.286
  660    HB   ILE  93           HB       ILE  93   3.379  -5.991  -5.991
  661   1HG1  ILE  93          HG12      ILE  93   1.950  -5.955  -5.955
  662   2HG1  ILE  93          HG11      ILE  93   0.707  -6.705  -6.705
  663   1HG2  ILE  93          HG22      ILE  93   1.165  -4.037  -4.037
  664   2HG2  ILE  93          HG21      ILE  93   1.910  -4.089  -4.089
  665   3HG2  ILE  93          HG23      ILE  93   2.897  -3.757  -3.757
  666   1HD1  ILE  93          HD13      ILE  93   3.498  -7.818  -7.818
  667   2HD1  ILE  93          HD12      ILE  93   2.340  -8.235  -8.235
  668   3HD1  ILE  93          HD11      ILE  93   1.998  -8.638  -8.638
  669    H    CYS  94           HN       CYS  94   0.427  -4.460  -4.460
  670    HA   CYS  94           HA       CYS  94   2.576  -4.073  -4.073
  671   1HB   CYS  94           HB2      CYS  94   0.820  -3.147  -3.147
  672   2HB   CYS  94           HB1      CYS  94   0.158  -4.614  -4.614
  673    H    LYS  95           HN       LYS  95   3.907  -2.390  -2.390
  674    HA   LYS  95           HA       LYS  95   2.875  -0.286  -0.286
  675   1HB   LYS  95           HB2      LYS  95   4.923  -1.671  -1.671
  676   2HB   LYS  95           HB1      LYS  95   5.685  -0.932  -0.932
  677   1HG   LYS  95           HG2      LYS  95   6.300   0.821   0.821
  678   2HG   LYS  95           HG1      LYS  95   4.602   1.189   1.189
  679   1HD   LYS  95           HD2      LYS  95   4.550  -0.156  -0.156
  680   2HD   LYS  95           HD1      LYS  95   6.090  -0.921  -0.921
  681   1HE   LYS  95           HE2      LYS  95   7.210   1.316   1.316
  682   2HE   LYS  95           HE1      LYS  95   5.664   1.977   1.977
  683   1HZ   LYS  95           HZ1      LYS  95   5.635   0.080   0.080
  684   2HZ   LYS  95           HZ3      LYS  95   7.253  -0.212  -0.212
  685   3HZ   LYS  95           HZ2      LYS  95   6.812   1.269   1.269
  686    H    VAL  96           HN       VAL  96   2.826   1.875   1.875
  687    HA   VAL  96           HA       VAL  96   3.968   2.600   2.600
  688    HB   VAL  96           HB       VAL  96   1.134   3.197   3.197
  689   1HG1  VAL  96          HG12      VAL  96   2.819   3.964   3.964
  690   2HG1  VAL  96          HG11      VAL  96   1.301   3.237   3.237
  691   3HG1  VAL  96          HG13      VAL  96   1.286   4.646   4.646
  692   1HG2  VAL  96          HG23      VAL  96   2.224   0.873   0.873
  693   2HG2  VAL  96          HG22      VAL  96   1.061   0.861   0.861
  694   3HG2  VAL  96          HG21      VAL  96   0.576   1.452   1.452
  695    H    GLU  97           HN       GLU  97   5.399   4.197   4.197
  696    HA   GLU  97           HA       GLU  97   4.056   6.384   6.384
  697   1HB   GLU  97           HB2      GLU  97   6.717   5.040   5.040
  698   2HB   GLU  97           HB1      GLU  97   6.097   6.428   6.428
  699   1HG   GLU  97           HG2      GLU  97   4.072   5.042   5.042
  700   2HG   GLU  97           HG1      GLU  97   4.845   3.660   3.660
  701    H    LEU  98           HN       LEU  98   4.398   8.343   8.343
  702    HA   LEU  98           HA       LEU  98   6.531   8.770   8.770
  703   1HB   LEU  98           HB2      LEU  98   4.332  10.410  10.410
  704   2HB   LEU  98           HB1      LEU  98   5.482  11.130  11.130
  705    HG   LEU  98           HG       LEU  98   4.832   9.223   9.223
  706   1HD1  LEU  98          HD12      LEU  98   2.792   8.927   8.927
  707   2HD1  LEU  98          HD11      LEU  98   2.372   8.526   8.526
  708   3HD1  LEU  98          HD13      LEU  98   3.697   7.681   7.681
  709   1HD2  LEU  98          HD23      LEU  98   2.817  11.345  11.345
  710   2HD2  LEU  98          HD22      LEU  98   4.106  11.511  11.511
  711   3HD2  LEU  98          HD21      LEU  98   2.749  10.428  10.428
  712    H    MET  99           HN       MET  99   8.115   8.079   8.079
  713    HA   MET  99           HA       MET  99   8.479   9.548   9.548
  714   1HB   MET  99           HB2      MET  99   8.994   7.139   7.139
  715   2HB   MET  99           HB1      MET  99  10.384   7.690   7.690
  716   1HG   MET  99           HG2      MET  99  11.070   7.142   7.142
  717   2HG   MET  99           HG1      MET  99  11.253   8.869   8.869
  718   1HE   MET  99           HE2      MET  99   8.769   6.264   6.264
  719   2HE   MET  99           HE1      MET  99   9.092   6.247   6.247
  720   3HE   MET  99           HE3      MET  99   7.581   6.937   6.937
  721    H    TYR 100           HN       TYR 100  10.472   9.310   9.310
  722    HA   TYR 100           HA       TYR 100  12.415  11.253  11.253
  723   1HB   TYR 100           HB2      TYR 100  11.586  10.149  10.149
  724   2HB   TYR 100           HB1      TYR 100  12.982  11.202  11.202
  725    HD1  TYR 100           HD2      TYR 100  14.932  10.484  10.484
  726    HD2  TYR 100           HD1      TYR 100  11.541   7.885   7.885
  727    HE1  TYR 100           HE2      TYR 100  16.287   8.518   8.518
  728    HE2  TYR 100           HE1      TYR 100  12.893   5.917   5.917
  729    HH   TYR 100           HH       TYR 100  16.133   5.881   5.881
  730    HA   PRO 101           HA       PRO 101  10.014  14.443  14.443
  731   1HB   PRO 101           HB2      PRO 101   7.498  13.962  13.962
  732   2HB   PRO 101           HB1      PRO 101   8.965  13.535  13.535
  733   1HG   PRO 101           HG2      PRO 101   7.083  11.832  11.832
  734   2HG   PRO 101           HG1      PRO 101   8.142  11.439  11.439
  735   1HD   PRO 101           HD2      PRO 101   8.567  10.836  10.836
  736   2HD   PRO 101           HD1      PRO 101   9.713  10.585  10.585
  737    HA   PRO 102           HA       PRO 102   7.623  15.217  15.217
  738   1HB   PRO 102           HB2      PRO 102   8.648  17.770  17.770
  739   2HB   PRO 102           HB1      PRO 102   9.530  16.235  16.235
  740   1HG   PRO 102           HG2      PRO 102   9.879  18.276  18.276
  741   2HG   PRO 102           HG1      PRO 102  11.064  17.175  17.175
  742   1HD   PRO 102           HD2      PRO 102   9.672  16.930  16.930
  743   2HD   PRO 102           HD1      PRO 102  10.757  15.763  15.763
  744    HA   PRO 103           HA       PRO 103   6.924  16.394  16.394
  745   1HB   PRO 103           HB2      PRO 103   5.068  16.418  16.418
  746   2HB   PRO 103           HB1      PRO 103   6.274  17.720  17.720
  747   1HG   PRO 103           HG2      PRO 103   3.552  17.823  17.823
  748   2HG   PRO 103           HG1      PRO 103   4.733  18.948  18.948
  749   1HD   PRO 103           HD2      PRO 103   3.669  16.459  16.459
  750   2HD   PRO 103           HD1      PRO 103   3.509  18.080  18.080
  751    H    TYR 104           HN       TYR 104   6.318  14.342  14.342
  752    HA   TYR 104           HA       TYR 104   5.165  12.119  12.119
  753   1HB   TYR 104           HB2      TYR 104   7.130  11.791  11.791
  754   2HB   TYR 104           HB1      TYR 104   6.277  12.407  12.407
  755    HD1  TYR 104           HD1      TYR 104   4.790  10.221  10.221
  756    HD2  TYR 104           HD2      TYR 104   6.396  10.459  10.459
  757    HE1  TYR 104           HE1      TYR 104   4.021   7.886   7.886
  758    HE2  TYR 104           HE2      TYR 104   5.630   8.105   8.105
  759    HH   TYR 104           HH       TYR 104   3.676   6.586   6.586
  760    H    TYR 105           HN       TYR 105   3.096  11.565  11.565
  761    HA   TYR 105           HA       TYR 105   1.314  11.864  11.864
  762   1HB   TYR 105           HB2      TYR 105   1.450  13.953  13.953
  763   2HB   TYR 105           HB1      TYR 105   0.769  12.999  12.999
  764    HD1  TYR 105           HD2      TYR 105   0.173  14.005  14.005
  765    HD2  TYR 105           HD1      TYR 105  -1.509  12.611  12.611
  766    HE1  TYR 105           HE2      TYR 105  -2.129  14.398  14.398
  767    HE2  TYR 105           HE1      TYR 105  -3.817  12.997  12.997
  768    HH   TYR 105           HH       TYR 105  -4.666  13.087  13.087
  769    H    LEU 106           HN       LEU 106   1.985   9.371   9.371
  770    HA   LEU 106           HA       LEU 106  -0.369   8.449   8.449
  771   1HB   LEU 106           HB2      LEU 106   2.366   8.377   8.377
  772   2HB   LEU 106           HB1      LEU 106   1.956   6.719   6.719
  773    HG   LEU 106           HG       LEU 106   1.528   7.096   7.096
  774   1HD1  LEU 106          HD13      LEU 106  -0.983   6.829   6.829
  775   2HD1  LEU 106          HD12      LEU 106  -0.934   6.532   6.532
  776   3HD1  LEU 106          HD11      LEU 106   0.012   5.523   5.523
  777   1HD2  LEU 106          HD22      LEU 106   0.992   9.643   9.643
  778   2HD2  LEU 106          HD21      LEU 106   0.251   8.856   8.856
  779   3HD2  LEU 106          HD23      LEU 106  -0.665   9.048   9.048
  780    H    GLY 108           HN       GLY 108   0.462   5.614   5.614
  781   1HA   GLY 108           HA2      GLY 108   0.663   5.183   5.183
  782   2HA   GLY 108           HA1      GLY 108  -0.957   4.900   4.900
  783    H    ILE 109           HN       ILE 109  -0.355   2.653   2.653
  784    HA   ILE 109           HA       ILE 109   1.144   1.124   1.124
  785    HB   ILE 109           HB       ILE 109   0.831   0.750   0.750
  786   1HG1  ILE 109          HG12      ILE 109   3.250   1.329   1.329
  787   2HG1  ILE 109          HG11      ILE 109   2.358   2.551   2.551
  788   1HG2  ILE 109          HG22      ILE 109   0.901  -1.401  -1.401
  789   2HG2  ILE 109          HG21      ILE 109   2.488  -0.904  -0.904
  790   3HG2  ILE 109          HG23      ILE 109   2.227  -1.197  -1.197
  791   1HD1  ILE 109          HD13      ILE 109   3.641   0.105   0.105
  792   2HD1  ILE 109          HD12      ILE 109   4.305   1.734   1.734
  793   3HD1  ILE 109          HD11      ILE 109   2.788   1.350   1.350
  794    H    GLY 110           HN       GLY 110   0.224  -1.003  -1.003
  795   1HA   GLY 110           HA2      GLY 110  -2.697  -1.113  -1.113
  796   2HA   GLY 110           HA1      GLY 110  -1.711  -2.273  -2.273
  797    H    ASN 111           HN       ASN 111  -3.762  -2.522  -2.522
  798    HA   ASN 111           HA       ASN 111  -2.365  -3.387  -3.387
  799   1HB   ASN 111           HB2      ASN 111  -5.047  -4.075  -4.075
  800   2HB   ASN 111           HB1      ASN 111  -4.541  -4.697  -4.697
  801    HD2  ASN 111          HD22      ASN 111  -3.318  -1.278  -1.278
  802    H    GLY 112           HN       GLY 112  -3.015  -5.039  -5.039
  803   1HA   GLY 112           HA2      GLY 112  -1.277  -6.755  -6.755
  804   2HA   GLY 112           HA1      GLY 112  -1.508  -7.400  -7.400
  805    H    THR 113           HN       THR 113  -1.810  -8.611  -8.611
  806    HA   THR 113           HA       THR 113  -4.697  -9.453  -9.453
  807    HB   THR 113           HB       THR 113  -2.590  -9.556  -9.556
  808    HG1  THR 113           HG1      THR 113  -4.862  -7.902  -7.902
  809   1HG2  THR 113          HG22      THR 113  -5.521 -10.316 -10.316
  810   2HG2  THR 113          HG21      THR 113  -4.592 -10.096 -10.096
  811   3HG2  THR 113          HG23      THR 113  -4.146 -11.371 -11.371
  812    H    GLN 114           HN       GLN 114  -4.985 -11.624 -11.624
  813    HA   GLN 114           HA       GLN 114  -2.609 -13.262 -13.262
  814   1HB   GLN 114           HB2      GLN 114  -4.711 -13.165 -13.165
  815   2HB   GLN 114           HB1      GLN 114  -5.561 -13.966 -13.966
  816   1HG   GLN 114           HG2      GLN 114  -4.972 -15.858 -15.858
  817   2HG   GLN 114           HG1      GLN 114  -3.450 -15.640 -15.640
  818   1HE2  GLN 114          HE22      GLN 114  -2.064 -15.838 -15.838
  819   2HE2  GLN 114          HE21      GLN 114  -2.379 -16.728 -16.728
  820    H    ILE 115           HN       ILE 115  -1.637 -14.441 -14.441
  821    HA   ILE 115           HA       ILE 115  -3.125 -14.902 -14.902
  822    HB   ILE 115           HB       ILE 115  -0.278 -15.422 -15.422
  823   1HG1  ILE 115          HG12      ILE 115  -1.321 -13.554 -13.554
  824   2HG1  ILE 115          HG11      ILE 115  -1.119 -13.056 -13.056
  825   1HG2  ILE 115          HG23      ILE 115  -1.566 -15.975 -15.975
  826   2HG2  ILE 115          HG22      ILE 115   0.178 -15.860 -15.860
  827   3HG2  ILE 115          HG21      ILE 115  -0.739 -17.130 -17.130
  828   1HD1  ILE 115          HD13      ILE 115   1.305 -14.222 -14.222
  829   2HD1  ILE 115          HD12      ILE 115   0.919 -13.552 -13.552
  830   3HD1  ILE 115          HD11      ILE 115   0.987 -12.494 -12.494
  831    H    TYR 116           HN       TYR 116  -4.338 -16.708 -16.708
  832    HA   TYR 116           HA       TYR 116  -4.002 -19.047 -19.047
  833   1HB   TYR 116           HB2      TYR 116  -6.015 -18.060 -18.060
  834   2HB   TYR 116           HB1      TYR 116  -6.092 -19.712 -19.712
  835    HD1  TYR 116           HD1      TYR 116  -4.863 -18.156 -18.156
  836    HD2  TYR 116           HD2      TYR 116  -8.460 -18.160 -18.160
  837    HE1  TYR 116           HE1      TYR 116  -6.204 -17.427 -17.427
  838    HE2  TYR 116           HE2      TYR 116  -9.792 -17.444 -17.444
  839    HH   TYR 116           HH       TYR 116  -8.393 -16.247 -16.247
  840    H    VAL 117           HN       VAL 117  -2.678 -20.711 -20.711
  841    HA   VAL 117           HA       VAL 117  -1.957 -20.959 -20.959
  842    HB   VAL 117           HB       VAL 117  -1.235 -22.555 -22.555
  843   1HG1  VAL 117          HG12      VAL 117  -0.231 -22.704 -22.704
  844   2HG1  VAL 117          HG11      VAL 117   0.629 -23.419 -23.419
  845   3HG1  VAL 117          HG13      VAL 117  -0.982 -23.997 -23.997
  846   1HG2  VAL 117          HG23      VAL 117  -0.479 -20.101 -20.101
  847   2HG2  VAL 117          HG22      VAL 117   0.781 -21.296 -21.296
  848   3HG2  VAL 117          HG21      VAL 117   0.516 -20.690 -20.690
  849    H    ILE 118           HN       ILE 118  -2.172 -23.155 -23.155
  850    HA   ILE 118           HA       ILE 118  -4.881 -24.261 -24.261
  851    HB   ILE 118           HB       ILE 118  -2.944 -24.388 -24.388
  852   1HG1  ILE 118          HG12      ILE 118  -3.778 -22.134 -22.134
  853   2HG1  ILE 118          HG11      ILE 118  -4.545 -22.827 -22.827
  854   1HG2  ILE 118          HG21      ILE 118  -5.688 -25.528 -25.528
  855   2HG2  ILE 118          HG23      ILE 118  -5.193 -25.028 -25.028
  856   3HG2  ILE 118          HG22      ILE 118  -4.282 -26.272 -26.272
  857   1HD1  ILE 118          HD13      ILE 118  -6.253 -23.600 -23.600
  858   2HD1  ILE 118          HD12      ILE 118  -5.734 -22.009 -22.009
  859   3HD1  ILE 118          HD11      ILE 118  -6.488 -22.188 -22.188
  860    H    ASP 119           HN       ASP 119  -5.147 -26.427 -26.427
  861    HA   ASP 119           HA       ASP 119  -2.665 -28.063 -28.063
  862   1HB   ASP 119           HB2      ASP 119  -3.999 -27.424 -27.424
  863   2HB   ASP 119           HB1      ASP 119  -5.399 -28.238 -28.238
  864    HA   PRO 120           HA       PRO 120  -4.537 -30.449 -30.449
  865   1HB   PRO 120           HB2      PRO 120  -2.671 -32.452 -32.452
  866   2HB   PRO 120           HB1      PRO 120  -2.414 -30.853 -30.853
  867   1HG   PRO 120           HG2      PRO 120  -1.436 -31.925 -31.925
  868   2HG   PRO 120           HG1      PRO 120  -0.599 -30.915 -30.915
  869   1HD   PRO 120           HD2      PRO 120  -1.669 -29.918 -29.918
  870   2HD   PRO 120           HD1      PRO 120  -1.546 -28.975 -28.975
  871    H    GLU 121           HN       GLU 121  -5.780 -32.381 -32.381
  872    HA   GLU 121           HA       GLU 121  -5.936 -33.966 -33.966
  873   1HB   GLU 121           HB2      GLU 121  -8.110 -33.004 -33.004
  874   2HB   GLU 121           HB1      GLU 121  -8.391 -34.070 -34.070
  875   1HG   GLU 121           HG2      GLU 121  -7.563 -32.361 -32.361
  876   2HG   GLU 121           HG1      GLU 121  -7.166 -31.302 -31.302
  877    HA   PRO 122           HA       PRO 122  -5.298 -37.481 -37.481
  878   1HB   PRO 122           HB2      PRO 122  -6.690 -39.410 -39.410
  879   2HB   PRO 122           HB1      PRO 122  -5.113 -38.788 -38.788
  880   1HG   PRO 122           HG2      PRO 122  -7.845 -38.067 -38.067
  881   2HG   PRO 122           HG1      PRO 122  -6.357 -38.317 -38.317
  882   1HD   PRO 122           HD2      PRO 122  -7.301 -35.854 -35.854
  883   2HD   PRO 122           HD1      PRO 122  -5.562 -36.203 -36.203
  884    H    CYS 123           HN       CYS 123  -8.586 -36.576 -36.576
  885    HA   CYS 123           HA       CYS 123  -9.526 -37.618 -37.618
  886   1HB   CYS 123           HB2      CYS 123 -10.814 -37.929 -37.929
  887   2HB   CYS 123           HB1      CYS 123 -11.588 -38.380 -38.380
  888    HG   CYS 123           HG       CYS 123  -9.586 -40.112 -40.112
  889    HA   PRO 124           HA       PRO 124 -11.078 -33.409 -33.409
  890   1HB   PRO 124           HB2      PRO 124 -12.474 -33.532 -33.532
  891   2HB   PRO 124           HB1      PRO 124 -10.708 -33.363 -33.363
  892   1HG   PRO 124           HG2      PRO 124 -12.358 -35.787 -35.787
  893   2HG   PRO 124           HG1      PRO 124 -10.833 -35.282 -35.282
  894   1HD   PRO 124           HD2      PRO 124 -10.993 -37.183 -37.183
  895   2HD   PRO 124           HD1      PRO 124  -9.564 -36.156 -36.156
  896    H    ASP 125           HN       ASP 125 -13.022 -36.310 -36.310
  897    HA   ASP 125           HA       ASP 125 -15.534 -34.792 -34.792
  898   1HB   ASP 125           HB2      ASP 125 -14.881 -37.696 -37.696
  899   2HB   ASP 125           HB1      ASP 125 -16.517 -37.089 -37.089
  900    H    SER 126           HN       SER 126 -16.576 -34.874 -34.874
  901    HA   SER 126           HA       SER 126 -15.099 -36.003 -36.003
  902   1HB   SER 126           HB2      SER 126 -16.627 -34.610 -34.610
  903   2HB   SER 126           HB1      SER 126 -16.079 -33.684 -33.684
  904    HG   SER 126           HG       SER 126 -18.525 -34.102 -34.102
  905    H    ASP 127           HN       ASP 127 -17.383 -37.240 -37.240
  906    HA   ASP 127           HA       ASP 127 -19.333 -38.455 -38.455
  907   1HB   ASP 127           HB2      ASP 127 -18.132 -39.282 -39.282
  908   2HB   ASP 127           HB1      ASP 127 -19.603 -39.974 -39.974
  909    H    GLN 128           HN       GLN 128 -16.003 -39.317 -39.317
  910    HA   GLN 128           HA       GLN 128 -16.279 -42.047 -42.047
  911   1HB   GLN 128           HB2      GLN 128 -13.946 -40.378 -40.378
  912   2HB   GLN 128           HB1      GLN 128 -13.830 -42.081 -42.081
  913   1HG   GLN 128           HG2      GLN 128 -15.679 -40.982 -40.982
  914   2HG   GLN 128           HG1      GLN 128 -14.129 -41.760 -41.760
  915   1HE2  GLN 128          HE22      GLN 128 -15.345 -45.028 -45.028
  916   2HE2  GLN 128          HE21      GLN 128 -13.958 -44.055 -44.055
  917    H    GLU 129           HN       GLU 129 -16.076 -39.048 -39.048
  918    HA   GLU 129           HA       GLU 129 -14.019 -39.325 -39.325
  919   1HB   GLU 129           HB2      GLU 129 -16.696 -37.922 -37.922
  920   2HB   GLU 129           HB1      GLU 129 -15.554 -37.735 -37.735
  921   1HG   GLU 129           HG2      GLU 129 -13.817 -37.034 -37.034
  922   2HG   GLU 129           HG1      GLU 129 -15.063 -37.076 -37.076
  923    HA   PRO 130           HA       PRO 130 -17.227 -41.377 -41.377
  924   1HB   PRO 130           HB2      PRO 130 -19.415 -42.587 -42.587
  925   2HB   PRO 130           HB1      PRO 130 -19.418 -40.906 -40.906
  926   1HG   PRO 130           HG2      PRO 130 -19.174 -41.968 -41.968
  927   2HG   PRO 130           HG1      PRO 130 -20.031 -40.536 -40.536
  928   1HD   PRO 130           HD2      PRO 130 -17.616 -40.446 -40.446
  929   2HD   PRO 130           HD1      PRO 130 -18.161 -39.226 -39.226
  930    H    LYS 131           HN       LYS 131 -17.152 -43.610 -43.610
  931    HA   LYS 131           HA       LYS 131 -15.460 -45.303 -45.303
  932   1HB   LYS 131           HB2      LYS 131 -16.909 -45.714 -45.714
  933   2HB   LYS 131           HB1      LYS 131 -15.715 -46.830 -46.830
  934   1HG   LYS 131           HG2      LYS 131 -15.095 -43.905 -43.905
  935   2HG   LYS 131           HG1      LYS 131 -14.854 -45.109 -45.109
  936   1HD   LYS 131           HD2      LYS 131 -13.690 -45.448 -45.448
  937   2HD   LYS 131           HD1      LYS 131 -12.826 -44.596 -44.596
  938   1HE   LYS 131           HE2      LYS 131 -12.921 -46.591 -46.591
  939   2HE   LYS 131           HE1      LYS 131 -13.849 -47.454 -47.454
  940   1HZ   LYS 131           HZ3      LYS 131 -11.173 -46.234 -46.234
  941   2HZ   LYS 131           HZ2      LYS 131 -11.440 -47.888 -47.888
  942   3HZ   LYS 131           HZ1      LYS 131 -12.056 -47.150 -47.150
  943    H1   NAG 132           H1       NAG 132  -4.155  -2.908  -2.908
  944    H2   NAG 132           H2       NAG 132  -1.890  -0.841  -0.841
  945    H3   NAG 132           H3       NAG 132  -2.362  -2.902  -2.902
  946    H4   NAG 132           H4       NAG 132  -2.585   0.144   0.144
  947    H5   NAG 132           H5       NAG 132  -4.866  -1.884  -1.884
  948   1H6   NAG 132           H61      NAG 132  -4.568   0.932   0.932
  949   2H6   NAG 132           H62      NAG 132  -5.684   0.777   0.777
  950   1H8   NAG 132           H81      NAG 132   0.768  -0.993  -0.993
  951   2H8   NAG 132           H82      NAG 132   0.343  -2.399  -2.399
  952   3H8   NAG 132           H83      NAG 132  -0.926  -1.251  -1.251
  953    HN2  NAG 132           HN2      NAG 132  -1.913  -3.706  -3.706
  954    HO3  NAG 132           HO3      NAG 132  -0.368  -2.448  -2.448
  955    H1   NAG 133           H1       NAG 133  -2.448   0.767   0.767
  956    H2   NAG 133           H2       NAG 133  -2.196  -1.668  -1.668
  957    H3   NAG 133           H3       NAG 133  -1.792   1.253   1.253
  958    H4   NAG 133           H4       NAG 133   0.336  -0.962  -0.962
  959    H5   NAG 133           H5       NAG 133  -0.116   1.411   1.411
  960   1H6   NAG 133           H61      NAG 133   1.834  -0.887  -0.887
  961   2H6   NAG 133           H62      NAG 133   2.180   0.856   0.856
  962   1H8   NAG 133           H81      NAG 133  -6.281  -1.099  -1.099
  963   2H8   NAG 133           H82      NAG 133  -6.621  -1.611  -1.611
  964   3H8   NAG 133           H83      NAG 133  -6.199   0.105   0.105
  965    HN2  NAG 133           HN2      NAG 133  -4.078   0.646   0.646
  966    HO3  NAG 133           HO3      NAG 133  -1.305   0.471   0.471
  967    HO6  NAG 133           HO6      NAG 133   2.427   0.129   0.129
  968    H1   FUC 134           H1       FUC 134  -6.797   0.546   0.546
  969    H2   FUC 134           H2       FUC 134  -8.629  -1.272  -1.272
  970    H3   FUC 134           H3       FUC 134  -9.907   1.474   1.474
  971    H4   FUC 134           H4       FUC 134 -11.201   0.751   0.751
  972    H5   FUC 134           H5       FUC 134  -8.916   1.902   1.902
  973   1H6   FUC 134           H61      FUC 134  -8.580   1.053   1.053
  974   2H6   FUC 134           H62      FUC 134 -10.343   0.910   0.910
  975   3H6   FUC 134           H63      FUC 134  -9.296  -0.536  -0.536
  976    HO2  FUC 134           HO2      FUC 134  -9.005  -0.046  -0.046
  977    HO3  FUC 134           HO3      FUC 134 -10.701  -1.168  -1.168
  978    HO4  FUC 134           HO4      FUC 134 -11.006  -1.502  -1.502
  979    H1   MAN 135           H1       MAN 135   1.330  -0.569  -0.569
  980    H2   MAN 135           H2       MAN 135   3.007  -0.473  -0.473
  981    H3   MAN 135           H3       MAN 135   3.858  -1.323  -1.323
  982    H4   MAN 135           H4       MAN 135   4.573   1.549   1.549
  983    H5   MAN 135           H5       MAN 135   2.363  -0.251  -0.251
  984   1H6   MAN 135           H61      MAN 135   3.729   1.739   1.739
  985   2H6   MAN 135           H62      MAN 135   2.417   2.658   2.658
  986    HO2  MAN 135           HO2      MAN 135   3.633   2.115   2.115
  987    HO3  MAN 135           HO3      MAN 135   6.024  -0.794  -0.794
  988    HO4  MAN 135           HO4      MAN 135   4.737  -0.967  -0.967
  989    HO6  MAN 135           HO6      MAN 135   2.195   0.450   0.450
  990    H1   NAG 136           H1       NAG 136   0.892  -7.840  -7.840
  991    H2   NAG 136           H2       NAG 136  -1.970  -8.724  -8.724
  992    H3   NAG 136           H3       NAG 136   0.728  -9.926  -9.926
  993    H4   NAG 136           H4       NAG 136  -1.209  -8.521  -8.521
  994    H5   NAG 136           H5       NAG 136   1.400  -7.426  -7.426
  995   1H6   NAG 136           H61      NAG 136  -0.646  -6.740  -6.740
  996   2H6   NAG 136           H62      NAG 136  -0.270  -5.370  -5.370
  997   1H8   NAG 136           H81      NAG 136  -3.780 -10.167 -10.167
  998   2H8   NAG 136           H82      NAG 136  -2.664 -11.557 -11.557
  999   3H8   NAG 136           H83      NAG 136  -3.347 -11.114 -11.114
 1000    HN2  NAG 136           HN2      NAG 136  -0.061 -10.392 -10.392
 1001    HO3  NAG 136           HO3      NAG 136  -1.058 -11.369 -11.369
 1002    H1   NAG 137           H1       NAG 137   2.006  -9.122  -9.122
 1003    H2   NAG 137           H2       NAG 137   1.982 -11.292 -11.292
 1004    H3   NAG 137           H3       NAG 137   4.018 -10.882 -10.882
 1005    H4   NAG 137           H4       NAG 137   4.381 -10.458 -10.458
 1006    H5   NAG 137           H5       NAG 137   4.231  -8.319  -8.319
 1007   1H6   NAG 137           H61      NAG 137   5.695  -7.975  -7.975
 1008   2H6   NAG 137           H62      NAG 137   4.570  -6.745  -6.745
 1009   1H8   NAG 137           H81      NAG 137  -0.673 -13.989 -13.989
 1010   2H8   NAG 137           H82      NAG 137   0.988 -14.623 -14.623
 1011   3H8   NAG 137           H83      NAG 137   0.646 -13.394 -13.394
 1012    HN2  NAG 137           HN2      NAG 137   1.735 -11.557 -11.557
 1013    HO3  NAG 137           HO3      NAG 137   4.718 -12.762 -12.762
 1014    HO6  NAG 137           HO6      NAG 137   4.553  -8.189  -8.189
 1015    H1   FUC 138           H1       FUC 138   0.659  -6.942  -6.942
 1016    H2   FUC 138           H2       FUC 138   0.397  -4.218  -4.218
 1017    H3   FUC 138           H3       FUC 138   0.798  -3.730  -3.730
 1018    H4   FUC 138           H4       FUC 138   2.949  -2.606  -2.606
 1019    H5   FUC 138           H5       FUC 138   3.381  -5.161  -5.161
 1020   1H6   FUC 138           H61      FUC 138   5.238  -4.140  -4.140
 1021   2H6   FUC 138           H62      FUC 138   4.314  -4.069  -4.069
 1022   3H6   FUC 138           H63      FUC 138   4.820  -5.652  -5.652
 1023    HO2  FUC 138           HO2      FUC 138  -1.414  -5.722  -5.722
 1024    HO3  FUC 138           HO3      FUC 138  -0.375  -2.182  -2.182
 1025    HO4  FUC 138           HO4      FUC 138   1.853  -2.089  -2.089
 1026    H1   MAN 139           H1       MAN 139   6.247  -9.778  -9.778
 1027    H2   MAN 139           H2       MAN 139   7.548  -8.132  -8.132
 1028    H3   MAN 139           H3       MAN 139   8.530  -8.680  -8.680
 1029    H4   MAN 139           H4       MAN 139  10.017 -10.947 -10.947
 1030    H5   MAN 139           H5       MAN 139   7.704 -11.119 -11.119
 1031   1H6   MAN 139           H61      MAN 139   7.773 -13.531 -13.531
 1032   2H6   MAN 139           H62      MAN 139   8.912 -13.028 -13.028
 1033    HO2  MAN 139           HO2      MAN 139   8.612  -8.821  -8.821
 1034    HO3  MAN 139           HO3      MAN 139  10.153  -7.563  -7.563
 1035    HO4  MAN 139           HO4      MAN 139   9.873  -9.961  -9.961
 1036    HO6  MAN 139           HO6      MAN 139   9.595 -12.861 -12.861

  Start of MODEL   17
    1   1H    ALA   1           HT2      ALA   1 -10.561   7.246   7.246
    2   2H    ALA   1           HT1      ALA   1 -11.205   8.573   8.573
    3   3H    ALA   1           HT3      ALA   1 -11.059   8.633   8.633
    4    HA   ALA   1           HA       ALA   1  -9.302   9.934   9.934
    5   1HB   ALA   1           HB3      ALA   1  -9.465   8.340   8.340
    6   2HB   ALA   1           HB2      ALA   1  -8.443   7.238   7.238
    7   3HB   ALA   1           HB1      ALA   1  -7.834   8.828   8.828
    8    H    MET   1           HN       MET   1  -8.686   6.510   6.510
    9    HA   MET   1           HA       MET   1  -6.813   7.477   7.477
   10   1HB   MET   1           HB2      MET   1  -7.087   4.848   4.848
   11   2HB   MET   1           HB1      MET   1  -5.894   5.154   5.154
   12   1HG   MET   1           HG2      MET   1  -4.913   6.964   6.964
   13   2HG   MET   1           HG1      MET   1  -6.153   6.769   6.769
   14   1HE   MET   1           HE3      MET   1  -3.445   6.983   6.983
   15   2HE   MET   1           HE2      MET   1  -4.384   6.275   6.275
   16   3HE   MET   1           HE1      MET   1  -2.836   5.564   5.564
   17    H    HIS   2           HN       HIS   2  -6.863   6.246   6.246
   18    HA   HIS   2           HA       HIS   2  -9.510   4.951   4.951
   19   1HB   HIS   2           HB2      HIS   2  -7.936   6.964   6.964
   20   2HB   HIS   2           HB1      HIS   2  -9.410   6.163   6.163
   21    HD1  HIS   2           HD1      HIS   2  -8.172   8.884   8.884
   22    HD2  HIS   2           HD2      HIS   2 -11.789   6.964   6.964
   23    HE1  HIS   2           HE1      HIS   2  -9.981  10.310  10.310
   24    H    VAL   3           HN       VAL   3  -8.031   2.996   2.996
   25    HA   VAL   3           HA       VAL   3  -6.501   2.311   2.311
   26    HB   VAL   3           HB       VAL   3  -6.022   1.554   1.554
   27   1HG1  VAL   3          HG13      VAL   3  -5.425  -0.224  -0.224
   28   2HG1  VAL   3          HG12      VAL   3  -4.306   0.931   0.931
   29   3HG1  VAL   3          HG11      VAL   3  -4.055   0.380   0.380
   30   1HG2  VAL   3          HG23      VAL   3  -4.552   3.371   3.371
   31   2HG2  VAL   3          HG22      VAL   3  -5.373   3.849   3.849
   32   3HG2  VAL   3          HG21      VAL   3  -3.909   2.870   2.870
   33    H    ALA   4           HN       ALA   4  -7.157   0.437   0.437
   34    HA   ALA   4           HA       ALA   4  -9.240  -1.230  -1.230
   35   1HB   ALA   4           HB2      ALA   4  -8.715  -0.231  -0.231
   36   2HB   ALA   4           HB1      ALA   4  -9.254  -1.911  -1.911
   37   3HB   ALA   4           HB3      ALA   4 -10.249  -0.633  -0.633
   38    H    GLN   5           HN       GLN   5  -8.707  -3.338  -3.338
   39    HA   GLN   5           HA       GLN   5  -6.355  -4.572  -4.572
   40   1HB   GLN   5           HB2      GLN   5  -6.939  -4.356  -4.356
   41   2HB   GLN   5           HB1      GLN   5  -5.679  -5.390  -5.390
   42   1HG   GLN   5           HG2      GLN   5  -5.858  -2.398  -2.398
   43   2HG   GLN   5           HG1      GLN   5  -4.810  -3.170  -3.170
   44   1HE2  GLN   5          HE22      GLN   5  -2.629  -4.584  -4.584
   45   2HE2  GLN   5          HE21      GLN   5  -3.283  -4.917  -4.917
   46    HA   PRO   6           HA       PRO   6  -9.169  -8.074  -8.074
   47   1HB   PRO   6           HB2      PRO   6  -7.408  -9.966  -9.966
   48   2HB   PRO   6           HB1      PRO   6  -8.112  -8.747  -8.747
   49   1HG   PRO   6           HG2      PRO   6  -5.412  -8.853  -8.853
   50   2HG   PRO   6           HG1      PRO   6  -5.909  -8.263  -8.263
   51   1HD   PRO   6           HD2      PRO   6  -5.333  -6.646  -6.646
   52   2HD   PRO   6           HD1      PRO   6  -6.369  -6.177  -6.177
   53    H    ALA   7           HN       ALA   7  -9.666  -9.623  -9.623
   54    HA   ALA   7           HA       ALA   7  -7.995  -9.741  -9.741
   55   1HB   ALA   7           HB3      ALA   7 -10.517 -11.124 -11.124
   56   2HB   ALA   7           HB2      ALA   7  -9.805 -11.470 -11.470
   57   3HB   ALA   7           HB1      ALA   7 -10.378  -9.844  -9.844
   58    H    VAL   8           HN       VAL   8  -8.449 -11.824 -11.824
   59    HA   VAL   8           HA       VAL   8  -6.107 -13.346 -13.346
   60    HB   VAL   8           HB       VAL   8  -8.324 -14.266 -14.266
   61   1HG1  VAL   8          HG11      VAL   8  -8.891 -14.551 -14.551
   62   2HG1  VAL   8          HG13      VAL   8  -8.968 -16.106 -16.106
   63   3HG1  VAL   8          HG12      VAL   8  -9.963 -14.741 -14.741
   64   1HG2  VAL   8          HG23      VAL   8  -5.931 -15.420 -15.420
   65   2HG2  VAL   8          HG22      VAL   8  -7.193 -16.168 -16.168
   66   3HG2  VAL   8          HG21      VAL   8  -7.076 -16.494 -16.494
   67    H    VAL   9           HN       VAL   9  -5.266 -14.689 -14.689
   68    HA   VAL   9           HA       VAL   9  -6.298 -14.160 -14.160
   69    HB   VAL   9           HB       VAL   9  -3.630 -13.537 -13.537
   70   1HG1  VAL   9          HG12      VAL   9  -4.186 -14.294 -14.294
   71   2HG1  VAL   9          HG11      VAL   9  -2.948 -13.093 -13.093
   72   3HG1  VAL   9          HG13      VAL   9  -2.807 -14.730 -14.730
   73   1HG2  VAL   9          HG23      VAL   9  -5.747 -11.984 -11.984
   74   2HG2  VAL   9          HG22      VAL   9  -4.094 -11.391 -11.391
   75   3HG2  VAL   9          HG21      VAL   9  -4.934 -11.910 -11.910
   76    H    LEU  10           HN       LEU  10  -5.604 -15.767 -15.767
   77    HA   LEU  10           HA       LEU  10  -4.700 -18.336 -18.336
   78   1HB   LEU  10           HB2      LEU  10  -6.498 -17.802 -17.802
   79   2HB   LEU  10           HB1      LEU  10  -6.096 -19.396 -19.396
   80    HG   LEU  10           HG       LEU  10  -7.524 -17.213 -17.213
   81   1HD1  LEU  10          HD12      LEU  10  -8.902 -18.165 -18.165
   82   2HD1  LEU  10          HD11      LEU  10  -8.578 -19.788 -19.788
   83   3HD1  LEU  10          HD13      LEU  10  -9.509 -18.650 -18.650
   84   1HD2  LEU  10          HD22      LEU  10  -6.319 -19.807 -19.807
   85   2HD2  LEU  10          HD21      LEU  10  -6.752 -18.437 -18.437
   86   3HD2  LEU  10          HD23      LEU  10  -7.983 -19.607 -19.607
   87    H    ALA  11           HN       ALA  11  -2.742 -19.067 -19.067
   88    HA   ALA  11           HA       ALA  11  -1.373 -17.698 -17.698
   89   1HB   ALA  11           HB3      ALA  11  -0.816 -20.094 -20.094
   90   2HB   ALA  11           HB2      ALA  11   0.315 -19.571 -19.571
   91   3HB   ALA  11           HB1      ALA  11  -0.085 -18.489 -18.489
   92    H    SER  12           HN       SER  12  -1.190 -18.409 -18.409
   93    HA   SER  12           HA       SER  12  -3.104 -20.383 -20.383
   94   1HB   SER  12           HB2      SER  12  -2.501 -18.335 -18.335
   95   2HB   SER  12           HB1      SER  12  -0.832 -18.886 -18.886
   96    HG   SER  12           HG       SER  12  -2.688 -19.337 -19.337
   97    H    SER  13           HN       SER  13   0.441 -20.256 -20.256
   98    HA   SER  13           HA       SER  13   0.737 -23.102 -23.102
   99   1HB   SER  13           HB2      SER  13   1.374 -23.749 -23.749
  100   2HB   SER  13           HB1      SER  13  -0.256 -23.081 -23.081
  101    HG   SER  13           HG       SER  13   1.076 -22.206 -22.206
  102    H    ARG  14           HN       ARG  14   3.071 -23.789 -23.789
  103    HA   ARG  14           HA       ARG  14   5.375 -23.421 -23.421
  104   1HB   ARG  14           HB2      ARG  14   4.555 -21.091 -21.091
  105   2HB   ARG  14           HB1      ARG  14   6.233 -21.410 -21.410
  106   1HG   ARG  14           HG2      ARG  14   5.152 -23.887 -23.887
  107   2HG   ARG  14           HG1      ARG  14   4.611 -22.675 -22.675
  108   1HD   ARG  14           HD2      ARG  14   6.971 -21.870 -21.870
  109   2HD   ARG  14           HD1      ARG  14   7.475 -23.198 -23.198
  110    HE   ARG  14           HE       ARG  14   5.957 -24.483 -24.483
  111   1HH1  ARG  14          HH21      ARG  14   8.672 -22.282 -22.282
  112   2HH1  ARG  14          HH22      ARG  14   9.255 -22.953 -22.953
  113   1HH2  ARG  14          HH11      ARG  14   6.748 -25.319 -25.319
  114   2HH2  ARG  14          HH12      ARG  14   8.180 -24.653 -24.653
  115    H    GLY  15           HN       GLY  15   3.246 -22.023 -22.023
  116   1HA   GLY  15           HA2      GLY  15   3.419 -20.746 -20.746
  117   2HA   GLY  15           HA1      GLY  15   5.158 -20.665 -20.665
  118    H    ILE  16           HN       ILE  16   2.676 -19.553 -19.553
  119    HA   ILE  16           HA       ILE  16   3.860 -16.828 -16.828
  120    HB   ILE  16           HB       ILE  16   2.259 -18.349 -18.349
  121   1HG1  ILE  16          HG12      ILE  16   4.091 -17.910 -17.910
  122   2HG1  ILE  16          HG11      ILE  16   4.728 -16.651 -16.651
  123   1HG2  ILE  16          HG21      ILE  16   2.405 -15.393 -15.393
  124   2HG2  ILE  16          HG23      ILE  16   2.580 -15.976 -15.976
  125   3HG2  ILE  16          HG22      ILE  16   1.129 -16.366 -16.366
  126   1HD1  ILE  16          HD13      ILE  16   4.565 -19.484 -19.484
  127   2HD1  ILE  16          HD12      ILE  16   5.912 -18.968 -18.968
  128   3HD1  ILE  16          HD11      ILE  16   5.625 -18.193 -18.193
  129    H    ALA  17           HN       ALA  17   2.797 -15.934 -15.934
  130    HA   ALA  17           HA       ALA  17  -0.199 -15.932 -15.932
  131   1HB   ALA  17           HB2      ALA  17   1.879 -15.364 -15.364
  132   2HB   ALA  17           HB1      ALA  17   0.148 -15.111 -15.111
  133   3HB   ALA  17           HB3      ALA  17   0.770 -16.734 -16.734
  134    H    SER  18           HN       SER  18  -0.945 -14.145 -14.145
  135    HA   SER  18           HA       SER  18   0.577 -11.582 -11.582
  136   1HB   SER  18           HB2      SER  18   0.634 -12.605 -12.605
  137   2HB   SER  18           HB1      SER  18  -1.125 -12.557 -12.557
  138    HG   SER  18           HG       SER  18  -0.967 -10.280 -10.280
  139    H    PHE  19           HN       PHE  19  -0.521  -9.915  -9.915
  140    HA   PHE  19           HA       PHE  19  -3.492  -9.861  -9.861
  141   1HB   PHE  19           HB2      PHE  19  -3.542  -9.309  -9.309
  142   2HB   PHE  19           HB1      PHE  19  -2.881 -10.906 -10.906
  143    HD1  PHE  19           HD1      PHE  19  -0.315 -11.180 -11.180
  144    HD2  PHE  19           HD2      PHE  19  -2.284  -7.668  -7.668
  145    HE1  PHE  19           HE1      PHE  19   1.773 -10.572 -10.572
  146    HE2  PHE  19           HE2      PHE  19  -0.192  -7.056  -7.056
  147    HZ   PHE  19           HZ       PHE  19   1.835  -8.514  -8.514
  148    H    VAL  20           HN       VAL  20  -4.318  -7.659  -7.659
  149    HA   VAL  20           HA       VAL  20  -2.261  -5.586  -5.586
  150    HB   VAL  20           HB       VAL  20  -5.155  -5.829  -5.829
  151   1HG1  VAL  20          HG13      VAL  20  -3.061  -3.757  -3.757
  152   2HG1  VAL  20          HG12      VAL  20  -4.658  -3.881  -3.881
  153   3HG1  VAL  20          HG11      VAL  20  -4.509  -3.473  -3.473
  154   1HG2  VAL  20          HG21      VAL  20  -3.487  -7.390  -7.390
  155   2HG2  VAL  20          HG23      VAL  20  -4.292  -6.296  -6.296
  156   3HG2  VAL  20          HG22      VAL  20  -2.641  -5.963  -5.963
  157    H    CYS  21           HN       CYS  21  -2.019  -4.038  -4.038
  158    HA   CYS  21           HA       CYS  21  -4.168  -3.624  -3.624
  159   1HB   CYS  21           HB2      CYS  21  -1.956  -4.266  -4.266
  160   2HB   CYS  21           HB1      CYS  21  -1.204  -2.965  -2.965
  161    H    GLU  22           HN       GLU  22  -5.293  -1.713  -1.713
  162    HA   GLU  22           HA       GLU  22  -4.383   0.325   0.325
  163   1HB   GLU  22           HB2      GLU  22  -6.532  -0.729  -0.729
  164   2HB   GLU  22           HB1      GLU  22  -7.037  -0.275  -0.275
  165   1HG   GLU  22           HG2      GLU  22  -6.909   2.095   2.095
  166   2HG   GLU  22           HG1      GLU  22  -6.307   1.684   1.684
  167    H    TYR  23           HN       TYR  23  -3.942   2.394   2.394
  168    HA   TYR  23           HA       TYR  23  -4.396   3.239   3.239
  169   1HB   TYR  23           HB2      TYR  23  -2.057   3.895   3.895
  170   2HB   TYR  23           HB1      TYR  23  -2.108   2.231   2.231
  171    HD1  TYR  23           HD1      TYR  23  -2.032   1.847   1.847
  172    HD2  TYR  23           HD2      TYR  23  -0.916   5.564   5.564
  173    HE1  TYR  23           HE1      TYR  23  -0.720   2.506   2.506
  174    HE2  TYR  23           HE2      TYR  23   0.406   6.206   6.206
  175    HH   TYR  23           HH       TYR  23   0.150   5.418   5.418
  176    H    ALA  24           HN       ALA  24  -3.572   5.731   5.731
  177    HA   ALA  24           HA       ALA  24  -4.665   7.065   7.065
  178   1HB   ALA  24           HB3      ALA  24  -5.229   7.532   7.532
  179   2HB   ALA  24           HB2      ALA  24  -5.667   8.700   8.700
  180   3HB   ALA  24           HB1      ALA  24  -6.378   7.086   7.086
  181    H    SER  25           HN       SER  25  -2.971   8.197   8.197
  182    HA   SER  25           HA       SER  25  -1.358   9.958   9.958
  183   1HB   SER  25           HB2      SER  25   0.680   9.133   9.133
  184   2HB   SER  25           HB1      SER  25  -0.248   7.731   7.731
  185    HG   SER  25           HG       SER  25   0.375   8.623   8.623
  186    HA   PRO  26           HA       PRO  26  -1.868  12.881  12.881
  187   1HB   PRO  26           HB2      PRO  26   0.546  14.177  14.177
  188   2HB   PRO  26           HB1      PRO  26  -0.652  14.432  14.432
  189   1HG   PRO  26           HG2      PRO  26   1.802  12.743  12.743
  190   2HG   PRO  26           HG1      PRO  26   1.138  13.777  13.777
  191   1HD   PRO  26           HD2      PRO  26   0.844  11.083  11.083
  192   2HD   PRO  26           HD1      PRO  26  -0.359  12.182  12.182
  193    H    GLY  27           HN       GLY  27  -1.262  13.261  13.261
  194   1HA   GLY  27           HA2      GLY  27   0.321  11.019  11.019
  195   2HA   GLY  27           HA1      GLY  27  -0.839  12.005  12.005
  196    H    LYS  28           HN       LYS  28   1.387  13.701  13.701
  197    HA   LYS  28           HA       LYS  28   2.949  14.507  14.507
  198   1HB   LYS  28           HB2      LYS  28   3.072  16.735  16.735
  199   2HB   LYS  28           HB1      LYS  28   1.402  16.230  16.230
  200   1HG   LYS  28           HG2      LYS  28   1.174  15.564  15.564
  201   2HG   LYS  28           HG1      LYS  28   2.895  15.800  15.800
  202   1HD   LYS  28           HD2      LYS  28   2.638  18.217  18.217
  203   2HD   LYS  28           HD1      LYS  28   0.909  17.974  17.974
  204   1HE   LYS  28           HE2      LYS  28   2.299  17.210  17.210
  205   2HE   LYS  28           HE1      LYS  28   1.545  18.796  18.796
  206   1HZ   LYS  28           HZ1      LYS  28  -0.485  17.583  17.583
  207   2HZ   LYS  28           HZ3      LYS  28   0.241  16.137  16.137
  208   3HZ   LYS  28           HZ2      LYS  28  -0.101  17.356  17.356
  209    H    ALA  29           HN       ALA  29   3.608  12.354  12.354
  210    HA   ALA  29           HA       ALA  29   6.218  13.448  13.448
  211   1HB   ALA  29           HB2      ALA  29   4.419  13.134  13.134
  212   2HB   ALA  29           HB1      ALA  29   4.464  11.408  11.408
  213   3HB   ALA  29           HB3      ALA  29   5.893  12.210  12.210
  214    H    THR  30           HN       THR  30   7.978  12.102  12.102
  215    HA   THR  30           HA       THR  30   7.519   9.716   9.716
  216    HB   THR  30           HB       THR  30   9.911   9.867   9.867
  217    HG1  THR  30           HG1      THR  30   9.947  11.851  11.851
  218   1HG2  THR  30          HG23      THR  30   8.391  11.627  11.627
  219   2HG2  THR  30          HG22      THR  30   8.989  12.714  12.714
  220   3HG2  THR  30          HG21      THR  30  10.108  12.017  12.017
  221    H    GLU  31           HN       GLU  31   7.410  10.057  10.057
  222    HA   GLU  31           HA       GLU  31   9.014   7.563   7.563
  223   1HB   GLU  31           HB2      GLU  31   8.662  10.002  10.002
  224   2HB   GLU  31           HB1      GLU  31   9.630   8.591   8.591
  225   1HG   GLU  31           HG2      GLU  31  10.161  10.157  10.157
  226   2HG   GLU  31           HG1      GLU  31  10.849  10.658  10.658
  227    H    VAL  32           HN       VAL  32   7.775   5.929   5.929
  228    HA   VAL  32           HA       VAL  32   5.631   6.476   6.476
  229    HB   VAL  32           HB       VAL  32   5.409   4.826   4.826
  230   1HG1  VAL  32          HG12      VAL  32   4.170   4.304   4.304
  231   2HG1  VAL  32          HG11      VAL  32   2.970   5.270   5.270
  232   3HG1  VAL  32          HG13      VAL  32   3.583   3.782   3.782
  233   1HG2  VAL  32          HG22      VAL  32   4.445   7.511   7.511
  234   2HG2  VAL  32          HG21      VAL  32   4.970   6.976   6.976
  235   3HG2  VAL  32          HG23      VAL  32   3.365   6.545   6.545
  236    H    ARG  33           HN       ARG  33   7.310   5.651   5.651
  237    HA   ARG  33           HA       ARG  33   8.655   3.152   3.152
  238   1HB   ARG  33           HB2      ARG  33   9.251   5.007   5.007
  239   2HB   ARG  33           HB1      ARG  33   7.829   4.625   4.625
  240   1HG   ARG  33           HG2      ARG  33   8.740   2.684   2.684
  241   2HG   ARG  33           HG1      ARG  33   9.708   2.390   2.390
  242   1HD   ARG  33           HD2      ARG  33  10.492   4.855   4.855
  243   2HD   ARG  33           HD1      ARG  33  10.703   3.392   3.392
  244    HE   ARG  33           HE       ARG  33  11.616   2.978   2.978
  245   1HH1  ARG  33          HH21      ARG  33  12.514   4.358   4.358
  246   2HH1  ARG  33          HH22      ARG  33  14.207   4.200   4.200
  247   1HH2  ARG  33          HH11      ARG  33  13.816   2.793   2.793
  248   2HH2  ARG  33          HH12      ARG  33  14.939   3.325   3.325
  249    H    VAL  34           HN       VAL  34   7.712   1.179   1.179
  250    HA   VAL  34           HA       VAL  34   5.294   0.686   0.686
  251    HB   VAL  34           HB       VAL  34   4.771  -1.070  -1.070
  252   1HG1  VAL  34          HG12      VAL  34   5.192   1.773   1.773
  253   2HG1  VAL  34          HG11      VAL  34   4.467   0.576   0.576
  254   3HG1  VAL  34          HG13      VAL  34   3.689   0.974   0.974
  255   1HG2  VAL  34          HG23      VAL  34   7.113  -1.524  -1.524
  256   2HG2  VAL  34          HG22      VAL  34   6.058  -1.198  -1.198
  257   3HG2  VAL  34          HG21      VAL  34   7.160   0.049   0.049
  258    H    THR  35           HN       THR  35   5.490  -0.850  -0.850
  259    HA   THR  35           HA       THR  35   7.942  -2.588  -2.588
  260    HB   THR  35           HB       THR  35   6.446  -1.372  -1.372
  261    HG1  THR  35           HG1      THR  35   8.898  -0.688  -0.688
  262   1HG2  THR  35          HG22      THR  35   7.655  -3.540  -3.540
  263   2HG2  THR  35          HG21      THR  35   9.145  -2.749  -2.749
  264   3HG2  THR  35          HG23      THR  35   8.295  -2.183  -2.183
  265    H    VAL  36           HN       VAL  36   7.546  -4.762  -4.762
  266    HA   VAL  36           HA       VAL  36   4.766  -5.629  -5.629
  267    HB   VAL  36           HB       VAL  36   6.994  -6.939  -6.939
  268   1HG1  VAL  36          HG13      VAL  36   4.193  -7.823  -7.823
  269   2HG1  VAL  36          HG12      VAL  36   5.036  -8.453  -8.453
  270   3HG1  VAL  36          HG11      VAL  36   5.701  -8.715  -8.715
  271   1HG2  VAL  36          HG22      VAL  36   4.599  -5.280  -5.280
  272   2HG2  VAL  36          HG21      VAL  36   6.207  -5.283  -5.283
  273   3HG2  VAL  36          HG23      VAL  36   5.068  -6.576  -6.576
  274    H    LEU  37           HN       LEU  37   4.502  -6.816  -6.816
  275    HA   LEU  37           HA       LEU  37   7.029  -7.935  -7.935
  276   1HB   LEU  37           HB2      LEU  37   4.584  -6.697  -6.697
  277   2HB   LEU  37           HB1      LEU  37   5.983  -7.330  -7.330
  278    HG   LEU  37           HG       LEU  37   6.215  -5.131  -5.131
  279   1HD1  LEU  37          HD11      LEU  37   4.705  -4.811  -4.811
  280   2HD1  LEU  37          HD13      LEU  37   6.297  -4.543  -4.543
  281   3HD1  LEU  37          HD12      LEU  37   5.749  -3.527  -3.527
  282   1HD2  LEU  37          HD21      LEU  37   7.990  -6.567  -6.567
  283   2HD2  LEU  37          HD23      LEU  37   8.384  -5.743  -5.743
  284   3HD2  LEU  37          HD22      LEU  37   8.188  -4.812  -4.812
  285    H    ARG  38           HN       ARG  38   6.618  -9.691  -9.691
  286    HA   ARG  38           HA       ARG  38   4.178 -11.318 -11.318
  287   1HB   ARG  38           HB2      ARG  38   7.067 -12.102 -12.102
  288   2HB   ARG  38           HB1      ARG  38   5.750 -13.275 -13.275
  289   1HG   ARG  38           HG2      ARG  38   5.088 -12.490 -12.490
  290   2HG   ARG  38           HG1      ARG  38   6.563 -11.532 -11.532
  291   1HD   ARG  38           HD2      ARG  38   6.469 -14.543 -14.543
  292   2HD   ARG  38           HD1      ARG  38   6.894 -13.745 -13.745
  293    HE   ARG  38           HE       ARG  38   8.485 -12.657 -12.657
  294   1HH1  ARG  38          HH21      ARG  38   8.147 -15.522 -15.522
  295   2HH1  ARG  38          HH22      ARG  38   9.819 -15.938 -15.938
  296   1HH2  ARG  38          HH11      ARG  38  10.639 -13.233 -13.233
  297   2HH2  ARG  38          HH12      ARG  38  11.216 -14.658 -14.658
  298    H    GLN  39           HN       GLN  39   2.910 -11.447 -11.447
  299    HA   GLN  39           HA       GLN  39   4.121 -10.954 -10.954
  300   1HB   GLN  39           HB2      GLN  39   2.186  -9.666  -9.666
  301   2HB   GLN  39           HB1      GLN  39   1.283 -11.150 -11.150
  302   1HG   GLN  39           HG2      GLN  39   1.803 -11.573 -11.573
  303   2HG   GLN  39           HG1      GLN  39   2.105  -9.833  -9.833
  304   1HE2  GLN  39          HE22      GLN  39  -1.670 -10.967 -10.967
  305   2HE2  GLN  39          HE21      GLN  39  -0.336 -11.889 -11.889
  306    H    ALA  40           HN       ALA  40   4.107 -12.427 -12.427
  307    HA   ALA  40           HA       ALA  40   2.841 -15.097 -15.097
  308   1HB   ALA  40           HB1      ALA  40   5.504 -14.580 -14.580
  309   2HB   ALA  40           HB3      ALA  40   5.494 -15.026 -15.026
  310   3HB   ALA  40           HB2      ALA  40   4.876 -16.151 -16.151
  311    H    ASP  41           HN       ASP  41   2.433 -16.220 -16.220
  312    HA   ASP  41           HA       ASP  41   1.479 -14.563 -14.563
  313   1HB   ASP  41           HB2      ASP  41   2.245 -17.459 -17.459
  314   2HB   ASP  41           HB1      ASP  41   1.478 -16.790 -16.790
  315    H    SER  42           HN       SER  42   4.547 -16.314 -16.314
  316    HA   SER  42           HA       SER  42   5.563 -15.580 -15.580
  317   1HB   SER  42           HB2      SER  42   6.848 -16.643 -16.643
  318   2HB   SER  42           HB1      SER  42   7.669 -16.530 -16.530
  319    HG   SER  42           HG       SER  42   6.659 -18.265 -18.265
  320    H    GLN  43           HN       GLN  43   6.467 -14.523 -14.523
  321    HA   GLN  43           HA       GLN  43   7.056 -11.804 -11.804
  322   1HB   GLN  43           HB2      GLN  43   9.093 -13.754 -13.754
  323   2HB   GLN  43           HB1      GLN  43   9.390 -12.018 -12.018
  324   1HG   GLN  43           HG2      GLN  43   8.860 -12.125 -12.125
  325   2HG   GLN  43           HG1      GLN  43   8.862 -13.882 -13.882
  326   1HE2  GLN  43          HE22      GLN  43  12.365 -12.008 -12.008
  327   2HE2  GLN  43          HE21      GLN  43  10.866 -11.279 -11.279
  328    H    VAL  44           HN       VAL  44   7.941 -10.425 -10.425
  329    HA   VAL  44           HA       VAL  44   6.724 -11.256 -11.256
  330    HB   VAL  44           HB       VAL  44   6.663  -8.559  -8.559
  331   1HG1  VAL  44          HG13      VAL  44   6.798  -8.642  -8.642
  332   2HG1  VAL  44          HG12      VAL  44   5.159  -9.288  -9.288
  333   3HG1  VAL  44          HG11      VAL  44   5.508  -7.687  -7.687
  334   1HG2  VAL  44          HG22      VAL  44   4.983 -10.841 -10.841
  335   2HG2  VAL  44          HG21      VAL  44   4.717  -9.226  -9.226
  336   3HG2  VAL  44          HG23      VAL  44   4.073  -9.653  -9.653
  337    H    THR  45           HN       THR  45   8.061 -10.786 -10.786
  338    HA   THR  45           HA       THR  45  10.583  -9.246  -9.246
  339    HB   THR  45           HB       THR  45  11.732 -10.958 -10.958
  340    HG1  THR  45           HG1      THR  45  10.393 -11.955 -11.955
  341   1HG2  THR  45          HG23      THR  45  11.295 -11.168 -11.168
  342   2HG2  THR  45          HG22      THR  45  10.131 -12.413 -12.413
  343   3HG2  THR  45          HG21      THR  45  11.834 -12.604 -12.604
  344    H    GLU  46           HN       GLU  46  11.595  -8.345  -8.345
  345    HA   GLU  46           HA       GLU  46   9.631  -7.225  -7.225
  346   1HB   GLU  46           HB2      GLU  46  12.617  -6.995  -6.995
  347   2HB   GLU  46           HB1      GLU  46  11.757  -6.123  -6.123
  348   1HG   GLU  46           HG2      GLU  46  10.356  -5.007  -5.007
  349   2HG   GLU  46           HG1      GLU  46  11.092  -5.946  -5.946
  350    H    VAL  47           HN       VAL  47   9.823  -7.367  -7.367
  351    HA   VAL  47           HA       VAL  47  11.176  -9.862  -9.862
  352    HB   VAL  47           HB       VAL  47   8.315  -8.918  -8.918
  353   1HG1  VAL  47          HG12      VAL  47   9.844 -10.830 -10.830
  354   2HG1  VAL  47          HG11      VAL  47   8.150 -11.165 -11.165
  355   3HG1  VAL  47          HG13      VAL  47   8.593  -9.669  -9.669
  356   1HG2  VAL  47          HG23      VAL  47   9.795 -11.050 -11.050
  357   2HG2  VAL  47          HG22      VAL  47   8.269 -10.270 -10.270
  358   3HG2  VAL  47          HG21      VAL  47   8.299 -11.569 -11.569
  359    H    CYS  48           HN       CYS  48   9.143  -7.272  -7.272
  360    HA   CYS  48           HA       CYS  48  11.398  -6.748  -6.748
  361   1HB   CYS  48           HB2      CYS  48   8.419  -7.025  -7.025
  362   2HB   CYS  48           HB1      CYS  48   9.599  -6.576  -6.576
  363    H    ALA  49           HN       ALA  49  11.741  -4.593  -4.593
  364    HA   ALA  49           HA       ALA  49   9.763  -2.539  -2.539
  365   1HB   ALA  49           HB2      ALA  49  12.180  -3.320  -3.320
  366   2HB   ALA  49           HB1      ALA  49  12.222  -1.612  -1.612
  367   3HB   ALA  49           HB3      ALA  49  10.882  -2.240  -2.240
  368    H    ALA  50           HN       ALA  50   9.759  -0.899  -0.899
  369    HA   ALA  50           HA       ALA  50  12.185  -0.032  -0.032
  370   1HB   ALA  50           HB2      ALA  50   9.998  -1.572  -1.572
  371   2HB   ALA  50           HB1      ALA  50  11.370  -0.792  -0.792
  372   3HB   ALA  50           HB3      ALA  50  11.632  -2.152  -2.152
  373    H    THR  51           HN       THR  51  11.730   1.882   1.882
  374    HA   THR  51           HA       THR  51   9.165   3.218   3.218
  375    HB   THR  51           HB       THR  51  11.534   4.531   4.531
  376    HG1  THR  51           HG1      THR  51  11.200   3.905   3.905
  377   1HG2  THR  51          HG22      THR  51   9.233   5.332   5.332
  378   2HG2  THR  51          HG21      THR  51  10.685   6.329   6.329
  379   3HG2  THR  51          HG23      THR  51   9.757   6.023   6.023
  380    H    TYR  52           HN       TYR  52   7.585   3.043   3.043
  381    HA   TYR  52           HA       TYR  52   8.225   2.402   2.402
  382   1HB   TYR  52           HB2      TYR  52   6.162   1.716   1.716
  383   2HB   TYR  52           HB1      TYR  52   5.607   3.376   3.376
  384    HD1  TYR  52           HD2      TYR  52   5.412   4.355   4.355
  385    HD2  TYR  52           HD1      TYR  52   5.864   0.137   0.137
  386    HE1  TYR  52           HE2      TYR  52   4.570   3.767   3.767
  387    HE2  TYR  52           HE1      TYR  52   5.029  -0.446  -0.446
  388    HH   TYR  52           HH       TYR  52   4.638   1.941   1.941
  389    H    MET  53           HN       MET  53   8.765   3.908   3.908
  390    HA   MET  53           HA       MET  53   8.198   6.766   6.766
  391   1HB   MET  53           HB2      MET  53   9.798   5.435   5.435
  392   2HB   MET  53           HB1      MET  53   9.801   7.153   7.153
  393   1HG   MET  53           HG2      MET  53  10.454   6.125   6.125
  394   2HG   MET  53           HG1      MET  53  11.166   4.903   4.903
  395   1HE   MET  53           HE1      MET  53  11.497   7.596   7.596
  396   2HE   MET  53           HE3      MET  53  12.884   8.579   8.579
  397   3HE   MET  53           HE2      MET  53  11.268   8.956   8.956
  398    H    MET  54           HN       MET  54   7.092   8.007   8.007
  399    HA   MET  54           HA       MET  54   4.764   6.704   6.704
  400   1HB   MET  54           HB2      MET  54   6.198   9.226   9.226
  401   2HB   MET  54           HB1      MET  54   4.544   8.810   8.810
  402   1HG   MET  54           HG2      MET  54   5.549   9.170   9.170
  403   2HG   MET  54           HG1      MET  54   4.575  10.337  10.337
  404   1HE   MET  54           HE2      MET  54   5.063   7.588   7.588
  405   2HE   MET  54           HE1      MET  54   3.482   7.147   7.147
  406   3HE   MET  54           HE3      MET  54   4.154   6.275   6.275
  407    H    GLY  55           HN       GLY  55   7.969   7.019   7.019
  408   1HA   GLY  55           HA2      GLY  55   6.955   5.472   5.472
  409   2HA   GLY  55           HA1      GLY  55   8.122   6.777   6.777
  410    H    ASN  56           HN       ASN  56   7.973   4.089   4.089
  411    HA   ASN  56           HA       ASN  56  10.348   2.824   2.824
  412   1HB   ASN  56           HB2      ASN  56  10.900   4.887   4.887
  413   2HB   ASN  56           HB1      ASN  56  10.636   3.691   3.691
  414   1HD2  ASN  56          HD22      ASN  56  14.236   3.655   3.655
  415   2HD2  ASN  56          HD21      ASN  56  13.230   4.958   4.958
  416    H    GLU  57           HN       GLU  57  11.126   1.038   1.038
  417    HA   GLU  57           HA       GLU  57   8.652  -0.324  -0.324
  418   1HB   GLU  57           HB2      GLU  57   9.814  -1.332  -1.332
  419   2HB   GLU  57           HB1      GLU  57  11.282  -1.471  -1.471
  420   1HG   GLU  57           HG2      GLU  57  10.145  -2.947  -2.947
  421   2HG   GLU  57           HG1      GLU  57   8.625  -2.753  -2.753
  422    H    LEU  58           HN       LEU  58   8.898  -1.564  -1.564
  423    HA   LEU  58           HA       LEU  58  10.525  -0.275  -0.275
  424   1HB   LEU  58           HB2      LEU  58   8.787  -2.755  -2.755
  425   2HB   LEU  58           HB1      LEU  58   9.532  -2.173  -2.173
  426    HG   LEU  58           HG       LEU  58   7.723  -0.503  -0.503
  427   1HD1  LEU  58          HD13      LEU  58   7.188  -2.185  -2.185
  428   2HD1  LEU  58          HD12      LEU  58   6.183  -0.788  -0.788
  429   3HD1  LEU  58          HD11      LEU  58   6.288  -2.133  -2.133
  430   1HD2  LEU  58          HD22      LEU  58   9.164  -0.089  -0.089
  431   2HD2  LEU  58          HD21      LEU  58   9.063   0.983   0.983
  432   3HD2  LEU  58          HD23      LEU  58   7.675   0.787   0.787
  433    H    THR  59           HN       THR  59  12.501  -0.901  -0.901
  434    HA   THR  59           HA       THR  59  13.828  -3.276  -3.276
  435    HB   THR  59           HB       THR  59  15.829  -2.018  -2.018
  436    HG1  THR  59           HG1      THR  59  14.146   0.156   0.156
  437   1HG2  THR  59          HG21      THR  59  14.638  -1.680  -1.680
  438   2HG2  THR  59          HG23      THR  59  14.091  -0.151  -0.151
  439   3HG2  THR  59          HG22      THR  59  15.816  -0.467  -0.467
  440    H    PHE  60           HN       PHE  60  14.189  -5.014  -5.014
  441    HA   PHE  60           HA       PHE  60  13.908  -4.598  -4.598
  442   1HB   PHE  60           HB2      PHE  60  13.207  -6.937  -6.937
  443   2HB   PHE  60           HB1      PHE  60  13.024  -6.938  -6.938
  444    HD1  PHE  60           HD1      PHE  60  11.399  -5.424  -5.424
  445    HD2  PHE  60           HD2      PHE  60  11.683  -5.687  -5.687
  446    HE1  PHE  60           HE1      PHE  60   9.196  -4.263  -4.263
  447    HE2  PHE  60           HE2      PHE  60   9.476  -4.530  -4.530
  448    HZ   PHE  60           HZ       PHE  60   8.233  -3.817  -3.817
  449    H    LEU  61           HN       LEU  61  16.393  -4.151  -4.151
  450    HA   LEU  61           HA       LEU  61  18.174  -6.271  -6.271
  451   1HB   LEU  61           HB2      LEU  61  18.431  -3.786  -3.786
  452   2HB   LEU  61           HB1      LEU  61  19.812  -4.790  -4.790
  453    HG   LEU  61           HG       LEU  61  17.911  -3.507  -3.507
  454   1HD1  LEU  61          HD11      LEU  61  19.332  -1.876  -1.876
  455   2HD1  LEU  61          HD13      LEU  61  20.760  -2.745  -2.745
  456   3HD1  LEU  61          HD12      LEU  61  19.709  -1.933  -1.933
  457   1HD2  LEU  61          HD23      LEU  61  20.445  -5.143  -5.143
  458   2HD2  LEU  61          HD22      LEU  61  18.874  -5.457  -5.457
  459   3HD2  LEU  61          HD21      LEU  61  19.863  -4.114  -4.114
  460    H    ASP  62           HN       ASP  62  16.856  -5.272  -5.272
  461    HA   ASP  62           HA       ASP  62  18.301  -7.501  -7.501
  462   1HB   ASP  62           HB2      ASP  62  18.241  -5.118  -5.118
  463   2HB   ASP  62           HB1      ASP  62  16.515  -5.328  -5.328
  464    H    ASP  63           HN       ASP  63  17.267  -9.366  -9.366
  465    HA   ASP  63           HA       ASP  63  15.544 -10.970 -10.970
  466   1HB   ASP  63           HB2      ASP  63  14.276  -8.410  -8.410
  467   2HB   ASP  63           HB1      ASP  63  13.508  -9.990  -9.990
  468    H    SER  64           HN       SER  64  15.818 -10.118 -10.118
  469    HA   SER  64           HA       SER  64  13.534  -8.999  -8.999
  470   1HB   SER  64           HB2      SER  64  15.790  -9.338  -9.338
  471   2HB   SER  64           HB1      SER  64  15.515 -11.075 -11.075
  472    HG   SER  64           HG       SER  64  14.963 -10.274 -10.274
  473    H    ILE  67           HN       ILE  67  13.898 -12.178 -12.178
  474    HA   ILE  67           HA       ILE  67  12.348 -13.935 -13.935
  475    HB   ILE  67           HB       ILE  67  11.948 -13.227 -13.227
  476   1HG1  ILE  67          HG12      ILE  67  14.322 -13.537 -13.537
  477   2HG1  ILE  67          HG11      ILE  67  13.718 -14.890 -14.890
  478   1HG2  ILE  67          HG21      ILE  67  11.203 -15.578 -15.578
  479   2HG2  ILE  67          HG23      ILE  67  11.648 -15.846 -15.846
  480   3HG2  ILE  67          HG22      ILE  67  10.291 -14.792 -14.792
  481   1HD1  ILE  67          HD12      ILE  67  13.316 -16.110 -16.110
  482   2HD1  ILE  67          HD11      ILE  67  14.191 -14.815 -14.815
  483   3HD1  ILE  67          HD13      ILE  67  15.015 -15.825 -15.825
  484    H    CYS  68           HN       CYS  68  11.377 -10.998 -10.998
  485    HA   CYS  68           HA       CYS  68   8.522 -11.658 -11.658
  486   1HB   CYS  68           HB2      CYS  68   7.839  -9.824  -9.824
  487   2HB   CYS  68           HB1      CYS  68   8.777 -11.058 -11.058
  488    H    THR  69           HN       THR  69   7.352  -9.914  -9.914
  489    HA   THR  69           HA       THR  69   9.146  -7.950  -7.950
  490    HB   THR  69           HB       THR  69   8.458  -9.832  -9.832
  491    HG1  THR  69           HG1      THR  69   7.105  -7.396  -7.396
  492   1HG2  THR  69          HG21      THR  69   5.650  -8.961  -8.961
  493   2HG2  THR  69          HG23      THR  69   6.046 -10.130 -10.130
  494   3HG2  THR  69          HG22      THR  69   6.414 -10.492 -10.492
  495    H    GLY  70           HN       GLY  70   8.324  -5.834  -5.834
  496   1HA   GLY  70           HA2      GLY  70   5.685  -5.460  -5.460
  497   2HA   GLY  70           HA1      GLY  70   7.035  -4.346  -4.346
  498    H    THR  71           HN       THR  71   4.141  -4.653  -4.653
  499    HA   THR  71           HA       THR  71   4.876  -2.765  -2.765
  500    HB   THR  71           HB       THR  71   2.748  -4.877  -4.877
  501    HG1  THR  71           HG1      THR  71   4.127  -6.091  -6.091
  502   1HG2  THR  71          HG21      THR  71   3.569  -2.701  -2.701
  503   2HG2  THR  71          HG23      THR  71   3.197  -4.247  -4.247
  504   3HG2  THR  71          HG22      THR  71   1.984  -3.438  -3.438
  505    H    SER  72           HN       SER  72   3.193  -1.197  -1.197
  506    HA   SER  72           HA       SER  72   0.822  -1.129  -1.129
  507   1HB   SER  72           HB2      SER  72   3.135   0.796   0.796
  508   2HB   SER  72           HB1      SER  72   1.552   1.009   1.009
  509    HG   SER  72           HG       SER  72   2.841  -0.058  -0.058
  510    H    SER  73           HN       SER  73  -0.778   0.104   0.104
  511    HA   SER  73           HA       SER  73  -0.027   2.103   2.103
  512   1HB   SER  73           HB2      SER  73  -1.674   1.067   1.067
  513   2HB   SER  73           HB1      SER  73  -0.470  -0.126  -0.126
  514    HG   SER  73           HG       SER  73  -2.002  -1.223  -1.223
  515    H    GLY  74           HN       GLY  74  -1.424   3.893   3.893
  516   1HA   GLY  74           HA2      GLY  74  -3.086   5.330   5.330
  517   2HA   GLY  74           HA1      GLY  74  -4.115   3.898   3.898
  518    H    ASN  75           HN       ASN  75  -4.902   3.631   3.631
  519    HA   ASN  75           HA       ASN  75  -3.213   4.440   4.440
  520   1HB   ASN  75           HB2      ASN  75  -6.192   4.001   4.001
  521   2HB   ASN  75           HB1      ASN  75  -5.439   4.467   4.467
  522   1HD2  ASN  75          HD22      ASN  75  -4.345   7.683   7.683
  523   2HD2  ASN  75          HD21      ASN  75  -3.553   6.369   6.369
  524    H    GLN  76           HN       GLN  76  -3.573   1.687   1.687
  525    HA   GLN  76           HA       GLN  76  -3.932  -0.052  -0.052
  526   1HB   GLN  76           HB2      GLN  76  -4.485  -0.418  -0.418
  527   2HB   GLN  76           HB1      GLN  76  -4.523  -1.756  -1.756
  528   1HG   GLN  76           HG2      GLN  76  -6.222  -0.561  -0.561
  529   2HG   GLN  76           HG1      GLN  76  -6.210   0.754   0.754
  530   1HE2  GLN  76          HE22      GLN  76  -7.518  -1.667  -1.667
  531   2HE2  GLN  76          HE21      GLN  76  -6.084  -0.773  -0.773
  532    H    VAL  77           HN       VAL  77  -2.120  -1.214  -1.214
  533    HA   VAL  77           HA       VAL  77   0.119  -1.382  -1.382
  534    HB   VAL  77           HB       VAL  77   1.562  -1.385  -1.385
  535   1HG1  VAL  77          HG11      VAL  77   0.131   0.760   0.760
  536   2HG1  VAL  77          HG13      VAL  77  -0.389   0.603   0.603
  537   3HG1  VAL  77          HG12      VAL  77   1.324   0.796   0.796
  538   1HG2  VAL  77          HG22      VAL  77  -0.827  -2.244  -2.244
  539   2HG2  VAL  77          HG21      VAL  77   0.868  -2.583  -2.583
  540   3HG2  VAL  77          HG23      VAL  77   0.144  -1.060  -1.060
  541    H    ASN  78           HN       ASN  78   0.596  -3.395  -3.395
  542    HA   ASN  78           HA       ASN  78  -0.701  -5.756  -5.756
  543   1HB   ASN  78           HB2      ASN  78  -0.959  -5.182  -5.182
  544   2HB   ASN  78           HB1      ASN  78   0.775  -5.435  -5.435
  545    HD2  ASN  78          HD22      ASN  78  -1.990  -7.384  -7.384
  546    H    LEU  79           HN       LEU  79   0.511  -6.924  -6.924
  547    HA   LEU  79           HA       LEU  79   3.483  -7.067  -7.067
  548   1HB   LEU  79           HB2      LEU  79   1.652  -7.353  -7.353
  549   2HB   LEU  79           HB1      LEU  79   3.359  -7.787  -7.787
  550    HG   LEU  79           HG       LEU  79   2.322  -5.045  -5.045
  551   1HD1  LEU  79          HD12      LEU  79   3.107  -6.254  -6.254
  552   2HD1  LEU  79          HD11      LEU  79   3.582  -4.585  -4.585
  553   3HD1  LEU  79          HD13      LEU  79   1.878  -5.039  -5.039
  554   1HD2  LEU  79          HD23      LEU  79   5.011  -6.356  -6.356
  555   2HD2  LEU  79          HD22      LEU  79   4.435  -5.174  -5.174
  556   3HD2  LEU  79          HD21      LEU  79   4.875  -4.654  -4.654
  557    H    THR  80           HN       THR  80   4.299  -9.068  -9.068
  558    HA   THR  80           HA       THR  80   2.564 -11.481 -11.481
  559    HB   THR  80           HB       THR  80   4.302 -10.786 -10.786
  560    HG1  THR  80           HG1      THR  80   2.598  -9.570  -9.570
  561   1HG2  THR  80          HG22      THR  80   2.936 -13.224 -13.224
  562   2HG2  THR  80          HG21      THR  80   2.504 -12.743 -12.743
  563   3HG2  THR  80          HG23      THR  80   4.193 -13.021 -13.021
  564    H    ILE  81           HN       ILE  81   3.633 -13.258 -13.258
  565    HA   ILE  81           HA       ILE  81   6.580 -13.002 -13.002
  566    HB   ILE  81           HB       ILE  81   4.371 -14.627 -14.627
  567   1HG1  ILE  81          HG12      ILE  81   6.034 -12.404 -12.404
  568   2HG1  ILE  81          HG11      ILE  81   4.501 -12.096 -12.096
  569   1HG2  ILE  81          HG23      ILE  81   6.586 -15.793 -15.793
  570   2HG2  ILE  81          HG22      ILE  81   7.287 -14.373 -14.373
  571   3HG2  ILE  81          HG21      ILE  81   6.049 -15.319 -15.319
  572   1HD1  ILE  81          HD13      ILE  81   3.438 -13.792 -13.792
  573   2HD1  ILE  81          HD12      ILE  81   4.955 -13.831 -13.831
  574   3HD1  ILE  81          HD11      ILE  81   4.020 -12.337 -12.337
  575    H    GLN  82           HN       GLN  82   7.901 -14.439 -14.439
  576    HA   GLN  82           HA       GLN  82   6.590 -16.843 -16.843
  577   1HB   GLN  82           HB2      GLN  82   8.946 -15.196 -15.196
  578   2HB   GLN  82           HB1      GLN  82   8.294 -16.627 -16.627
  579   1HG   GLN  82           HG2      GLN  82   6.146 -15.516 -15.516
  580   2HG   GLN  82           HG1      GLN  82   6.718 -14.099 -14.099
  581   1HE2  GLN  82          HE22      GLN  82   7.842 -12.704 -12.704
  582   2HE2  GLN  82          HE21      GLN  82   6.991 -12.493 -12.493
  583    H    GLY  83           HN       GLY  83   7.245 -18.637 -18.637
  584   1HA   GLY  83           HA2      GLY  83   9.040 -20.249 -20.249
  585   2HA   GLY  83           HA1      GLY  83  10.086 -18.890 -18.890
  586    H    LEU  84           HN       LEU  84   6.734 -19.286 -19.286
  587    HA   LEU  84           HA       LEU  84   7.676 -19.210 -19.210
  588   1HB   LEU  84           HB2      LEU  84   5.852 -17.893 -17.893
  589   2HB   LEU  84           HB1      LEU  84   5.881 -17.725 -17.725
  590    HG   LEU  84           HG       LEU  84   4.362 -19.839 -19.839
  591   1HD1  LEU  84          HD12      LEU  84   4.927 -19.825 -19.825
  592   2HD1  LEU  84          HD11      LEU  84   3.420 -18.902 -18.902
  593   3HD1  LEU  84          HD13      LEU  84   3.452 -20.534 -20.534
  594   1HD2  LEU  84          HD22      LEU  84   3.674 -17.521 -17.521
  595   2HD2  LEU  84          HD21      LEU  84   2.386 -18.416 -18.416
  596   3HD2  LEU  84          HD23      LEU  84   3.321 -17.217 -17.217
  597    H    ARG  85           HN       ARG  85   7.502 -20.953 -20.953
  598    HA   ARG  85           HA       ARG  85   6.457 -23.492 -23.492
  599   1HB   ARG  85           HB2      ARG  85   7.879 -22.586 -22.586
  600   2HB   ARG  85           HB1      ARG  85   7.372 -24.262 -24.262
  601   1HG   ARG  85           HG2      ARG  85   8.649 -24.183 -24.183
  602   2HG   ARG  85           HG1      ARG  85   9.331 -22.653 -22.653
  603   1HD   ARG  85           HD2      ARG  85  10.177 -23.807 -23.807
  604   2HD   ARG  85           HD1      ARG  85   9.580 -25.341 -25.341
  605    HE   ARG  85           HE       ARG  85  11.326 -25.296 -25.296
  606   1HH1  ARG  85          HH21      ARG  85  10.996 -22.163 -22.163
  607   2HH1  ARG  85          HH22      ARG  85  12.449 -21.555 -21.555
  608   1HH2  ARG  85          HH11      ARG  85  13.197 -24.465 -24.465
  609   2HH2  ARG  85          HH12      ARG  85  13.683 -22.840 -22.840
  610    H    ALA  86           HN       ALA  86   4.889 -24.782 -24.782
  611    HA   ALA  86           HA       ALA  86   2.521 -23.376 -23.376
  612   1HB   ALA  86           HB3      ALA  86   2.893 -25.840 -25.840
  613   2HB   ALA  86           HB2      ALA  86   3.408 -26.091 -26.091
  614   3HB   ALA  86           HB1      ALA  86   1.764 -25.553 -25.553
  615    H    MET  87           HN       MET  87   5.393 -24.319 -24.319
  616    HA   MET  87           HA       MET  87   4.414 -23.947 -23.947
  617   1HB   MET  87           HB2      MET  87   6.734 -24.196 -24.196
  618   2HB   MET  87           HB1      MET  87   6.515 -25.136 -25.136
  619   1HG   MET  87           HG2      MET  87   7.350 -23.218 -23.218
  620   2HG   MET  87           HG1      MET  87   7.653 -22.333 -22.333
  621   1HE   MET  87           HE3      MET  87   8.982 -22.893 -22.893
  622   2HE   MET  87           HE2      MET  87   8.948 -24.628 -24.628
  623   3HE   MET  87           HE1      MET  87  10.482 -23.830 -23.830
  624    H    ASP  88           HN       ASP  88   5.644 -21.776 -21.776
  625    HA   ASP  88           HA       ASP  88   6.030 -19.478 -19.478
  626   1HB   ASP  88           HB2      ASP  88   5.842 -19.874 -19.874
  627   2HB   ASP  88           HB1      ASP  88   6.269 -18.339 -18.339
  628    H    THR  89           HN       THR  89   3.187 -20.948 -20.948
  629    HA   THR  89           HA       THR  89   1.525 -18.871 -18.871
  630    HB   THR  89           HB       THR  89   0.888 -21.183 -21.183
  631    HG1  THR  89           HG1      THR  89   1.155 -22.385 -22.385
  632   1HG2  THR  89          HG21      THR  89  -0.797 -19.211 -19.211
  633   2HG2  THR  89          HG23      THR  89  -0.971 -20.163 -20.163
  634   3HG2  THR  89          HG22      THR  89  -1.331 -20.889 -20.889
  635    H    GLY  90           HN       GLY  90   0.430 -17.248 -17.248
  636   1HA   GLY  90           HA2      GLY  90  -0.188 -17.113 -17.113
  637   2HA   GLY  90           HA1      GLY  90   1.439 -16.461 -16.461
  638    H    LEU  91           HN       LEU  91   0.825 -14.345 -14.345
  639    HA   LEU  91           HA       LEU  91  -1.114 -12.954 -12.954
  640   1HB   LEU  91           HB2      LEU  91  -1.454 -12.995 -12.995
  641   2HB   LEU  91           HB1      LEU  91   0.107 -12.200 -12.200
  642    HG   LEU  91           HG       LEU  91  -0.821 -10.390 -10.390
  643   1HD1  LEU  91          HD11      LEU  91  -2.788 -11.925 -11.925
  644   2HD1  LEU  91          HD13      LEU  91  -3.468 -11.462 -11.462
  645   3HD1  LEU  91          HD12      LEU  91  -3.160 -10.232 -10.232
  646   1HD2  LEU  91          HD23      LEU  91  -0.494 -10.188 -10.188
  647   2HD2  LEU  91          HD22      LEU  91  -1.792  -9.180  -9.180
  648   3HD2  LEU  91          HD21      LEU  91  -2.177 -10.680 -10.680
  649    H    TYR  92           HN       TYR  92  -0.371 -11.475 -11.475
  650    HA   TYR  92           HA       TYR  92   2.433 -10.463 -10.463
  651   1HB   TYR  92           HB2      TYR  92   0.667 -11.128 -11.128
  652   2HB   TYR  92           HB1      TYR  92   2.053 -10.052 -10.052
  653    HD1  TYR  92           HD1      TYR  92   0.984 -13.512 -13.512
  654    HD2  TYR  92           HD2      TYR  92   4.339 -10.852 -10.852
  655    HE1  TYR  92           HE1      TYR  92   2.530 -15.478 -15.478
  656    HE2  TYR  92           HE2      TYR  92   5.887 -12.813 -12.813
  657    HH   TYR  92           HH       TYR  92   5.059 -15.793 -15.793
  658    H    ILE  93           HN       ILE  93   2.673  -8.258  -8.258
  659    HA   ILE  93           HA       ILE  93   0.197  -6.617  -6.617
  660    HB   ILE  93           HB       ILE  93   3.027  -6.246  -6.246
  661   1HG1  ILE  93          HG12      ILE  93   1.678  -6.259  -6.259
  662   2HG1  ILE  93          HG11      ILE  93   0.398  -7.008  -7.008
  663   1HG2  ILE  93          HG23      ILE  93   0.751  -4.344  -4.344
  664   2HG2  ILE  93          HG22      ILE  93   1.566  -4.379  -4.379
  665   3HG2  ILE  93          HG21      ILE  93   2.481  -4.025  -4.025
  666   1HD1  ILE  93          HD11      ILE  93   3.194  -8.108  -8.108
  667   2HD1  ILE  93          HD13      ILE  93   2.156  -8.521  -8.521
  668   3HD1  ILE  93          HD12      ILE  93   1.665  -8.938  -8.938
  669    H    CYS  94           HN       CYS  94  -0.126  -4.876  -4.876
  670    HA   CYS  94           HA       CYS  94   1.930  -4.294  -4.294
  671   1HB   CYS  94           HB2      CYS  94   0.067  -3.614  -3.614
  672   2HB   CYS  94           HB1      CYS  94  -0.506  -5.058  -5.058
  673    H    LYS  95           HN       LYS  95   3.047  -2.380  -2.380
  674    HA   LYS  95           HA       LYS  95   1.698  -0.365  -0.365
  675   1HB   LYS  95           HB2      LYS  95   4.613  -1.109  -1.109
  676   2HB   LYS  95           HB1      LYS  95   3.998   0.126   0.126
  677   1HG   LYS  95           HG2      LYS  95   2.475  -2.207  -2.207
  678   2HG   LYS  95           HG1      LYS  95   4.156  -2.732  -2.732
  679   1HD   LYS  95           HD2      LYS  95   4.835  -1.097  -1.097
  680   2HD   LYS  95           HD1      LYS  95   3.212  -0.404  -0.404
  681   1HE   LYS  95           HE2      LYS  95   2.286  -2.288  -2.288
  682   2HE   LYS  95           HE1      LYS  95   3.671  -3.309  -3.309
  683   1HZ   LYS  95           HZ1      LYS  95   5.079  -1.891  -1.891
  684   2HZ   LYS  95           HZ3      LYS  95   3.749  -0.917  -0.917
  685   3HZ   LYS  95           HZ2      LYS  95   3.811  -2.530  -2.530
  686    H    VAL  96           HN       VAL  96   1.862   1.842   1.842
  687    HA   VAL  96           HA       VAL  96   3.332   2.399   2.399
  688    HB   VAL  96           HB       VAL  96   0.536   3.400   3.400
  689   1HG1  VAL  96          HG11      VAL  96   2.476   3.363   3.363
  690   2HG1  VAL  96          HG13      VAL  96   0.804   3.038   3.038
  691   3HG1  VAL  96          HG12      VAL  96   1.218   4.538   4.538
  692   1HG2  VAL  96          HG23      VAL  96   1.328   0.765   0.765
  693   2HG2  VAL  96          HG22      VAL  96   0.284   0.998   0.998
  694   3HG2  VAL  96          HG21      VAL  96  -0.263   1.503   1.503
  695    H    GLU  97           HN       GLU  97   4.805   3.925   3.925
  696    HA   GLU  97           HA       GLU  97   3.652   6.225   6.225
  697   1HB   GLU  97           HB2      GLU  97   6.256   4.737   4.737
  698   2HB   GLU  97           HB1      GLU  97   5.832   6.228   6.228
  699   1HG   GLU  97           HG2      GLU  97   4.970   4.798   4.798
  700   2HG   GLU  97           HG1      GLU  97   3.596   4.717   4.717
  701    H    LEU  98           HN       LEU  98   4.044   8.155   8.155
  702    HA   LEU  98           HA       LEU  98   5.997   8.434   8.434
  703   1HB   LEU  98           HB2      LEU  98   4.091  10.183  10.183
  704   2HB   LEU  98           HB1      LEU  98   5.237  10.910  10.910
  705    HG   LEU  98           HG       LEU  98   4.387   9.247   9.247
  706   1HD1  LEU  98          HD12      LEU  98   2.474   8.754   8.754
  707   2HD1  LEU  98          HD11      LEU  98   1.962   8.520   8.520
  708   3HD1  LEU  98          HD13      LEU  98   3.316   7.590   7.590
  709   1HD2  LEU  98          HD22      LEU  98   3.595  11.746  11.746
  710   2HD2  LEU  98          HD21      LEU  98   2.807  10.765  10.765
  711   3HD2  LEU  98          HD23      LEU  98   2.074  10.930  10.930
  712    H    MET  99           HN       MET  99   7.779   7.616   7.616
  713    HA   MET  99           HA       MET  99   8.596   8.972   8.972
  714   1HB   MET  99           HB2      MET  99   9.766   6.880   6.880
  715   2HB   MET  99           HB1      MET  99  10.670   7.483   7.483
  716   1HG   MET  99           HG2      MET  99   7.834   6.488   6.488
  717   2HG   MET  99           HG1      MET  99   9.223   5.415   5.415
  718   1HE   MET  99           HE2      MET  99   7.397   5.320   5.320
  719   2HE   MET  99           HE1      MET  99   7.720   6.038   6.038
  720   3HE   MET  99           HE3      MET  99   6.750   6.915   6.915
  721    H    TYR 100           HN       TYR 100  10.007   8.855   8.855
  722    HA   TYR 100           HA       TYR 100  12.172  10.619  10.619
  723   1HB   TYR 100           HB2      TYR 100  10.844   9.744   9.744
  724   2HB   TYR 100           HB1      TYR 100  12.291  10.747  10.747
  725    HD1  TYR 100           HD1      TYR 100  14.450   9.860   9.860
  726    HD2  TYR 100           HD2      TYR 100  10.880   7.401   7.401
  727    HE1  TYR 100           HE1      TYR 100  15.844   7.822   7.822
  728    HE2  TYR 100           HE2      TYR 100  12.277   5.369   5.369
  729    HH   TYR 100           HH       TYR 100  15.211   4.993   4.993
  730    HA   PRO 101           HA       PRO 101   9.679  14.186  14.186
  731   1HB   PRO 101           HB2      PRO 101   7.009  13.881  13.881
  732   2HB   PRO 101           HB1      PRO 101   8.286  13.423  13.423
  733   1HG   PRO 101           HG2      PRO 101   6.567  11.737  11.737
  734   2HG   PRO 101           HG1      PRO 101   7.347  11.345  11.345
  735   1HD   PRO 101           HD2      PRO 101   8.172  10.613  10.613
  736   2HD   PRO 101           HD1      PRO 101   9.073  10.377  10.377
  737    HA   PRO 102           HA       PRO 102   7.920  14.905  14.905
  738   1HB   PRO 102           HB2      PRO 102   9.248  17.312  17.312
  739   2HB   PRO 102           HB1      PRO 102  10.025  15.726  15.726
  740   1HG   PRO 102           HG2      PRO 102  10.266  17.790  17.790
  741   2HG   PRO 102           HG1      PRO 102  11.458  16.635  16.635
  742   1HD   PRO 102           HD2      PRO 102   9.981  16.352  16.352
  743   2HD   PRO 102           HD1      PRO 102  10.911  15.085  15.085
  744    HA   PRO 103           HA       PRO 103   7.169  15.859  15.859
  745   1HB   PRO 103           HB2      PRO 103   5.744  16.025  16.025
  746   2HB   PRO 103           HB1      PRO 103   7.029  17.171  17.171
  747   1HG   PRO 103           HG2      PRO 103   4.379  17.560  17.560
  748   2HG   PRO 103           HG1      PRO 103   5.543  18.583  18.583
  749   1HD   PRO 103           HD2      PRO 103   3.900  16.284  16.284
  750   2HD   PRO 103           HD1      PRO 103   3.994  18.067  18.067
  751    H    TYR 104           HN       TYR 104   6.527  13.909  13.909
  752    HA   TYR 104           HA       TYR 104   5.444  11.936  11.936
  753   1HB   TYR 104           HB2      TYR 104   7.257  11.253  11.253
  754   2HB   TYR 104           HB1      TYR 104   6.653  11.908  11.908
  755    HD1  TYR 104           HD2      TYR 104   5.117   9.704   9.704
  756    HD2  TYR 104           HD1      TYR 104   6.137  10.170  10.170
  757    HE1  TYR 104           HE2      TYR 104   3.984   7.546   7.546
  758    HE2  TYR 104           HE1      TYR 104   4.992   7.995   7.995
  759    HH   TYR 104           HH       TYR 104   4.336   5.926   5.926
  760    H    TYR 105           HN       TYR 105   3.320  11.367  11.367
  761    HA   TYR 105           HA       TYR 105   1.591  11.477  11.477
  762   1HB   TYR 105           HB2      TYR 105   1.737  13.753  13.753
  763   2HB   TYR 105           HB1      TYR 105   1.045  13.018  13.018
  764    HD1  TYR 105           HD1      TYR 105  -1.225  12.158  12.158
  765    HD2  TYR 105           HD2      TYR 105   0.408  14.032  14.032
  766    HE1  TYR 105           HE1      TYR 105  -3.539  12.396  12.396
  767    HE2  TYR 105           HE2      TYR 105  -1.904  14.277  14.277
  768    HH   TYR 105           HH       TYR 105  -4.319  14.400  14.400
  769    H    LEU 106           HN       LEU 106   1.005   9.239   9.239
  770    HA   LEU 106           HA       LEU 106  -0.869   8.760   8.760
  771   1HB   LEU 106           HB2      LEU 106   1.738   8.433   8.433
  772   2HB   LEU 106           HB1      LEU 106   1.377   6.809   6.809
  773    HG   LEU 106           HG       LEU 106  -0.747   6.949   6.949
  774   1HD1  LEU 106          HD13      LEU 106   0.668   9.459   9.459
  775   2HD1  LEU 106          HD12      LEU 106   0.111   8.521   8.521
  776   3HD1  LEU 106          HD11      LEU 106  -1.040   9.046   9.046
  777   1HD2  LEU 106          HD23      LEU 106   2.076   6.535   6.535
  778   2HD2  LEU 106          HD22      LEU 106   0.704   5.429   5.429
  779   3HD2  LEU 106          HD21      LEU 106   0.912   6.676   6.676
  780    H    GLY 108           HN       GLY 108  -0.288   5.726   5.726
  781   1HA   GLY 108           HA2      GLY 108  -0.981   5.259   5.259
  782   2HA   GLY 108           HA1      GLY 108  -2.266   4.914   4.914
  783    H    ILE 109           HN       ILE 109  -1.803   2.731   2.731
  784    HA   ILE 109           HA       ILE 109   0.185   1.192   1.192
  785    HB   ILE 109           HB       ILE 109  -0.595   0.987   0.987
  786   1HG1  ILE 109          HG12      ILE 109   0.812   2.960   2.960
  787   2HG1  ILE 109          HG11      ILE 109   1.655   1.767   1.767
  788   1HG2  ILE 109          HG23      ILE 109   1.292  -0.617  -0.617
  789   2HG2  ILE 109          HG22      ILE 109   1.377  -0.588  -0.588
  790   3HG2  ILE 109          HG21      ILE 109  -0.073  -1.188  -1.188
  791   1HD1  ILE 109          HD12      ILE 109   2.059   1.123   1.123
  792   2HD1  ILE 109          HD11      ILE 109   2.451   2.825   2.825
  793   3HD1  ILE 109          HD13      ILE 109   3.255   1.587   1.587
  794    H    GLY 110           HN       GLY 110  -0.384  -1.203  -1.203
  795   1HA   GLY 110           HA2      GLY 110  -3.349  -1.575  -1.575
  796   2HA   GLY 110           HA1      GLY 110  -2.184  -2.548  -2.548
  797    H    ASN 111           HN       ASN 111  -4.246  -3.044  -3.044
  798    HA   ASN 111           HA       ASN 111  -2.770  -3.888  -3.888
  799   1HB   ASN 111           HB2      ASN 111  -5.289  -3.604  -3.604
  800   2HB   ASN 111           HB1      ASN 111  -5.272  -5.201  -5.201
  801    HD2  ASN 111          HD22      ASN 111  -3.607  -6.747  -6.747
  802    H    GLY 112           HN       GLY 112  -3.504  -5.604  -5.604
  803   1HA   GLY 112           HA2      GLY 112  -1.606  -7.182  -7.182
  804   2HA   GLY 112           HA1      GLY 112  -1.804  -7.865  -7.865
  805    H    THR 113           HN       THR 113  -2.017  -9.199  -9.199
  806    HA   THR 113           HA       THR 113  -4.881 -10.135 -10.135
  807    HB   THR 113           HB       THR 113  -2.830 -10.051 -10.051
  808    HG1  THR 113           HG1      THR 113  -3.734  -8.252  -8.252
  809   1HG2  THR 113          HG23      THR 113  -5.600 -11.229 -11.229
  810   2HG2  THR 113          HG22      THR 113  -4.947 -10.704 -10.704
  811   3HG2  THR 113          HG21      THR 113  -4.128 -11.979 -11.979
  812    H    GLN 114           HN       GLN 114  -5.066 -12.400 -12.400
  813    HA   GLN 114           HA       GLN 114  -2.615 -13.881 -13.881
  814   1HB   GLN 114           HB2      GLN 114  -4.909 -14.084 -14.084
  815   2HB   GLN 114           HB1      GLN 114  -5.451 -14.932 -14.932
  816   1HG   GLN 114           HG2      GLN 114  -4.752 -16.741 -16.741
  817   2HG   GLN 114           HG1      GLN 114  -3.224 -16.330 -16.330
  818   1HE2  GLN 114          HE22      GLN 114  -2.003 -16.426 -16.426
  819   2HE2  GLN 114          HE21      GLN 114  -2.141 -17.320 -17.320
  820    H    ILE 115           HN       ILE 115  -1.600 -15.375 -15.375
  821    HA   ILE 115           HA       ILE 115  -2.844 -15.582 -15.582
  822    HB   ILE 115           HB       ILE 115   0.037 -15.735 -15.735
  823   1HG1  ILE 115          HG12      ILE 115  -1.407 -13.887 -13.887
  824   2HG1  ILE 115          HG11      ILE 115  -0.910 -13.471 -13.471
  825   1HG2  ILE 115          HG21      ILE 115  -0.351 -17.444 -17.444
  826   2HG2  ILE 115          HG23      ILE 115  -1.028 -16.201 -16.201
  827   3HG2  ILE 115          HG22      ILE 115   0.673 -16.136 -16.136
  828   1HD1  ILE 115          HD11      ILE 115   1.463 -14.310 -14.310
  829   2HD1  ILE 115          HD13      ILE 115   0.738 -13.785 -13.785
  830   3HD1  ILE 115          HD12      ILE 115   0.920 -12.640 -12.640
  831    H    TYR 116           HN       TYR 116  -3.648 -17.596 -17.596
  832    HA   TYR 116           HA       TYR 116  -2.899 -19.908 -19.908
  833   1HB   TYR 116           HB2      TYR 116  -5.160 -19.333 -19.333
  834   2HB   TYR 116           HB1      TYR 116  -4.951 -20.892 -20.892
  835    HD1  TYR 116           HD2      TYR 116  -3.890 -19.451 -19.451
  836    HD2  TYR 116           HD1      TYR 116  -7.430 -19.041 -19.041
  837    HE1  TYR 116           HE2      TYR 116  -5.205 -18.662 -18.662
  838    HE2  TYR 116           HE1      TYR 116  -8.727 -18.297 -18.297
  839    HH   TYR 116           HH       TYR 116  -8.161 -18.804 -18.804
  840    H    VAL 117           HN       VAL 117  -1.724 -21.599 -21.599
  841    HA   VAL 117           HA       VAL 117  -0.964 -21.455 -21.455
  842    HB   VAL 117           HB       VAL 117   0.088 -23.072 -23.072
  843   1HG1  VAL 117          HG11      VAL 117   0.905 -22.930 -22.930
  844   2HG1  VAL 117          HG13      VAL 117   2.024 -23.467 -23.467
  845   3HG1  VAL 117          HG12      VAL 117   0.533 -24.364 -24.364
  846   1HG2  VAL 117          HG21      VAL 117   0.465 -20.531 -20.531
  847   2HG2  VAL 117          HG23      VAL 117   1.910 -21.534 -21.534
  848   3HG2  VAL 117          HG22      VAL 117   1.454 -20.845 -20.845
  849    H    ILE 118           HN       ILE 118  -0.887 -23.575 -23.575
  850    HA   ILE 118           HA       ILE 118  -3.336 -25.167 -25.167
  851    HB   ILE 118           HB       ILE 118  -1.591 -24.747 -24.747
  852   1HG1  ILE 118          HG12      ILE 118  -2.761 -22.707 -22.707
  853   2HG1  ILE 118          HG11      ILE 118  -3.542 -23.425 -23.425
  854   1HG2  ILE 118          HG21      ILE 118  -4.099 -26.348 -26.348
  855   2HG2  ILE 118          HG23      ILE 118  -3.725 -25.695 -25.695
  856   3HG2  ILE 118          HG22      ILE 118  -2.617 -26.830 -26.830
  857   1HD1  ILE 118          HD13      ILE 118  -4.871 -24.602 -24.602
  858   2HD1  ILE 118          HD12      ILE 118  -4.607 -22.954 -22.954
  859   3HD1  ILE 118          HD11      ILE 118  -5.465 -23.237 -23.237
  860    H    ASP 119           HN       ASP 119  -3.091 -27.307 -27.307
  861    HA   ASP 119           HA       ASP 119  -0.347 -28.449 -28.449
  862   1HB   ASP 119           HB2      ASP 119  -1.921 -28.339 -28.339
  863   2HB   ASP 119           HB1      ASP 119  -2.961 -29.483 -29.483
  864    HA   PRO 120           HA       PRO 120  -1.651 -30.765 -30.765
  865   1HB   PRO 120           HB2      PRO 120   0.718 -32.047 -32.047
  866   2HB   PRO 120           HB1      PRO 120   0.434 -30.355 -30.355
  867   1HG   PRO 120           HG2      PRO 120   1.905 -31.469 -31.469
  868   2HG   PRO 120           HG1      PRO 120   2.264 -30.045 -30.045
  869   1HD   PRO 120           HD2      PRO 120   1.105 -29.938 -29.938
  870   2HD   PRO 120           HD1      PRO 120   0.902 -28.691 -28.691
  871    H    GLU 121           HN       GLU 121  -2.907 -31.917 -31.917
  872    HA   GLU 121           HA       GLU 121  -1.736 -34.487 -34.487
  873   1HB   GLU 121           HB2      GLU 121  -4.375 -33.061 -33.061
  874   2HB   GLU 121           HB1      GLU 121  -4.020 -34.642 -34.642
  875   1HG   GLU 121           HG2      GLU 121  -2.093 -33.726 -33.726
  876   2HG   GLU 121           HG1      GLU 121  -2.346 -32.154 -32.154
  877    HA   PRO 122           HA       PRO 122  -3.440 -36.540 -36.540
  878   1HB   PRO 122           HB2      PRO 122  -3.176 -39.130 -39.130
  879   2HB   PRO 122           HB1      PRO 122  -1.819 -38.165 -38.165
  880   1HG   PRO 122           HG2      PRO 122  -2.606 -38.741 -38.741
  881   2HG   PRO 122           HG1      PRO 122  -0.994 -38.706 -38.706
  882   1HD   PRO 122           HD2      PRO 122  -1.952 -36.665 -36.665
  883   2HD   PRO 122           HD1      PRO 122  -0.839 -36.412 -36.412
  884    H    CYS 123           HN       CYS 123  -4.646 -36.877 -36.877
  885    HA   CYS 123           HA       CYS 123  -7.290 -37.758 -37.758
  886   1HB   CYS 123           HB2      CYS 123  -5.860 -38.578 -38.578
  887   2HB   CYS 123           HB1      CYS 123  -7.512 -39.045 -39.045
  888    HG   CYS 123           HG       CYS 123  -5.657 -40.861 -40.861
  889    HA   PRO 124           HA       PRO 124  -8.681 -34.088 -34.088
  890   1HB   PRO 124           HB2      PRO 124 -11.358 -34.649 -34.649
  891   2HB   PRO 124           HB1      PRO 124 -10.561 -34.136 -34.136
  892   1HG   PRO 124           HG2      PRO 124 -11.331 -36.872 -36.872
  893   2HG   PRO 124           HG1      PRO 124 -11.450 -36.134 -36.134
  894   1HD   PRO 124           HD2      PRO 124  -9.477 -37.864 -37.864
  895   2HD   PRO 124           HD1      PRO 124  -9.252 -36.560 -36.560
  896    H    ASP 125           HN       ASP 125  -9.617 -33.470 -33.470
  897    HA   ASP 125           HA       ASP 125  -9.066 -35.458 -35.458
  898   1HB   ASP 125           HB2      ASP 125  -8.442 -33.001 -33.001
  899   2HB   ASP 125           HB1      ASP 125 -10.155 -32.633 -32.633
  900    H    SER 126           HN       SER 126 -10.631 -36.847 -36.847
  901    HA   SER 126           HA       SER 126 -13.409 -36.651 -36.651
  902   1HB   SER 126           HB2      SER 126 -13.612 -38.595 -38.595
  903   2HB   SER 126           HB1      SER 126 -12.151 -38.735 -38.735
  904    HG   SER 126           HG       SER 126 -11.273 -38.988 -38.988
  905    H    ASP 127           HN       ASP 127 -11.577 -35.572 -35.572
  906    HA   ASP 127           HA       ASP 127 -13.834 -35.085 -35.085
  907   1HB   ASP 127           HB2      ASP 127 -11.384 -35.341 -35.341
  908   2HB   ASP 127           HB1      ASP 127 -11.120 -33.730 -33.730
  909    H    GLN 128           HN       GLN 128 -15.234 -33.367 -33.367
  910    HA   GLN 128           HA       GLN 128 -15.018 -31.313 -31.313
  911   1HB   GLN 128           HB2      GLN 128 -17.014 -31.891 -31.891
  912   2HB   GLN 128           HB1      GLN 128 -17.253 -30.685 -30.685
  913   1HG   GLN 128           HG2      GLN 128 -17.129 -32.410 -32.410
  914   2HG   GLN 128           HG1      GLN 128 -16.781 -33.637 -33.637
  915   1HE2  GLN 128          HE22      GLN 128 -20.599 -32.766 -32.766
  916   2HE2  GLN 128          HE21      GLN 128 -19.303 -32.311 -32.311
  917    H    GLU 129           HN       GLU 129 -14.793 -29.060 -29.060
  918    HA   GLU 129           HA       GLU 129 -13.894 -27.172 -27.172
  919   1HB   GLU 129           HB2      GLU 129 -15.359 -28.594 -28.594
  920   2HB   GLU 129           HB1      GLU 129 -14.804 -26.922 -26.922
  921   1HG   GLU 129           HG2      GLU 129 -16.971 -26.589 -26.589
  922   2HG   GLU 129           HG1      GLU 129 -16.134 -26.732 -26.732
  923    HA   PRO 130           HA       PRO 130 -10.647 -29.966 -29.966
  924   1HB   PRO 130           HB2      PRO 130  -8.736 -29.936 -29.936
  925   2HB   PRO 130           HB1      PRO 130  -9.991 -31.187 -31.187
  926   1HG   PRO 130           HG2      PRO 130  -9.870 -28.780 -28.780
  927   2HG   PRO 130           HG1      PRO 130 -10.415 -30.422 -30.422
  928   1HD   PRO 130           HD2      PRO 130 -12.130 -28.382 -28.382
  929   2HD   PRO 130           HD1      PRO 130 -12.505 -30.077 -30.077
  930    H    LYS 131           HN       LYS 131  -8.650 -29.097 -29.097
  931    HA   LYS 131           HA       LYS 131  -8.577 -26.212 -26.212
  932   1HB   LYS 131           HB2      LYS 131  -6.645 -28.415 -28.415
  933   2HB   LYS 131           HB1      LYS 131  -6.525 -26.741 -26.741
  934   1HG   LYS 131           HG2      LYS 131  -8.741 -26.897 -26.897
  935   2HG   LYS 131           HG1      LYS 131  -8.914 -28.553 -28.553
  936   1HD   LYS 131           HD2      LYS 131  -6.633 -27.674 -27.674
  937   2HD   LYS 131           HD1      LYS 131  -8.144 -28.331 -28.331
  938   1HE   LYS 131           HE2      LYS 131  -7.801 -30.418 -30.418
  939   2HE   LYS 131           HE1      LYS 131  -6.327 -29.760 -29.760
  940   1HZ   LYS 131           HZ3      LYS 131  -6.803 -30.055 -30.055
  941   2HZ   LYS 131           HZ2      LYS 131  -5.814 -31.069 -31.069
  942   3HZ   LYS 131           HZ1      LYS 131  -5.397 -29.437 -29.437
  943    H1   NAG 132           H1       NAG 132  -2.438  -6.764  -6.764
  944    H2   NAG 132           H2       NAG 132  -3.709  -4.025  -4.025
  945    H3   NAG 132           H3       NAG 132  -1.276  -5.093  -5.093
  946    H4   NAG 132           H4       NAG 132  -4.095  -4.656  -4.656
  947    H5   NAG 132           H5       NAG 132  -2.733  -7.330  -7.330
  948   1H6   NAG 132           H61      NAG 132  -4.208  -7.436  -7.436
  949   2H6   NAG 132           H62      NAG 132  -5.493  -6.666  -6.666
  950   1H8   NAG 132           H81      NAG 132  -0.651  -2.917  -2.917
  951   2H8   NAG 132           H82      NAG 132  -0.439  -1.372  -1.372
  952   3H8   NAG 132           H83      NAG 132   0.511  -2.795  -2.795
  953    HN2  NAG 132           HN2      NAG 132  -1.302  -4.823  -4.823
  954    HO3  NAG 132           HO3      NAG 132  -1.106  -3.070  -3.070
  955    H1   NAG 133           H1       NAG 133  -4.309  -5.596  -5.596
  956    H2   NAG 133           H2       NAG 133  -1.646  -5.786  -5.786
  957    H3   NAG 133           H3       NAG 133  -4.488  -6.298  -6.298
  958    H4   NAG 133           H4       NAG 133  -2.640  -3.944  -3.944
  959    H5   NAG 133           H5       NAG 133  -5.203  -3.943  -3.943
  960   1H6   NAG 133           H61      NAG 133  -3.399  -1.856  -1.856
  961   2H6   NAG 133           H62      NAG 133  -5.164  -1.873  -1.873
  962   1H8   NAG 133           H81      NAG 133  -5.095  -7.989  -7.989
  963   2H8   NAG 133           H82      NAG 133  -4.722  -9.736  -9.736
  964   3H8   NAG 133           H83      NAG 133  -4.813  -8.812  -8.812
  965    HN2  NAG 133           HN2      NAG 133  -2.390  -7.716  -7.716
  966    HO3  NAG 133           HO3      NAG 133  -1.967  -6.079  -6.079
  967    HO6  NAG 133           HO6      NAG 133  -4.362  -0.522  -0.522
  968    H1   FUC 134           H1       FUC 134  -4.698  -9.368  -9.368
  969    H2   FUC 134           H2       FUC 134  -7.654  -9.695  -9.695
  970    H3   FUC 134           H3       FUC 134  -7.187  -7.881  -7.881
  971    H4   FUC 134           H4       FUC 134  -8.191  -9.929  -9.929
  972    H5   FUC 134           H5       FUC 134  -5.571 -10.177 -10.177
  973   1H6   FUC 134           H61      FUC 134  -5.411 -12.537 -12.537
  974   2H6   FUC 134           H62      FUC 134  -6.941 -12.765 -12.765
  975   3H6   FUC 134           H63      FUC 134  -6.976 -12.146 -12.146
  976    HO2  FUC 134           HO2      FUC 134  -7.151  -7.027  -7.027
  977    HO3  FUC 134           HO3      FUC 134  -9.531  -8.437  -8.437
  978    HO4  FUC 134           HO4      FUC 134  -8.757 -11.693 -11.693
  979    H1   MAN 135           H1       MAN 135  -2.819  -4.253  -4.253
  980    H2   MAN 135           H2       MAN 135  -3.536  -1.881  -1.881
  981    H3   MAN 135           H3       MAN 135  -2.425  -2.472  -2.472
  982    H4   MAN 135           H4       MAN 135  -5.159  -3.183  -3.183
  983    H5   MAN 135           H5       MAN 135  -2.837  -5.044  -5.044
  984   1H6   MAN 135           H61      MAN 135  -4.364  -6.831  -6.831
  985   2H6   MAN 135           H62      MAN 135  -4.115  -5.816  -5.816
  986    HO2  MAN 135           HO2      MAN 135  -5.708  -1.869  -1.869
  987    HO3  MAN 135           HO3      MAN 135  -3.548  -0.941  -0.941
  988    HO4  MAN 135           HO4      MAN 135  -3.809  -3.921  -3.921
  989    HO6  MAN 135           HO6      MAN 135  -6.427  -6.410  -6.410
  990    H1   NAG 136           H1       NAG 136   0.445  -8.907  -8.907
  991    H2   NAG 136           H2       NAG 136  -2.357  -8.950  -8.950
  992    H3   NAG 136           H3       NAG 136  -0.028 -10.930 -10.930
  993    H4   NAG 136           H4       NAG 136  -1.083  -8.887  -8.887
  994    H5   NAG 136           H5       NAG 136   1.487  -8.737  -8.737
  995   1H6   NAG 136           H61      NAG 136   1.948  -6.899  -6.899
  996   2H6   NAG 136           H62      NAG 136   0.918  -7.765  -7.765
  997   1H8   NAG 136           H81      NAG 136  -4.274 -11.272 -11.272
  998   2H8   NAG 136           H82      NAG 136  -4.764 -11.048 -11.048
  999   3H8   NAG 136           H83      NAG 136  -3.437 -12.176 -12.176
 1000    HN2  NAG 136           HN2      NAG 136  -1.253 -11.096 -11.096
 1001    HO3  NAG 136           HO3      NAG 136  -2.409 -10.704 -10.704
 1002    H1   NAG 137           H1       NAG 137   2.097  -9.254  -9.254
 1003    H2   NAG 137           H2       NAG 137   1.832 -12.275 -12.275
 1004    H3   NAG 137           H3       NAG 137   4.435 -10.675 -10.675
 1005    H4   NAG 137           H4       NAG 137   3.505 -12.179 -12.179
 1006    H5   NAG 137           H5       NAG 137   3.675  -9.138  -9.138
 1007   1H6   NAG 137           H61      NAG 137   2.464  -9.118  -9.118
 1008   2H6   NAG 137           H62      NAG 137   2.904 -10.830 -10.830
 1009   1H8   NAG 137           H81      NAG 137   4.764 -11.313 -11.313
 1010   2H8   NAG 137           H82      NAG 137   3.522 -10.345 -10.345
 1011   3H8   NAG 137           H83      NAG 137   3.166 -12.027 -12.027
 1012    HN2  NAG 137           HN2      NAG 137   1.697 -11.886 -11.886
 1013    HO3  NAG 137           HO3      NAG 137   5.261 -12.620 -12.620
 1014    HO6  NAG 137           HO6      NAG 137   4.567  -9.728  -9.728
 1015    H1   FUC 138           H1       FUC 138  -0.992  -6.800  -6.800
 1016    H2   FUC 138           H2       FUC 138  -1.694  -4.013  -4.013
 1017    H3   FUC 138           H3       FUC 138  -0.631  -3.974  -3.974
 1018    H4   FUC 138           H4       FUC 138   1.113  -2.433  -2.433
 1019    H5   FUC 138           H5       FUC 138   1.817  -4.973  -4.973
 1020   1H6   FUC 138           H61      FUC 138   2.046  -4.032  -4.032
 1021   2H6   FUC 138           H62      FUC 138   2.805  -2.984  -2.984
 1022   3H6   FUC 138           H63      FUC 138   3.288  -4.705  -4.705
 1023    HO2  FUC 138           HO2      FUC 138  -2.845  -6.042  -6.042
 1024    HO3  FUC 138           HO3      FUC 138  -2.081  -2.294  -2.294
 1025    HO4  FUC 138           HO4      FUC 138   0.758  -1.691  -1.691
 1026    H1   MAN 139           H1       MAN 139   5.405 -13.232 -13.232
 1027    H2   MAN 139           H2       MAN 139   6.160 -12.728 -12.728
 1028    H3   MAN 139           H3       MAN 139   7.190 -14.678 -14.678
 1029    H4   MAN 139           H4       MAN 139   9.375 -12.839 -12.839
 1030    H5   MAN 139           H5       MAN 139   7.150 -14.306 -14.306
 1031   1H6   MAN 139           H61      MAN 139   7.962 -13.239 -13.239
 1032   2H6   MAN 139           H62      MAN 139   9.342 -14.045 -14.045
 1033    HO2  MAN 139           HO2      MAN 139   7.934 -11.394 -11.394
 1034    HO3  MAN 139           HO3      MAN 139   9.375 -14.370 -14.370
 1035    HO4  MAN 139           HO4      MAN 139   8.793 -15.602 -15.602
 1036    HO6  MAN 139           HO6      MAN 139  10.263 -12.146 -12.146

  Start of MODEL   18
    1   1H    ALA   1           HT1      ALA   1 -14.214   4.916   4.916
    2   2H    ALA   1           HT3      ALA   1 -15.753   4.581   4.581
    3   3H    ALA   1           HT2      ALA   1 -14.601   3.339   3.339
    4    HA   ALA   1           HA       ALA   1 -14.814   4.115   4.115
    5   1HB   ALA   1           HB2      ALA   1 -15.437   6.432   6.432
    6   2HB   ALA   1           HB1      ALA   1 -13.697   6.713   6.713
    7   3HB   ALA   1           HB3      ALA   1 -14.495   6.409   6.409
    8    H    MET   1           HN       MET   1 -12.337   5.410   5.410
    9    HA   MET   1           HA       MET   1 -10.000   5.126   5.126
   10   1HB   MET   1           HB2      MET   1 -10.875   2.541   2.541
   11   2HB   MET   1           HB1      MET   1  -9.271   2.820   2.820
   12   1HG   MET   1           HG2      MET   1 -10.222   3.186   3.186
   13   2HG   MET   1           HG1      MET   1 -11.855   3.030   3.030
   14   1HE   MET   1           HE1      MET   1 -12.392   1.357   1.357
   15   2HE   MET   1           HE3      MET   1 -11.788  -0.302  -0.302
   16   3HE   MET   1           HE2      MET   1 -12.949   0.140   0.140
   17    H    HIS   2           HN       HIS   2  -8.026   4.869   4.869
   18    HA   HIS   2           HA       HIS   2  -8.663   5.715   5.715
   19   1HB   HIS   2           HB2      HIS   2  -6.432   6.531   6.531
   20   2HB   HIS   2           HB1      HIS   2  -6.561   7.068   7.068
   21    HD1  HIS   2           HD1      HIS   2  -7.977   7.621   7.621
   22    HD2  HIS   2           HD2      HIS   2  -8.796   8.832   8.832
   23    HE1  HIS   2           HE1      HIS   2  -9.607   9.552   9.552
   24    H    VAL   3           HN       VAL   3  -8.133   2.999   2.999
   25    HA   VAL   3           HA       VAL   3  -5.953   2.269   2.269
   26    HB   VAL   3           HB       VAL   3  -6.047   1.564   1.564
   27   1HG1  VAL   3          HG13      VAL   3  -4.285   0.626   0.626
   28   2HG1  VAL   3          HG12      VAL   3  -3.741   0.571   0.571
   29   3HG1  VAL   3          HG11      VAL   3  -5.160  -0.350  -0.350
   30   1HG2  VAL   3          HG23      VAL   3  -4.255   3.339   3.339
   31   2HG2  VAL   3          HG22      VAL   3  -5.209   3.790   3.790
   32   3HG2  VAL   3          HG21      VAL   3  -3.790   2.760   2.760
   33    H    ALA   4           HN       ALA   4  -6.271   0.194   0.194
   34    HA   ALA   4           HA       ALA   4  -8.694  -1.300  -1.300
   35   1HB   ALA   4           HB1      ALA   4  -7.716  -0.397  -0.397
   36   2HB   ALA   4           HB3      ALA   4  -8.411  -2.019  -2.019
   37   3HB   ALA   4           HB2      ALA   4  -9.370  -0.632  -0.632
   38    H    GLN   5           HN       GLN   5  -8.243  -3.342  -3.342
   39    HA   GLN   5           HA       GLN   5  -5.897  -4.788  -4.788
   40   1HB   GLN   5           HB2      GLN   5  -6.507  -4.183  -4.183
   41   2HB   GLN   5           HB1      GLN   5  -5.383  -5.453  -5.453
   42   1HG   GLN   5           HG2      GLN   5  -5.134  -2.570  -2.570
   43   2HG   GLN   5           HG1      GLN   5  -4.282  -3.242  -3.242
   44   1HE2  GLN   5          HE22      GLN   5  -1.854  -4.892  -4.892
   45   2HE2  GLN   5          HE21      GLN   5  -2.430  -4.544  -4.544
   46    HA   PRO   6           HA       PRO   6  -9.055  -8.009  -8.009
   47   1HB   PRO   6           HB2      PRO   6  -7.509 -10.055 -10.055
   48   2HB   PRO   6           HB1      PRO   6  -8.203  -8.815  -8.815
   49   1HG   PRO   6           HG2      PRO   6  -5.437  -9.065  -9.065
   50   2HG   PRO   6           HG1      PRO   6  -5.991  -8.533  -8.533
   51   1HD   PRO   6           HD2      PRO   6  -5.168  -6.826  -6.826
   52   2HD   PRO   6           HD1      PRO   6  -6.333  -6.383  -6.383
   53    H    ALA   7           HN       ALA   7  -9.557  -9.468  -9.468
   54    HA   ALA   7           HA       ALA   7  -7.778  -9.646  -9.646
   55   1HB   ALA   7           HB2      ALA   7 -10.277  -9.673  -9.673
   56   2HB   ALA   7           HB1      ALA   7 -10.263 -11.243 -11.243
   57   3HB   ALA   7           HB3      ALA   7  -9.581 -11.075 -11.075
   58    H    VAL   8           HN       VAL   8  -8.432 -11.755 -11.755
   59    HA   VAL   8           HA       VAL   8  -6.060 -13.292 -13.292
   60    HB   VAL   8           HB       VAL   8  -8.175 -14.132 -14.132
   61   1HG1  VAL   8          HG13      VAL   8  -8.948 -14.685 -14.685
   62   2HG1  VAL   8          HG12      VAL   8  -9.146 -16.032 -16.032
   63   3HG1  VAL   8          HG11      VAL   8  -9.953 -14.485 -14.485
   64   1HG2  VAL   8          HG22      VAL   8  -5.897 -15.391 -15.391
   65   2HG2  VAL   8          HG21      VAL   8  -6.977 -15.987 -15.987
   66   3HG2  VAL   8          HG23      VAL   8  -7.197 -16.481 -16.481
   67    H    VAL   9           HN       VAL   9  -5.463 -14.801 -14.801
   68    HA   VAL   9           HA       VAL   9  -6.678 -14.381 -14.381
   69    HB   VAL   9           HB       VAL   9  -3.927 -13.699 -13.699
   70   1HG1  VAL   9          HG11      VAL   9  -4.707 -14.524 -14.524
   71   2HG1  VAL   9          HG13      VAL   9  -3.346 -13.441 -13.441
   72   3HG1  VAL   9          HG12      VAL   9  -3.332 -15.082 -15.082
   73   1HG2  VAL   9          HG21      VAL   9  -5.846 -12.051 -12.051
   74   2HG2  VAL   9          HG23      VAL   9  -4.359 -11.634 -11.634
   75   3HG2  VAL   9          HG22      VAL   9  -5.716 -12.325 -12.325
   76    H    LEU  10           HN       LEU  10  -6.249 -16.109 -16.109
   77    HA   LEU  10           HA       LEU  10  -5.215 -18.602 -18.602
   78   1HB   LEU  10           HB2      LEU  10  -7.144 -18.156 -18.156
   79   2HB   LEU  10           HB1      LEU  10  -6.713 -19.727 -19.727
   80    HG   LEU  10           HG       LEU  10  -8.024 -17.476 -17.476
   81   1HD1  LEU  10          HD13      LEU  10  -9.521 -18.452 -18.452
   82   2HD1  LEU  10          HD12      LEU  10  -9.191 -20.063 -20.063
   83   3HD1  LEU  10          HD11      LEU  10 -10.043 -18.880 -18.880
   84   1HD2  LEU  10          HD22      LEU  10  -6.601 -19.793 -19.793
   85   2HD2  LEU  10          HD21      LEU  10  -7.532 -18.668 -18.668
   86   3HD2  LEU  10          HD23      LEU  10  -8.308 -20.096 -20.096
   87    H    ALA  11           HN       ALA  11  -3.313 -19.379 -19.379
   88    HA   ALA  11           HA       ALA  11  -2.155 -18.106 -18.106
   89   1HB   ALA  11           HB1      ALA  11  -1.062 -18.668 -18.668
   90   2HB   ALA  11           HB3      ALA  11  -0.954 -20.313 -20.313
   91   3HB   ALA  11           HB2      ALA  11  -0.133 -18.994 -18.994
   92    H    SER  12           HN       SER  12  -1.547 -19.255 -19.255
   93    HA   SER  12           HA       SER  12  -3.256 -21.435 -21.435
   94   1HB   SER  12           HB2      SER  12  -2.283 -19.672 -19.672
   95   2HB   SER  12           HB1      SER  12  -0.681 -20.348 -20.348
   96    HG   SER  12           HG       SER  12  -1.525 -21.198 -21.198
   97    H    SER  13           HN       SER  13  -2.214 -23.486 -23.486
   98    HA   SER  13           HA       SER  13  -0.981 -25.070 -25.070
   99   1HB   SER  13           HB2      SER  13  -2.300 -25.877 -25.877
  100   2HB   SER  13           HB1      SER  13  -0.971 -25.416 -25.416
  101    HG   SER  13           HG       SER  13   0.239 -27.015 -27.015
  102    H    ARG  14           HN       ARG  14   0.402 -23.231 -23.231
  103    HA   ARG  14           HA       ARG  14   3.084 -24.164 -24.164
  104   1HB   ARG  14           HB2      ARG  14   2.039 -22.654 -22.654
  105   2HB   ARG  14           HB1      ARG  14   2.032 -21.360 -21.360
  106   1HG   ARG  14           HG2      ARG  14   4.002 -21.027 -21.027
  107   2HG   ARG  14           HG1      ARG  14   4.547 -21.711 -21.711
  108   1HD   ARG  14           HD2      ARG  14   4.694 -23.936 -23.936
  109   2HD   ARG  14           HD1      ARG  14   4.048 -23.321 -23.321
  110    HE   ARG  14           HE       ARG  14   6.283 -21.709 -21.709
  111   1HH1  ARG  14          HH21      ARG  14   5.566 -24.959 -24.959
  112   2HH1  ARG  14          HH22      ARG  14   7.108 -25.155 -25.155
  113   1HH2  ARG  14          HH11      ARG  14   8.265 -22.007 -22.007
  114   2HH2  ARG  14          HH12      ARG  14   8.621 -23.504 -23.504
  115    H    GLY  15           HN       GLY  15   1.357 -22.057 -22.057
  116   1HA   GLY  15           HA2      GLY  15   2.137 -21.700 -21.700
  117   2HA   GLY  15           HA1      GLY  15   3.795 -21.881 -21.881
  118    H    ILE  16           HN       ILE  16   1.493 -19.980 -19.980
  119    HA   ILE  16           HA       ILE  16   3.019 -17.553 -17.553
  120    HB   ILE  16           HB       ILE  16   1.647 -18.547 -18.547
  121   1HG1  ILE  16          HG12      ILE  16   3.824 -17.774 -17.774
  122   2HG1  ILE  16          HG11      ILE  16   4.334 -17.329 -17.329
  123   1HG2  ILE  16          HG22      ILE  16   2.122 -15.676 -15.676
  124   2HG2  ILE  16          HG21      ILE  16   2.286 -16.163 -16.163
  125   3HG2  ILE  16          HG23      ILE  16   0.748 -16.380 -16.380
  126   1HD1  ILE  16          HD13      ILE  16   3.377 -20.125 -20.125
  127   2HD1  ILE  16          HD12      ILE  16   5.007 -19.658 -19.658
  128   3HD1  ILE  16          HD11      ILE  16   4.536 -19.523 -19.523
  129    H    ALA  17           HN       ALA  17   1.998 -16.378 -16.378
  130    HA   ALA  17           HA       ALA  17  -0.990 -16.134 -16.134
  131   1HB   ALA  17           HB3      ALA  17   0.047 -17.056 -17.056
  132   2HB   ALA  17           HB2      ALA  17   1.015 -15.590 -15.590
  133   3HB   ALA  17           HB1      ALA  17  -0.741 -15.507 -15.507
  134    H    SER  18           HN       SER  18  -1.688 -14.167 -14.167
  135    HA   SER  18           HA       SER  18   0.203 -11.845 -11.845
  136   1HB   SER  18           HB2      SER  18  -1.675 -12.647 -12.647
  137   2HB   SER  18           HB1      SER  18  -0.668 -11.202 -11.202
  138    HG   SER  18           HG       SER  18  -0.002 -13.601 -13.601
  139    H    PHE  19           HN       PHE  19  -0.658  -9.931  -9.931
  140    HA   PHE  19           HA       PHE  19  -3.589  -9.527  -9.527
  141   1HB   PHE  19           HB2      PHE  19  -3.472  -8.958  -8.958
  142   2HB   PHE  19           HB1      PHE  19  -3.061 -10.638 -10.638
  143    HD1  PHE  19           HD2      PHE  19  -0.755 -11.464 -11.464
  144    HD2  PHE  19           HD1      PHE  19  -1.759  -7.321  -7.321
  145    HE1  PHE  19           HE2      PHE  19   1.459 -11.136 -11.136
  146    HE2  PHE  19           HE1      PHE  19   0.454  -6.993  -6.993
  147    HZ   PHE  19           HZ       PHE  19   2.062  -8.902  -8.902
  148    H    VAL  20           HN       VAL  20  -4.072  -7.218  -7.218
  149    HA   VAL  20           HA       VAL  20  -1.751  -5.420  -5.420
  150    HB   VAL  20           HB       VAL  20  -4.567  -5.350  -5.350
  151   1HG1  VAL  20          HG13      VAL  20  -3.405  -3.108  -3.108
  152   2HG1  VAL  20          HG12      VAL  20  -2.216  -3.646  -3.646
  153   3HG1  VAL  20          HG11      VAL  20  -3.908  -3.464  -3.464
  154   1HG2  VAL  20          HG22      VAL  20  -2.999  -7.142  -7.142
  155   2HG2  VAL  20          HG21      VAL  20  -3.606  -6.017  -6.017
  156   3HG2  VAL  20          HG23      VAL  20  -1.968  -5.837  -5.837
  157    H    CYS  21           HN       CYS  21  -1.505  -3.909  -3.909
  158    HA   CYS  21           HA       CYS  21  -3.792  -3.325  -3.325
  159   1HB   CYS  21           HB2      CYS  21  -1.532  -4.107  -4.107
  160   2HB   CYS  21           HB1      CYS  21  -0.845  -2.614  -2.614
  161    H    GLU  22           HN       GLU  22  -4.996  -1.637  -1.637
  162    HA   GLU  22           HA       GLU  22  -3.720   0.532   0.532
  163   1HB   GLU  22           HB2      GLU  22  -5.818  -0.367  -0.367
  164   2HB   GLU  22           HB1      GLU  22  -6.544  -0.135  -0.135
  165   1HG   GLU  22           HG2      GLU  22  -6.651   2.204   2.204
  166   2HG   GLU  22           HG1      GLU  22  -5.460   2.206   2.206
  167    H    TYR  23           HN       TYR  23  -3.342   2.593   2.593
  168    HA   TYR  23           HA       TYR  23  -4.120   3.228   3.228
  169   1HB   TYR  23           HB2      TYR  23  -1.859   4.037   4.037
  170   2HB   TYR  23           HB1      TYR  23  -1.741   2.420   2.420
  171    HD1  TYR  23           HD1      TYR  23  -1.330   6.055   6.055
  172    HD2  TYR  23           HD2      TYR  23  -0.878   2.050   2.050
  173    HE1  TYR  23           HE1      TYR  23   0.076   6.950   6.950
  174    HE2  TYR  23           HE2      TYR  23   0.526   2.944   2.944
  175    HH   TYR  23           HH       TYR  23   0.604   5.679   5.679
  176    H    ALA  24           HN       ALA  24  -3.621   5.706   5.706
  177    HA   ALA  24           HA       ALA  24  -4.326   7.261   7.261
  178   1HB   ALA  24           HB1      ALA  24  -6.305   6.502   6.502
  179   2HB   ALA  24           HB3      ALA  24  -5.692   7.660   7.660
  180   3HB   ALA  24           HB2      ALA  24  -6.218   8.216   8.216
  181    H    SER  25           HN       SER  25  -3.293   9.253   9.253
  182    HA   SER  25           HA       SER  25  -1.859  10.141  10.141
  183   1HB   SER  25           HB2      SER  25   0.009  10.721  10.721
  184   2HB   SER  25           HB1      SER  25  -0.462   9.067   9.067
  185    HG   SER  25           HG       SER  25  -0.551  11.330  11.330
  186    HA   PRO  26           HA       PRO  26  -3.924  13.990  13.990
  187   1HB   PRO  26           HB2      PRO  26  -2.163  15.713  15.713
  188   2HB   PRO  26           HB1      PRO  26  -3.232  14.628  14.628
  189   1HG   PRO  26           HG2      PRO  26  -0.345  14.316  14.316
  190   2HG   PRO  26           HG1      PRO  26  -1.203  13.938  13.938
  191   1HD   PRO  26           HD2      PRO  26  -0.504  12.045  12.045
  192   2HD   PRO  26           HD1      PRO  26  -1.934  11.904  11.904
  193    H    GLY  27           HN       GLY  27  -0.790  13.336  13.336
  194   1HA   GLY  27           HA2      GLY  27  -1.262  15.332  15.332
  195   2HA   GLY  27           HA1      GLY  27   0.224  15.529  15.529
  196    H    LYS  28           HN       LYS  28   1.081  15.147  15.147
  197    HA   LYS  28           HA       LYS  28   1.254  12.221  12.221
  198   1HB   LYS  28           HB2      LYS  28   1.748  14.718  14.718
  199   2HB   LYS  28           HB1      LYS  28   1.890  13.067  13.067
  200   1HG   LYS  28           HG2      LYS  28  -0.641  14.214  14.214
  201   2HG   LYS  28           HG1      LYS  28  -0.322  14.140  14.140
  202   1HD   LYS  28           HD2      LYS  28  -0.039  11.670  11.670
  203   2HD   LYS  28           HD1      LYS  28  -0.476  11.780  11.780
  204   1HE   LYS  28           HE2      LYS  28  -2.683  12.670  12.670
  205   2HE   LYS  28           HE1      LYS  28  -2.251  12.674  12.674
  206   1HZ   LYS  28           HZ1      LYS  28  -2.213  10.277  10.277
  207   2HZ   LYS  28           HZ3      LYS  28  -3.445  10.640  10.640
  208   3HZ   LYS  28           HZ2      LYS  28  -1.875  10.310  10.310
  209    H    ALA  29           HN       ALA  29   3.217  11.231  11.231
  210    HA   ALA  29           HA       ALA  29   5.700  12.896  12.896
  211   1HB   ALA  29           HB1      ALA  29   4.411  11.289  11.289
  212   2HB   ALA  29           HB3      ALA  29   6.145  11.025  11.025
  213   3HB   ALA  29           HB2      ALA  29   5.530  12.645  12.645
  214    H    THR  30           HN       THR  30   7.594  11.692  11.692
  215    HA   THR  30           HA       THR  30   7.055   9.474   9.474
  216    HB   THR  30           HB       THR  30   9.416   9.682   9.682
  217    HG1  THR  30           HG1      THR  30  10.721  10.998  10.998
  218   1HG2  THR  30          HG23      THR  30   7.686  11.833  11.833
  219   2HG2  THR  30          HG22      THR  30   9.127  12.501  12.501
  220   3HG2  THR  30          HG21      THR  30   9.255  11.701  11.701
  221    H    GLU  31           HN       GLU  31   8.832   9.883   9.883
  222    HA   GLU  31           HA       GLU  31   9.703   7.118   7.118
  223   1HB   GLU  31           HB2      GLU  31   9.664   9.332   9.332
  224   2HB   GLU  31           HB1      GLU  31  10.590   7.840   7.840
  225   1HG   GLU  31           HG2      GLU  31  10.952   9.468   9.468
  226   2HG   GLU  31           HG1      GLU  31  11.670  10.078  10.078
  227    H    VAL  32           HN       VAL  32   7.600   5.961   5.961
  228    HA   VAL  32           HA       VAL  32   6.023   6.159   6.159
  229    HB   VAL  32           HB       VAL  32   5.547   4.562   4.562
  230   1HG1  VAL  32          HG12      VAL  32   4.123   4.887   4.887
  231   2HG1  VAL  32          HG11      VAL  32   3.124   4.832   4.832
  232   3HG1  VAL  32          HG13      VAL  32   4.197   3.487   3.487
  233   1HG2  VAL  32          HG21      VAL  32   4.830   7.341   7.341
  234   2HG2  VAL  32          HG23      VAL  32   5.220   6.731   6.731
  235   3HG2  VAL  32          HG22      VAL  32   3.629   6.425   6.425
  236    H    ARG  33           HN       ARG  33   7.626   5.197   5.197
  237    HA   ARG  33           HA       ARG  33   9.036   2.770   2.770
  238   1HB   ARG  33           HB2      ARG  33   9.548   4.598   4.598
  239   2HB   ARG  33           HB1      ARG  33   8.287   3.891   3.891
  240   1HG   ARG  33           HG2      ARG  33  10.419   2.090   2.090
  241   2HG   ARG  33           HG1      ARG  33  10.814   3.144   3.144
  242   1HD   ARG  33           HD2      ARG  33   8.233   1.800   1.800
  243   2HD   ARG  33           HD1      ARG  33   9.585   0.663   0.663
  244    HE   ARG  33           HE       ARG  33   9.199   2.616   2.616
  245   1HH1  ARG  33          HH21      ARG  33  11.525   0.692   0.692
  246   2HH1  ARG  33          HH22      ARG  33  12.654   0.675   0.675
  247   1HH2  ARG  33          HH11      ARG  33  10.691   2.567   2.567
  248   2HH2  ARG  33          HH12      ARG  33  12.191   1.725   1.725
  249    H    VAL  34           HN       VAL  34   8.209   0.705   0.705
  250    HA   VAL  34           HA       VAL  34   5.776   0.143   0.143
  251    HB   VAL  34           HB       VAL  34   5.242  -1.524  -1.524
  252   1HG1  VAL  34          HG11      VAL  34   4.441   0.885   0.885
  253   2HG1  VAL  34          HG13      VAL  34   5.716   1.223   1.223
  254   3HG1  VAL  34          HG12      VAL  34   4.429   0.088   0.088
  255   1HG2  VAL  34          HG23      VAL  34   7.699  -1.711  -1.711
  256   2HG2  VAL  34          HG22      VAL  34   6.490  -1.650  -1.650
  257   3HG2  VAL  34          HG21      VAL  34   7.424  -0.210  -0.210
  258    H    THR  35           HN       THR  35   5.901  -1.558  -1.558
  259    HA   THR  35           HA       THR  35   8.207  -3.448  -3.448
  260    HB   THR  35           HB       THR  35   7.260  -2.009  -2.009
  261    HG1  THR  35           HG1      THR  35   9.284  -1.016  -1.016
  262   1HG2  THR  35          HG23      THR  35   9.165  -4.262  -4.262
  263   2HG2  THR  35          HG22      THR  35   9.558  -3.088  -3.088
  264   3HG2  THR  35          HG21      THR  35   8.057  -4.010  -4.010
  265    H    VAL  36           HN       VAL  36   7.841  -5.482  -5.482
  266    HA   VAL  36           HA       VAL  36   4.967  -6.090  -6.090
  267    HB   VAL  36           HB       VAL  36   7.053  -7.701  -7.701
  268   1HG1  VAL  36          HG12      VAL  36   4.163  -8.330  -8.330
  269   2HG1  VAL  36          HG11      VAL  36   5.148  -9.258  -9.258
  270   3HG1  VAL  36          HG13      VAL  36   5.588  -9.195  -9.195
  271   1HG2  VAL  36          HG21      VAL  36   4.835  -5.880  -5.880
  272   2HG2  VAL  36          HG23      VAL  36   6.332  -6.255  -6.255
  273   3HG2  VAL  36          HG22      VAL  36   4.970  -7.371  -7.371
  274    H    LEU  37           HN       LEU  37   4.641  -7.360  -7.360
  275    HA   LEU  37           HA       LEU  37   7.187  -8.325  -8.325
  276   1HB   LEU  37           HB2      LEU  37   4.772  -6.981  -6.981
  277   2HB   LEU  37           HB1      LEU  37   6.188  -7.544  -7.544
  278    HG   LEU  37           HG       LEU  37   6.644  -5.657  -5.657
  279   1HD1  LEU  37          HD12      LEU  37   4.669  -5.033  -5.033
  280   2HD1  LEU  37          HD11      LEU  37   6.112  -4.302  -4.302
  281   3HD1  LEU  37          HD13      LEU  37   5.612  -3.864  -3.864
  282   1HD2  LEU  37          HD21      LEU  37   8.090  -6.763  -6.763
  283   2HD2  LEU  37          HD23      LEU  37   8.672  -5.628  -5.628
  284   3HD2  LEU  37          HD22      LEU  37   7.959  -5.025  -5.025
  285    H    ARG  38           HN       ARG  38   6.680  -9.842  -9.842
  286    HA   ARG  38           HA       ARG  38   4.263 -11.544 -11.544
  287   1HB   ARG  38           HB2      ARG  38   7.151 -12.280 -12.280
  288   2HB   ARG  38           HB1      ARG  38   5.831 -13.443 -13.443
  289   1HG   ARG  38           HG2      ARG  38   5.249 -13.108 -13.108
  290   2HG   ARG  38           HG1      ARG  38   6.473 -11.853 -11.853
  291   1HD   ARG  38           HD2      ARG  38   8.201 -13.604 -13.604
  292   2HD   ARG  38           HD1      ARG  38   6.919 -14.814 -14.814
  293    HE   ARG  38           HE       ARG  38   7.095 -13.016 -13.016
  294   1HH1  ARG  38          HH21      ARG  38   8.463 -15.888 -15.888
  295   2HH1  ARG  38          HH22      ARG  38   9.021 -16.510 -16.510
  296   1HH2  ARG  38          HH11      ARG  38   7.834 -13.860 -13.860
  297   2HH2  ARG  38          HH12      ARG  38   8.670 -15.376 -15.376
  298    H    GLN  39           HN       GLN  39   2.970 -11.405 -11.405
  299    HA   GLN  39           HA       GLN  39   4.331 -10.776 -10.776
  300   1HB   GLN  39           HB2      GLN  39   1.505 -10.532 -10.532
  301   2HB   GLN  39           HB1      GLN  39   1.906 -10.287 -10.287
  302   1HG   GLN  39           HG2      GLN  39   3.378  -8.468  -8.468
  303   2HG   GLN  39           HG1      GLN  39   3.312  -8.815  -8.815
  304   1HE2  GLN  39          HE22      GLN  39  -0.244  -7.662  -7.662
  305   2HE2  GLN  39          HE21      GLN  39   0.560  -9.104  -9.104
  306    H    ALA  40           HN       ALA  40   4.587 -12.295 -12.295
  307    HA   ALA  40           HA       ALA  40   3.235 -14.924 -14.924
  308   1HB   ALA  40           HB3      ALA  40   5.820 -14.131 -14.131
  309   2HB   ALA  40           HB2      ALA  40   5.248 -14.451 -14.451
  310   3HB   ALA  40           HB1      ALA  40   5.183 -15.723 -15.723
  311    H    ASP  41           HN       ASP  41   3.106 -15.862 -15.862
  312    HA   ASP  41           HA       ASP  41   0.790 -14.680 -14.680
  313   1HB   ASP  41           HB2      ASP  41   2.912 -16.529 -16.529
  314   2HB   ASP  41           HB1      ASP  41   1.472 -16.149 -16.149
  315    H    SER  42           HN       SER  42   4.220 -14.364 -14.364
  316    HA   SER  42           HA       SER  42   3.424 -11.940 -11.940
  317   1HB   SER  42           HB2      SER  42   5.054 -12.713 -12.713
  318   2HB   SER  42           HB1      SER  42   3.768 -13.888 -13.888
  319    HG   SER  42           HG       SER  42   6.382 -14.224 -14.224
  320    H    GLN  43           HN       GLN  43   5.307 -13.024 -13.024
  321    HA   GLN  43           HA       GLN  43   7.210 -10.741 -10.741
  322   1HB   GLN  43           HB2      GLN  43   7.750 -13.605 -13.605
  323   2HB   GLN  43           HB1      GLN  43   8.921 -12.305 -12.305
  324   1HG   GLN  43           HG2      GLN  43   8.930 -11.842 -11.842
  325   2HG   GLN  43           HG1      GLN  43   7.680 -13.059 -13.059
  326   1HE2  GLN  43          HE22      GLN  43   9.986 -15.712 -15.712
  327   2HE2  GLN  43          HE21      GLN  43   8.400 -15.169 -15.169
  328    H    VAL  44           HN       VAL  44   7.988  -9.835  -9.835
  329    HA   VAL  44           HA       VAL  44   6.524 -10.682 -10.682
  330    HB   VAL  44           HB       VAL  44   6.878  -7.864  -7.864
  331   1HG1  VAL  44          HG13      VAL  44   6.877  -8.128  -8.128
  332   2HG1  VAL  44          HG12      VAL  44   5.256  -8.812  -8.812
  333   3HG1  VAL  44          HG11      VAL  44   5.555  -7.145  -7.145
  334   1HG2  VAL  44          HG23      VAL  44   5.201  -9.263  -9.263
  335   2HG2  VAL  44          HG22      VAL  44   4.467  -7.905  -7.905
  336   3HG2  VAL  44          HG21      VAL  44   4.356  -9.530  -9.530
  337    H    THR  45           HN       THR  45   7.820 -10.581 -10.581
  338    HA   THR  45           HA       THR  45  10.553  -9.362  -9.362
  339    HB   THR  45           HB       THR  45  11.397 -11.288 -11.288
  340    HG1  THR  45           HG1      THR  45   9.932 -12.122 -12.122
  341   1HG2  THR  45          HG21      THR  45  11.146 -11.440 -11.440
  342   2HG2  THR  45          HG23      THR  45   9.594 -12.240 -12.240
  343   3HG2  THR  45          HG22      THR  45  11.081 -13.004 -13.004
  344    H    GLU  46           HN       GLU  46  11.547  -8.688  -8.688
  345    HA   GLU  46           HA       GLU  46   9.588  -7.510  -7.510
  346   1HB   GLU  46           HB2      GLU  46  12.586  -7.372  -7.372
  347   2HB   GLU  46           HB1      GLU  46  11.755  -6.527  -6.527
  348   1HG   GLU  46           HG2      GLU  46  10.477  -5.210  -5.210
  349   2HG   GLU  46           HG1      GLU  46  10.978  -6.206  -6.206
  350    H    VAL  47           HN       VAL  47   9.817  -7.758  -7.758
  351    HA   VAL  47           HA       VAL  47  10.928 -10.432 -10.432
  352    HB   VAL  47           HB       VAL  47   8.430  -8.966  -8.966
  353   1HG1  VAL  47          HG11      VAL  47   9.787 -11.455 -11.455
  354   2HG1  VAL  47          HG13      VAL  47   8.025 -11.371 -11.371
  355   3HG1  VAL  47          HG12      VAL  47   8.976 -10.202 -10.202
  356   1HG2  VAL  47          HG21      VAL  47   8.877 -11.387 -11.387
  357   2HG2  VAL  47          HG23      VAL  47   8.097  -9.871  -9.871
  358   3HG2  VAL  47          HG22      VAL  47   7.313 -10.961 -10.961
  359    H    CYS  48           HN       CYS  48   9.574  -7.634  -7.634
  360    HA   CYS  48           HA       CYS  48  12.214  -7.158  -7.158
  361   1HB   CYS  48           HB2      CYS  48   9.637  -7.928  -7.928
  362   2HB   CYS  48           HB1      CYS  48  11.092  -7.371  -7.371
  363    H    ALA  49           HN       ALA  49  12.328  -5.053  -5.053
  364    HA   ALA  49           HA       ALA  49   9.968  -3.264  -3.264
  365   1HB   ALA  49           HB2      ALA  49  12.335  -3.405  -3.405
  366   2HB   ALA  49           HB1      ALA  49  12.016  -1.780  -1.780
  367   3HB   ALA  49           HB3      ALA  49  10.773  -2.641  -2.641
  368    H    ALA  50           HN       ALA  50  10.100  -1.408  -1.408
  369    HA   ALA  50           HA       ALA  50  12.514  -0.596  -0.596
  370   1HB   ALA  50           HB2      ALA  50  11.583  -2.870  -2.870
  371   2HB   ALA  50           HB1      ALA  50  10.409  -1.810  -1.810
  372   3HB   ALA  50           HB3      ALA  50  12.132  -1.599  -1.599
  373    H    THR  51           HN       THR  51  12.063   1.332   1.332
  374    HA   THR  51           HA       THR  51   9.328   2.483   2.483
  375    HB   THR  51           HB       THR  51  11.821   4.096   4.096
  376    HG1  THR  51           HG1      THR  51  10.964   3.225   3.225
  377   1HG2  THR  51          HG21      THR  51   9.224   4.796   4.796
  378   2HG2  THR  51          HG23      THR  51   9.784   4.899   4.899
  379   3HG2  THR  51          HG22      THR  51  10.574   5.852   5.852
  380    H    TYR  52           HN       TYR  52   8.149   2.685   2.685
  381    HA   TYR  52           HA       TYR  52   9.675   2.631   2.631
  382   1HB   TYR  52           HB2      TYR  52   7.477   2.243   2.243
  383   2HB   TYR  52           HB1      TYR  52   7.777   1.090   1.090
  384    HD1  TYR  52           HD1      TYR  52   5.794   4.001   4.001
  385    HD2  TYR  52           HD2      TYR  52   6.494   1.188   1.188
  386    HE1  TYR  52           HE1      TYR  52   3.608   4.636   4.636
  387    HE2  TYR  52           HE2      TYR  52   4.314   1.832   1.832
  388    HH   TYR  52           HH       TYR  52   1.955   2.967   2.967
  389    H    MET  53           HN       MET  53  10.126   4.454   4.454
  390    HA   MET  53           HA       MET  53   9.459   7.047   7.047
  391   1HB   MET  53           HB2      MET  53  10.280   6.090   6.090
  392   2HB   MET  53           HB1      MET  53  10.405   7.752   7.752
  393   1HG   MET  53           HG2      MET  53  11.647   5.724   5.724
  394   2HG   MET  53           HG1      MET  53  12.424   5.928   5.928
  395   1HE   MET  53           HE1      MET  53  11.548   7.151   7.151
  396   2HE   MET  53           HE3      MET  53  12.111   8.831   8.831
  397   3HE   MET  53           HE2      MET  53  10.622   8.472   8.472
  398    H    MET  54           HN       MET  54   8.121   5.103   5.103
  399    HA   MET  54           HA       MET  54   5.413   5.689   5.689
  400   1HB   MET  54           HB2      MET  54   6.963   7.958   7.958
  401   2HB   MET  54           HB1      MET  54   5.691   7.470   7.470
  402   1HG   MET  54           HG2      MET  54   5.463   8.704   8.704
  403   2HG   MET  54           HG1      MET  54   4.344   8.750   8.750
  404   1HE   MET  54           HE2      MET  54   5.320   7.691   7.691
  405   2HE   MET  54           HE1      MET  54   4.148   6.520   6.520
  406   3HE   MET  54           HE3      MET  54   5.596   5.966   5.966
  407    H    GLY  55           HN       GLY  55   5.084   3.690   3.690
  408   1HA   GLY  55           HA2      GLY  55   4.726   2.204   2.204
  409   2HA   GLY  55           HA1      GLY  55   5.205   3.498   3.498
  410    H    ASN  56           HN       ASN  56   7.221   2.362   2.362
  411    HA   ASN  56           HA       ASN  56   9.148   1.263   1.263
  412   1HB   ASN  56           HB2      ASN  56   9.533   2.811   2.811
  413   2HB   ASN  56           HB1      ASN  56  10.861   2.019   2.019
  414   1HD2  ASN  56          HD22      ASN  56  10.847   5.465   5.465
  415   2HD2  ASN  56          HD21      ASN  56  11.247   4.669   4.669
  416    H    GLU  57           HN       GLU  57  10.516  -0.505  -0.505
  417    HA   GLU  57           HA       GLU  57   9.036  -2.506  -2.506
  418   1HB   GLU  57           HB2      GLU  57  11.892  -2.264  -2.264
  419   2HB   GLU  57           HB1      GLU  57  11.259  -3.727  -3.727
  420   1HG   GLU  57           HG2      GLU  57  10.791  -4.236  -4.236
  421   2HG   GLU  57           HG1      GLU  57   9.318  -3.351  -3.351
  422    H    LEU  58           HN       LEU  58   9.543  -3.375  -3.375
  423    HA   LEU  58           HA       LEU  58  10.660  -1.415  -1.415
  424   1HB   LEU  58           HB2      LEU  58   9.298  -4.117  -4.117
  425   2HB   LEU  58           HB1      LEU  58   9.720  -3.086  -3.086
  426    HG   LEU  58           HG       LEU  58   7.952  -2.192  -2.192
  427   1HD1  LEU  58          HD13      LEU  58   7.199  -3.196  -3.196
  428   2HD1  LEU  58          HD12      LEU  58   6.080  -2.497  -2.497
  429   3HD1  LEU  58          HD11      LEU  58   6.879  -4.029  -4.029
  430   1HD2  LEU  58          HD22      LEU  58   8.592  -1.052  -1.052
  431   2HD2  LEU  58          HD21      LEU  58   9.040  -0.360  -0.360
  432   3HD2  LEU  58          HD23      LEU  58   7.346  -0.417  -0.417
  433    H    THR  59           HN       THR  59  12.785  -1.553  -1.553
  434    HA   THR  59           HA       THR  59  14.357  -3.978  -3.978
  435    HB   THR  59           HB       THR  59  16.179  -2.400  -2.400
  436    HG1  THR  59           HG1      THR  59  15.148  -1.142  -1.142
  437   1HG2  THR  59          HG22      THR  59  15.164  -2.519  -2.519
  438   2HG2  THR  59          HG21      THR  59  14.265  -1.065  -1.065
  439   3HG2  THR  59          HG23      THR  59  16.028  -1.032  -1.032
  440    H    PHE  60           HN       PHE  60  14.910  -5.422  -5.422
  441    HA   PHE  60           HA       PHE  60  14.272  -4.651  -4.651
  442   1HB   PHE  60           HB2      PHE  60  14.350  -7.328  -7.328
  443   2HB   PHE  60           HB1      PHE  60  13.968  -7.117  -7.117
  444    HD1  PHE  60           HD1      PHE  60  12.079  -5.239  -5.239
  445    HD2  PHE  60           HD2      PHE  60  12.558  -7.432  -7.432
  446    HE1  PHE  60           HE1      PHE  60   9.691  -4.770  -4.770
  447    HE2  PHE  60           HE2      PHE  60  10.175  -6.959  -6.959
  448    HZ   PHE  60           HZ       PHE  60   8.742  -5.630  -5.630
  449    H    LEU  61           HN       LEU  61  16.045  -4.417  -4.417
  450    HA   LEU  61           HA       LEU  61  18.741  -4.904  -4.904
  451   1HB   LEU  61           HB2      LEU  61  17.385  -4.587  -4.587
  452   2HB   LEU  61           HB1      LEU  61  19.137  -4.622  -4.622
  453    HG   LEU  61           HG       LEU  61  17.293  -2.670  -2.670
  454   1HD1  LEU  61          HD12      LEU  61  19.131  -2.288  -2.288
  455   2HD1  LEU  61          HD11      LEU  61  18.245  -1.004  -1.004
  456   3HD1  LEU  61          HD13      LEU  61  17.368  -2.264  -2.264
  457   1HD2  LEU  61          HD23      LEU  61  20.297  -3.019  -3.019
  458   2HD2  LEU  61          HD22      LEU  61  19.277  -2.983  -2.983
  459   3HD2  LEU  61          HD21      LEU  61  19.545  -1.507  -1.507
  460    H    ASP  62           HN       ASP  62  16.422  -6.879  -6.879
  461    HA   ASP  62           HA       ASP  62  18.202  -9.247  -9.247
  462   1HB   ASP  62           HB2      ASP  62  17.768  -9.857  -9.857
  463   2HB   ASP  62           HB1      ASP  62  18.558  -8.285  -8.285
  464    H    ASP  63           HN       ASP  63  16.824 -11.303 -11.303
  465    HA   ASP  63           HA       ASP  63  14.959 -12.647 -12.647
  466   1HB   ASP  63           HB2      ASP  63  13.700 -10.081 -10.081
  467   2HB   ASP  63           HB1      ASP  63  12.781 -11.554 -11.554
  468    H    SER  64           HN       SER  64  16.082 -11.584 -11.584
  469    HA   SER  64           HA       SER  64  14.610  -9.917  -9.917
  470   1HB   SER  64           HB2      SER  64  16.221 -12.421 -12.421
  471   2HB   SER  64           HB1      SER  64  15.752 -11.246 -11.246
  472    HG   SER  64           HG       SER  64  17.820 -11.171 -11.171
  473    H    ILE  67           HN       ILE  67  13.812 -13.160 -13.160
  474    HA   ILE  67           HA       ILE  67  12.178 -14.100 -14.100
  475    HB   ILE  67           HB       ILE  67  11.926 -14.366 -14.366
  476   1HG1  ILE  67          HG12      ILE  67  13.174 -16.154 -16.154
  477   2HG1  ILE  67          HG11      ILE  67  14.081 -15.084 -15.084
  478   1HG2  ILE  67          HG21      ILE  67  10.603 -15.867 -15.867
  479   2HG2  ILE  67          HG23      ILE  67  10.749 -16.542 -16.542
  480   3HG2  ILE  67          HG22      ILE  67   9.819 -15.067 -15.067
  481   1HD1  ILE  67          HD13      ILE  67  12.880 -16.300 -16.300
  482   2HD1  ILE  67          HD12      ILE  67  12.473 -17.518 -17.518
  483   3HD1  ILE  67          HD11      ILE  67  14.162 -17.172 -17.172
  484    H    CYS  68           HN       CYS  68  11.585 -11.450 -11.450
  485    HA   CYS  68           HA       CYS  68   8.692 -11.393 -11.393
  486   1HB   CYS  68           HB2      CYS  68  10.730  -9.245  -9.245
  487   2HB   CYS  68           HB1      CYS  68   8.993  -9.126  -9.126
  488    H    THR  69           HN       THR  69   7.554 -10.719 -10.719
  489    HA   THR  69           HA       THR  69   8.757  -8.705  -8.705
  490    HB   THR  69           HB       THR  69   9.205 -10.970 -10.970
  491    HG1  THR  69           HG1      THR  69   7.125  -9.595  -9.595
  492   1HG2  THR  69          HG22      THR  69   6.220 -11.288 -11.288
  493   2HG2  THR  69          HG21      THR  69   7.160 -12.329 -12.329
  494   3HG2  THR  69          HG23      THR  69   7.506 -12.298 -12.298
  495    H    GLY  70           HN       GLY  70   7.138  -7.408  -7.408
  496   1HA   GLY  70           HA2      GLY  70   4.344  -7.955  -7.955
  497   2HA   GLY  70           HA1      GLY  70   4.729  -6.970  -6.970
  498    H    THR  71           HN       THR  71   3.186  -5.549  -5.549
  499    HA   THR  71           HA       THR  71   4.766  -3.771  -3.771
  500    HB   THR  71           HB       THR  71   1.887  -4.618  -4.618
  501    HG1  THR  71           HG1      THR  71   4.095  -5.170  -5.170
  502   1HG2  THR  71          HG23      THR  71   3.515  -2.627  -2.627
  503   2HG2  THR  71          HG22      THR  71   2.180  -3.467  -3.467
  504   3HG2  THR  71          HG21      THR  71   1.876  -2.474  -2.474
  505    H    SER  72           HN       SER  72   3.740  -1.525  -1.525
  506    HA   SER  72           HA       SER  72   2.317  -0.831  -0.831
  507   1HB   SER  72           HB2      SER  72   3.947   0.982   0.982
  508   2HB   SER  72           HB1      SER  72   4.784  -0.564  -0.564
  509    HG   SER  72           HG       SER  72   5.870   0.446   0.446
  510    H    SER  73           HN       SER  73   1.066   1.121   1.121
  511    HA   SER  73           HA       SER  73   0.832   2.300   2.300
  512   1HB   SER  73           HB2      SER  73  -0.901   0.536   0.536
  513   2HB   SER  73           HB1      SER  73  -1.452   1.578   1.578
  514    HG   SER  73           HG       SER  73  -2.120   1.678   1.678
  515    H    GLY  74           HN       GLY  74  -0.939   4.269   4.269
  516   1HA   GLY  74           HA2      GLY  74   0.459   6.244   6.244
  517   2HA   GLY  74           HA1      GLY  74  -1.199   6.414   6.414
  518    H    ASN  75           HN       ASN  75  -2.547   4.486   4.486
  519    HA   ASN  75           HA       ASN  75  -2.000   5.156   5.156
  520   1HB   ASN  75           HB2      ASN  75  -4.612   5.013   5.013
  521   2HB   ASN  75           HB1      ASN  75  -4.497   5.249   5.249
  522   1HD2  ASN  75          HD22      ASN  75  -4.264   8.466   8.466
  523   2HD2  ASN  75          HD21      ASN  75  -4.974   6.993   6.993
  524    H    GLN  76           HN       GLN  76  -2.030   2.628   2.628
  525    HA   GLN  76           HA       GLN  76  -3.061   0.695   0.695
  526   1HB   GLN  76           HB2      GLN  76  -4.462   1.016   1.016
  527   2HB   GLN  76           HB1      GLN  76  -3.080   0.608   0.608
  528   1HG   GLN  76           HG2      GLN  76  -2.958  -1.588  -1.588
  529   2HG   GLN  76           HG1      GLN  76  -4.264  -1.203  -1.203
  530   1HE2  GLN  76          HE22      GLN  76  -5.254  -1.580  -1.580
  531   2HE2  GLN  76          HE21      GLN  76  -3.734  -0.948  -0.948
  532    H    VAL  77           HN       VAL  77  -1.493  -0.793  -0.793
  533    HA   VAL  77           HA       VAL  77   0.956  -1.062  -1.062
  534    HB   VAL  77           HB       VAL  77   2.136  -1.370  -1.370
  535   1HG1  VAL  77          HG11      VAL  77   0.731   0.953   0.953
  536   2HG1  VAL  77          HG13      VAL  77   0.411   0.627   0.627
  537   3HG1  VAL  77          HG12      VAL  77   2.073   0.774   0.774
  538   1HG2  VAL  77          HG21      VAL  77  -0.472  -2.164  -2.164
  539   2HG2  VAL  77          HG23      VAL  77   1.142  -2.720  -2.720
  540   3HG2  VAL  77          HG22      VAL  77   0.511  -1.208  -1.208
  541    H    ASN  78           HN       ASN  78   1.430  -3.098  -3.098
  542    HA   ASN  78           HA       ASN  78  -0.307  -5.362  -5.362
  543   1HB   ASN  78           HB2      ASN  78  -0.404  -4.530  -4.530
  544   2HB   ASN  78           HB1      ASN  78   1.291  -4.973  -4.973
  545    HD2  ASN  78          HD22      ASN  78  -1.086  -6.345  -6.345
  546    H    LEU  79           HN       LEU  79   0.756  -6.728  -6.728
  547    HA   LEU  79           HA       LEU  79   3.704  -7.169  -7.169
  548   1HB   LEU  79           HB2      LEU  79   1.832  -7.391  -7.391
  549   2HB   LEU  79           HB1      LEU  79   3.500  -7.956  -7.956
  550    HG   LEU  79           HG       LEU  79   2.687  -5.111  -5.111
  551   1HD1  LEU  79          HD12      LEU  79   3.224  -6.493  -6.493
  552   2HD1  LEU  79          HD11      LEU  79   3.991  -4.920  -4.920
  553   3HD1  LEU  79          HD13      LEU  79   2.238  -5.071  -5.071
  554   1HD2  LEU  79          HD23      LEU  79   5.324  -6.544  -6.544
  555   2HD2  LEU  79          HD22      LEU  79   4.814  -5.587  -5.587
  556   3HD2  LEU  79          HD21      LEU  79   5.184  -4.790  -4.790
  557    H    THR  80           HN       THR  80   4.344  -9.248  -9.248
  558    HA   THR  80           HA       THR  80   2.336 -11.461 -11.461
  559    HB   THR  80           HB       THR  80   4.185 -10.817 -10.817
  560    HG1  THR  80           HG1      THR  80   2.562  -9.654  -9.654
  561   1HG2  THR  80          HG22      THR  80   2.588 -13.199 -13.199
  562   2HG2  THR  80          HG21      THR  80   2.406 -12.649 -12.649
  563   3HG2  THR  80          HG23      THR  80   4.003 -13.068 -13.068
  564    H    ILE  81           HN       ILE  81   3.205 -13.477 -13.477
  565    HA   ILE  81           HA       ILE  81   6.150 -13.572 -13.572
  566    HB   ILE  81           HB       ILE  81   3.749 -14.837 -14.837
  567   1HG1  ILE  81          HG12      ILE  81   5.729 -12.829 -12.829
  568   2HG1  ILE  81          HG11      ILE  81   4.198 -12.357 -12.357
  569   1HG2  ILE  81          HG22      ILE  81   6.709 -15.032 -15.032
  570   2HG2  ILE  81          HG21      ILE  81   5.408 -15.634 -15.634
  571   3HG2  ILE  81          HG23      ILE  81   5.679 -16.353 -16.353
  572   1HD1  ILE  81          HD11      ILE  81   3.136 -14.075 -14.075
  573   2HD1  ILE  81          HD13      ILE  81   4.660 -13.926 -13.926
  574   3HD1  ILE  81          HD12      ILE  81   3.644 -12.506 -12.506
  575    H    GLN  82           HN       GLN  82   7.247 -15.409 -15.409
  576    HA   GLN  82           HA       GLN  82   5.567 -17.533 -17.533
  577   1HB   GLN  82           HB2      GLN  82   8.184 -16.289 -16.289
  578   2HB   GLN  82           HB1      GLN  82   7.529 -17.779 -17.779
  579   1HG   GLN  82           HG2      GLN  82   5.795 -16.709 -16.709
  580   2HG   GLN  82           HG1      GLN  82   5.738 -15.390 -15.390
  581   1HE2  GLN  82          HE22      GLN  82   8.739 -13.851 -13.851
  582   2HE2  GLN  82          HE21      GLN  82   8.300 -14.374 -14.374
  583    H    GLY  83           HN       GLY  83   5.851 -19.417 -19.417
  584   1HA   GLY  83           HA2      GLY  83   7.363 -21.279 -21.279
  585   2HA   GLY  83           HA1      GLY  83   8.527 -20.080 -20.080
  586    H    LEU  84           HN       LEU  84   5.030 -20.393 -20.393
  587    HA   LEU  84           HA       LEU  84   5.548 -20.003 -20.003
  588   1HB   LEU  84           HB2      LEU  84   3.095 -20.195 -20.195
  589   2HB   LEU  84           HB1      LEU  84   3.005 -19.968 -19.968
  590    HG   LEU  84           HG       LEU  84   4.619 -18.152 -18.152
  591   1HD1  LEU  84          HD13      LEU  84   2.195 -18.124 -18.124
  592   2HD1  LEU  84          HD12      LEU  84   1.812 -17.721 -17.721
  593   3HD1  LEU  84          HD11      LEU  84   2.743 -16.595 -16.595
  594   1HD2  LEU  84          HD23      LEU  84   3.898 -18.303 -18.303
  595   2HD2  LEU  84          HD22      LEU  84   5.371 -17.701 -17.701
  596   3HD2  LEU  84          HD21      LEU  84   3.921 -16.697 -16.697
  597    H    ARG  85           HN       ARG  85   5.789 -21.705 -21.705
  598    HA   ARG  85           HA       ARG  85   4.795 -24.399 -24.399
  599   1HB   ARG  85           HB2      ARG  85   6.767 -23.424 -23.424
  600   2HB   ARG  85           HB1      ARG  85   6.392 -25.120 -25.120
  601   1HG   ARG  85           HG2      ARG  85   7.152 -23.492 -23.492
  602   2HG   ARG  85           HG1      ARG  85   8.439 -23.837 -23.837
  603   1HD   ARG  85           HD2      ARG  85   7.872 -26.268 -26.268
  604   2HD   ARG  85           HD1      ARG  85   6.667 -25.885 -25.885
  605    HE   ARG  85           HE       ARG  85   9.209 -24.694 -24.694
  606   1HH1  ARG  85          HH21      ARG  85   7.516 -27.756 -27.756
  607   2HH1  ARG  85          HH22      ARG  85   8.462 -28.411 -28.411
  608   1HH2  ARG  85          HH11      ARG  85  10.406 -25.582 -25.582
  609   2HH2  ARG  85          HH12      ARG  85  10.081 -27.196 -27.196
  610    H    ALA  86           HN       ALA  86   4.144 -25.692 -25.692
  611    HA   ALA  86           HA       ALA  86   1.759 -24.538 -24.538
  612   1HB   ALA  86           HB1      ALA  86   2.455 -26.975 -26.975
  613   2HB   ALA  86           HB3      ALA  86   3.525 -26.673 -26.673
  614   3HB   ALA  86           HB2      ALA  86   1.780 -26.497 -26.497
  615    H    MET  87           HN       MET  87   5.041 -24.808 -24.808
  616    HA   MET  87           HA       MET  87   4.535 -23.597 -23.597
  617   1HB   MET  87           HB2      MET  87   6.524 -24.942 -24.942
  618   2HB   MET  87           HB1      MET  87   7.043 -23.618 -23.618
  619   1HG   MET  87           HG2      MET  87   7.106 -22.119 -22.119
  620   2HG   MET  87           HG1      MET  87   6.694 -23.499 -23.499
  621   1HE   MET  87           HE1      MET  87   7.909 -25.403 -25.403
  622   2HE   MET  87           HE3      MET  87   8.380 -25.980 -25.980
  623   3HE   MET  87           HE2      MET  87   9.597 -25.763 -25.763
  624    H    ASP  88           HN       ASP  88   5.519 -22.218 -22.218
  625    HA   ASP  88           HA       ASP  88   6.039 -19.549 -19.549
  626   1HB   ASP  88           HB2      ASP  88   4.973 -20.676 -20.676
  627   2HB   ASP  88           HB1      ASP  88   5.615 -19.046 -19.046
  628    H    THR  89           HN       THR  89   2.993 -21.217 -21.217
  629    HA   THR  89           HA       THR  89   1.174 -19.201 -19.201
  630    HB   THR  89           HB       THR  89   0.929 -21.400 -21.400
  631    HG1  THR  89           HG1      THR  89   0.555 -21.333 -21.333
  632   1HG2  THR  89          HG21      THR  89  -0.880 -19.581 -19.581
  633   2HG2  THR  89          HG23      THR  89  -1.245 -20.280 -20.280
  634   3HG2  THR  89          HG22      THR  89  -1.406 -21.260 -21.260
  635    H    GLY  90           HN       GLY  90   0.290 -17.522 -17.522
  636   1HA   GLY  90           HA2      GLY  90   0.146 -17.174 -17.174
  637   2HA   GLY  90           HA1      GLY  90   1.755 -16.601 -16.601
  638    H    LEU  91           HN       LEU  91   1.012 -14.462 -14.462
  639    HA   LEU  91           HA       LEU  91  -0.928 -13.154 -13.154
  640   1HB   LEU  91           HB2      LEU  91  -1.335 -13.209 -13.209
  641   2HB   LEU  91           HB1      LEU  91   0.182 -12.344 -12.344
  642    HG   LEU  91           HG       LEU  91  -0.774 -10.579 -10.579
  643   1HD1  LEU  91          HD12      LEU  91  -2.725 -12.398 -12.398
  644   2HD1  LEU  91          HD11      LEU  91  -3.468 -11.475 -11.475
  645   3HD1  LEU  91          HD13      LEU  91  -2.980 -10.658 -10.658
  646   1HD2  LEU  91          HD21      LEU  91  -0.661 -10.675 -10.675
  647   2HD2  LEU  91          HD23      LEU  91  -1.506  -9.365  -9.365
  648   3HD2  LEU  91          HD22      LEU  91  -2.418 -10.721 -10.721
  649    H    TYR  92           HN       TYR  92  -0.104 -11.832 -11.832
  650    HA   TYR  92           HA       TYR  92   2.637 -10.703 -10.703
  651   1HB   TYR  92           HB2      TYR  92   0.818 -11.297 -11.297
  652   2HB   TYR  92           HB1      TYR  92   2.239 -10.267 -10.267
  653    HD1  TYR  92           HD1      TYR  92   1.114 -13.681 -13.681
  654    HD2  TYR  92           HD2      TYR  92   4.442 -11.175 -11.175
  655    HE1  TYR  92           HE1      TYR  92   2.586 -15.699 -15.699
  656    HE2  TYR  92           HE2      TYR  92   5.914 -13.189 -13.189
  657    HH   TYR  92           HH       TYR  92   5.484 -15.765 -15.765
  658    H    ILE  93           HN       ILE  93   2.905  -8.464  -8.464
  659    HA   ILE  93           HA       ILE  93   0.405  -6.821  -6.821
  660    HB   ILE  93           HB       ILE  93   3.199  -6.544  -6.544
  661   1HG1  ILE  93          HG12      ILE  93   1.755  -6.621  -6.621
  662   2HG1  ILE  93          HG11      ILE  93   0.544  -7.362  -7.362
  663   1HG2  ILE  93          HG21      ILE  93   1.257  -4.490  -4.490
  664   2HG2  ILE  93          HG23      ILE  93   1.355  -4.759  -4.759
  665   3HG2  ILE  93          HG22      ILE  93   2.807  -4.358  -4.358
  666   1HD1  ILE  93          HD11      ILE  93   3.369  -8.392  -8.392
  667   2HD1  ILE  93          HD13      ILE  93   2.193  -8.922  -8.922
  668   3HD1  ILE  93          HD12      ILE  93   1.905  -9.231  -9.231
  669    H    CYS  94           HN       CYS  94   0.127  -5.198  -5.198
  670    HA   CYS  94           HA       CYS  94   2.321  -4.642  -4.642
  671   1HB   CYS  94           HB2      CYS  94   0.652  -3.278  -3.278
  672   2HB   CYS  94           HB1      CYS  94  -0.158  -4.750  -4.750
  673    H    LYS  95           HN       LYS  95   3.230  -2.351  -2.351
  674    HA   LYS  95           HA       LYS  95   2.806  -0.737  -0.737
  675   1HB   LYS  95           HB2      LYS  95   4.432  -2.542  -2.542
  676   2HB   LYS  95           HB1      LYS  95   5.418  -2.002  -2.002
  677   1HG   LYS  95           HG2      LYS  95   6.407  -0.450  -0.450
  678   2HG   LYS  95           HG1      LYS  95   4.839   0.264   0.264
  679   1HD   LYS  95           HD2      LYS  95   4.486  -1.443  -1.443
  680   2HD   LYS  95           HD1      LYS  95   6.121  -2.041  -2.041
  681   1HE   LYS  95           HE2      LYS  95   7.028   0.217   0.217
  682   2HE   LYS  95           HE1      LYS  95   5.383   0.749   0.749
  683   1HZ   LYS  95           HZ3      LYS  95   6.749  -1.601  -1.601
  684   2HZ   LYS  95           HZ2      LYS  95   6.584  -0.088  -0.088
  685   3HZ   LYS  95           HZ1      LYS  95   5.208  -1.020  -1.020
  686    H    VAL  96           HN       VAL  96   2.217   1.020   1.020
  687    HA   VAL  96           HA       VAL  96   4.285   1.867   1.867
  688    HB   VAL  96           HB       VAL  96   2.174   1.269   1.269
  689   1HG1  VAL  96          HG11      VAL  96   0.998   3.018   3.018
  690   2HG1  VAL  96          HG13      VAL  96   0.099   2.606   2.606
  691   3HG1  VAL  96          HG12      VAL  96   0.652   1.326   1.326
  692   1HG2  VAL  96          HG23      VAL  96   3.134   4.018   4.018
  693   2HG2  VAL  96          HG22      VAL  96   2.576   2.987   2.987
  694   3HG2  VAL  96          HG21      VAL  96   1.413   3.916   3.916
  695    H    GLU  97           HN       GLU  97   5.550   3.464   3.464
  696    HA   GLU  97           HA       GLU  97   4.385   5.669   5.669
  697   1HB   GLU  97           HB2      GLU  97   7.087   4.314   4.314
  698   2HB   GLU  97           HB1      GLU  97   6.488   5.594   5.594
  699   1HG   GLU  97           HG2      GLU  97   5.766   3.892   3.892
  700   2HG   GLU  97           HG1      GLU  97   4.462   3.715   3.715
  701    H    LEU  98           HN       LEU  98   4.758   7.639   7.639
  702    HA   LEU  98           HA       LEU  98   6.773   7.924   7.924
  703   1HB   LEU  98           HB2      LEU  98   4.843   9.666   9.666
  704   2HB   LEU  98           HB1      LEU  98   5.995  10.395  10.395
  705    HG   LEU  98           HG       LEU  98   3.779   9.984   9.984
  706   1HD1  LEU  98          HD11      LEU  98   6.083   9.820   9.820
  707   2HD1  LEU  98          HD13      LEU  98   5.712   8.097   8.097
  708   3HD1  LEU  98          HD12      LEU  98   4.638   9.275   9.275
  709   1HD2  LEU  98          HD21      LEU  98   3.397   7.835   7.835
  710   2HD2  LEU  98          HD23      LEU  98   2.879   7.833   7.833
  711   3HD2  LEU  98          HD22      LEU  98   4.386   7.040   7.040
  712    H    MET  99           HN       MET  99   8.511   7.060   7.060
  713    HA   MET  99           HA       MET  99   9.133   8.465   8.465
  714   1HB   MET  99           HB2      MET  99   9.463   6.020   6.020
  715   2HB   MET  99           HB1      MET  99  10.918   6.586   6.586
  716   1HG   MET  99           HG2      MET  99  12.048   6.852   6.852
  717   2HG   MET  99           HG1      MET  99  10.665   7.601   7.601
  718   1HE   MET  99           HE1      MET  99   8.531   6.286   6.286
  719   2HE   MET  99           HE3      MET  99   8.347   4.545   4.545
  720   3HE   MET  99           HE2      MET  99   8.595   5.611   5.611
  721    H    TYR 100           HN       TYR 100  10.642   8.439   8.439
  722    HA   TYR 100           HA       TYR 100  12.958   9.942   9.942
  723   1HB   TYR 100           HB2      TYR 100  11.449   9.540   9.540
  724   2HB   TYR 100           HB1      TYR 100  12.975  10.414  10.414
  725    HD1  TYR 100           HD2      TYR 100  15.085   9.258   9.258
  726    HD2  TYR 100           HD1      TYR 100  11.324   7.117   7.117
  727    HE1  TYR 100           HE2      TYR 100  16.327   7.086   7.086
  728    HE2  TYR 100           HE1      TYR 100  12.563   4.946   4.946
  729    HH   TYR 100           HH       TYR 100  15.465   4.470   4.470
  730    HA   PRO 101           HA       PRO 101  10.667  13.922  13.922
  731   1HB   PRO 101           HB2      PRO 101   7.984  13.936  13.936
  732   2HB   PRO 101           HB1      PRO 101   9.113  13.566  13.566
  733   1HG   PRO 101           HG2      PRO 101   7.426  11.745  11.745
  734   2HG   PRO 101           HG1      PRO 101   7.929  11.624  11.624
  735   1HD   PRO 101           HD2      PRO 101   9.049  10.226  10.226
  736   2HD   PRO 101           HD1      PRO 101   9.794  10.453  10.453
  737    HA   PRO 102           HA       PRO 102   9.190  14.282  14.282
  738   1HB   PRO 102           HB2      PRO 102  10.143  16.892  16.892
  739   2HB   PRO 102           HB1      PRO 102  11.237  15.484  15.484
  740   1HG   PRO 102           HG2      PRO 102  10.714  17.577  17.577
  741   2HG   PRO 102           HG1      PRO 102  12.219  16.730  16.730
  742   1HD   PRO 102           HD2      PRO 102  10.515  16.172  16.172
  743   2HD   PRO 102           HD1      PRO 102  11.843  15.143  15.143
  744    HA   PRO 103           HA       PRO 103   8.656  15.464  15.464
  745   1HB   PRO 103           HB2      PRO 103   8.006  15.266  15.266
  746   2HB   PRO 103           HB1      PRO 103   8.799  16.623  16.623
  747   1HG   PRO 103           HG2      PRO 103   6.125  17.151  17.151
  748   2HG   PRO 103           HG1      PRO 103   7.072  17.924  17.924
  749   1HD   PRO 103           HD2      PRO 103   5.587  15.297  15.297
  750   2HD   PRO 103           HD1      PRO 103   4.919  16.850  16.850
  751    H    TYR 104           HN       TYR 104   7.010  13.509  13.509
  752    HA   TYR 104           HA       TYR 104   6.346  11.304  11.304
  753   1HB   TYR 104           HB2      TYR 104   8.227  10.651  10.651
  754   2HB   TYR 104           HB1      TYR 104   7.475  11.277  11.277
  755    HD1  TYR 104           HD1      TYR 104   5.675   9.363   9.363
  756    HD2  TYR 104           HD2      TYR 104   7.565   9.319   9.319
  757    HE1  TYR 104           HE1      TYR 104   4.686   7.094   7.094
  758    HE2  TYR 104           HE2      TYR 104   6.607   7.093   7.093
  759    HH   TYR 104           HH       TYR 104   5.640   5.244   5.244
  760    H    TYR 105           HN       TYR 105   4.215  10.701  10.701
  761    HA   TYR 105           HA       TYR 105   2.554  10.877  10.877
  762   1HB   TYR 105           HB2      TYR 105   0.792  12.232  12.232
  763   2HB   TYR 105           HB1      TYR 105   1.987  13.100  13.100
  764    HD1  TYR 105           HD1      TYR 105   4.018  14.001  14.001
  765    HD2  TYR 105           HD2      TYR 105   0.797  12.216  12.216
  766    HE1  TYR 105           HE1      TYR 105   4.921  15.033  15.033
  767    HE2  TYR 105           HE2      TYR 105   1.671  13.235  13.235
  768    HH   TYR 105           HH       TYR 105   4.458  14.179  14.179
  769    H    LEU 106           HN       LEU 106   1.990   8.680   8.680
  770    HA   LEU 106           HA       LEU 106   0.022   8.113   8.113
  771   1HB   LEU 106           HB2      LEU 106   2.683   7.758   7.758
  772   2HB   LEU 106           HB1      LEU 106   2.211   6.136   6.136
  773    HG   LEU 106           HG       LEU 106   0.130   6.475   6.475
  774   1HD1  LEU 106          HD12      LEU 106   1.862   8.827   8.827
  775   2HD1  LEU 106          HD11      LEU 106   0.857   8.096   8.096
  776   3HD1  LEU 106          HD13      LEU 106   0.116   8.755   8.755
  777   1HD2  LEU 106          HD21      LEU 106   2.941   5.961   5.961
  778   2HD2  LEU 106          HD23      LEU 106   1.524   4.915   4.915
  779   3HD2  LEU 106          HD22      LEU 106   1.745   6.210   6.210
  780    H    GLY 108           HN       GLY 108   0.573   5.104   5.104
  781   1HA   GLY 108           HA2      GLY 108   0.151   4.589   4.589
  782   2HA   GLY 108           HA1      GLY 108  -1.302   4.390   4.390
  783    H    ILE 109           HN       ILE 109  -0.439   2.234   2.234
  784    HA   ILE 109           HA       ILE 109   0.879   0.509   0.509
  785    HB   ILE 109           HB       ILE 109   0.870   0.275   0.275
  786   1HG1  ILE 109          HG12      ILE 109   2.080   2.300   2.300
  787   2HG1  ILE 109          HG11      ILE 109   3.275   1.038   1.038
  788   1HG2  ILE 109          HG21      ILE 109   1.262  -1.780  -1.780
  789   2HG2  ILE 109          HG23      ILE 109   2.602  -0.993  -0.993
  790   3HG2  ILE 109          HG22      ILE 109   2.691  -1.291  -1.291
  791   1HD1  ILE 109          HD13      ILE 109   2.861   0.828   0.828
  792   2HD1  ILE 109          HD12      ILE 109   2.714   2.563   2.563
  793   3HD1  ILE 109          HD11      ILE 109   4.184   1.720   1.720
  794    H    GLY 110           HN       GLY 110  -0.109  -1.605  -1.605
  795   1HA   GLY 110           HA2      GLY 110  -2.913  -1.748  -1.748
  796   2HA   GLY 110           HA1      GLY 110  -2.184  -2.800  -2.800
  797    H    ASN 111           HN       ASN 111  -3.635  -3.446  -3.446
  798    HA   ASN 111           HA       ASN 111  -1.651  -4.475  -4.475
  799   1HB   ASN 111           HB2      ASN 111  -4.600  -5.048  -5.048
  800   2HB   ASN 111           HB1      ASN 111  -3.660  -5.645  -5.645
  801    HD2  ASN 111          HD22      ASN 111  -4.715  -3.372  -3.372
  802    H    GLY 112           HN       GLY 112  -3.027  -5.759  -5.759
  803   1HA   GLY 112           HA2      GLY 112  -1.411  -7.432  -7.432
  804   2HA   GLY 112           HA1      GLY 112  -1.496  -8.273  -8.273
  805    H    THR 113           HN       THR 113  -1.878  -9.581  -9.581
  806    HA   THR 113           HA       THR 113  -4.797 -10.301 -10.301
  807    HB   THR 113           HB       THR 113  -2.745 -10.224 -10.224
  808    HG1  THR 113           HG1      THR 113  -5.077  -8.725  -8.725
  809   1HG2  THR 113          HG22      THR 113  -5.604 -11.222 -11.222
  810   2HG2  THR 113          HG21      THR 113  -4.721 -10.866 -10.866
  811   3HG2  THR 113          HG23      THR 113  -4.152 -12.152 -12.152
  812    H    GLN 114           HN       GLN 114  -4.970 -12.482 -12.482
  813    HA   GLN 114           HA       GLN 114  -2.601 -14.106 -14.106
  814   1HB   GLN 114           HB2      GLN 114  -4.614 -14.427 -14.427
  815   2HB   GLN 114           HB1      GLN 114  -5.589 -14.701 -14.701
  816   1HG   GLN 114           HG2      GLN 114  -5.022 -16.801 -16.801
  817   2HG   GLN 114           HG1      GLN 114  -4.439 -16.783 -16.783
  818   1HE2  GLN 114          HE22      GLN 114  -1.622 -16.342 -16.342
  819   2HE2  GLN 114          HE21      GLN 114  -3.159 -15.661 -15.661
  820    H    ILE 115           HN       ILE 115  -1.745 -15.729 -15.729
  821    HA   ILE 115           HA       ILE 115  -3.002 -15.840 -15.840
  822    HB   ILE 115           HB       ILE 115  -0.088 -15.927 -15.927
  823   1HG1  ILE 115          HG12      ILE 115  -1.599 -14.100 -14.100
  824   2HG1  ILE 115          HG11      ILE 115  -1.174 -13.697 -13.697
  825   1HG2  ILE 115          HG23      ILE 115  -1.289 -16.470 -16.470
  826   2HG2  ILE 115          HG22      ILE 115   0.425 -16.172 -16.172
  827   3HG2  ILE 115          HG21      ILE 115  -0.352 -17.596 -17.596
  828   1HD1  ILE 115          HD13      ILE 115   1.253 -14.492 -14.492
  829   2HD1  ILE 115          HD12      ILE 115   0.525 -13.767 -13.767
  830   3HD1  ILE 115          HD11      ILE 115   0.706 -12.815 -12.815
  831    H    TYR 116           HN       TYR 116  -3.729 -17.889 -17.889
  832    HA   TYR 116           HA       TYR 116  -2.792 -20.210 -20.210
  833   1HB   TYR 116           HB2      TYR 116  -5.324 -19.564 -19.564
  834   2HB   TYR 116           HB1      TYR 116  -4.996 -21.178 -21.178
  835    HD1  TYR 116           HD1      TYR 116  -3.861 -20.868 -20.868
  836    HD2  TYR 116           HD2      TYR 116  -6.916 -18.428 -18.428
  837    HE1  TYR 116           HE1      TYR 116  -4.738 -20.202 -20.202
  838    HE2  TYR 116           HE2      TYR 116  -7.772 -17.768 -17.768
  839    HH   TYR 116           HH       TYR 116  -6.054 -18.353 -18.353
  840    H    VAL 117           HN       VAL 117  -1.920 -22.011 -22.011
  841    HA   VAL 117           HA       VAL 117  -1.521 -21.732 -21.732
  842    HB   VAL 117           HB       VAL 117  -0.210 -23.508 -23.508
  843   1HG1  VAL 117          HG11      VAL 117   0.166 -23.212 -23.212
  844   2HG1  VAL 117          HG13      VAL 117   1.461 -23.823 -23.823
  845   3HG1  VAL 117          HG12      VAL 117  -0.075 -24.690 -24.690
  846   1HG2  VAL 117          HG21      VAL 117   0.247 -20.984 -20.984
  847   2HG2  VAL 117          HG23      VAL 117   1.661 -22.025 -22.025
  848   3HG2  VAL 117          HG22      VAL 117   0.990 -21.213 -21.213
  849    H    ILE 118           HN       ILE 118  -1.692 -23.772 -23.772
  850    HA   ILE 118           HA       ILE 118  -4.026 -25.405 -25.405
  851    HB   ILE 118           HB       ILE 118  -2.887 -24.559 -24.559
  852   1HG1  ILE 118          HG12      ILE 118  -3.994 -22.752 -22.752
  853   2HG1  ILE 118          HG11      ILE 118  -4.975 -23.232 -23.232
  854   1HG2  ILE 118          HG23      ILE 118  -5.144 -26.423 -26.423
  855   2HG2  ILE 118          HG22      ILE 118  -5.218 -25.469 -25.469
  856   3HG2  ILE 118          HG21      ILE 118  -3.895 -26.608 -26.608
  857   1HD1  ILE 118          HD11      ILE 118  -5.809 -24.893 -24.893
  858   2HD1  ILE 118          HD13      ILE 118  -5.624 -23.299 -23.299
  859   3HD1  ILE 118          HD12      ILE 118  -6.686 -23.513 -23.513
  860    H    ASP 119           HN       ASP 119  -3.649 -27.583 -27.583
  861    HA   ASP 119           HA       ASP 119  -1.065 -28.729 -28.729
  862   1HB   ASP 119           HB2      ASP 119  -1.548 -28.696 -28.696
  863   2HB   ASP 119           HB1      ASP 119  -2.994 -29.662 -29.662
  864    HA   PRO 120           HA       PRO 120  -4.005 -30.772 -30.772
  865   1HB   PRO 120           HB2      PRO 120  -2.122 -31.889 -31.889
  866   2HB   PRO 120           HB1      PRO 120  -2.655 -30.202 -30.202
  867   1HG   PRO 120           HG2      PRO 120  -0.204 -31.311 -31.311
  868   2HG   PRO 120           HG1      PRO 120  -0.400 -29.856 -29.856
  869   1HD   PRO 120           HD2      PRO 120  -0.217 -29.782 -29.782
  870   2HD   PRO 120           HD1      PRO 120  -1.143 -28.590 -28.590
  871    H    GLU 121           HN       GLU 121  -4.800 -32.858 -32.858
  872    HA   GLU 121           HA       GLU 121  -3.027 -34.988 -34.988
  873   1HB   GLU 121           HB2      GLU 121  -5.855 -34.210 -34.210
  874   2HB   GLU 121           HB1      GLU 121  -5.009 -35.634 -35.634
  875   1HG   GLU 121           HG2      GLU 121  -3.265 -34.229 -34.229
  876   2HG   GLU 121           HG1      GLU 121  -4.016 -32.784 -32.784
  877    HA   PRO 122           HA       PRO 122  -4.700 -37.381 -37.381
  878   1HB   PRO 122           HB2      PRO 122  -4.501 -39.909 -39.909
  879   2HB   PRO 122           HB1      PRO 122  -3.103 -38.991 -38.991
  880   1HG   PRO 122           HG2      PRO 122  -4.052 -39.385 -39.385
  881   2HG   PRO 122           HG1      PRO 122  -2.401 -39.397 -39.397
  882   1HD   PRO 122           HD2      PRO 122  -3.442 -37.265 -37.265
  883   2HD   PRO 122           HD1      PRO 122  -2.239 -37.102 -37.102
  884    H    CYS 123           HN       CYS 123  -6.164 -37.231 -37.231
  885    HA   CYS 123           HA       CYS 123  -8.610 -38.655 -38.655
  886   1HB   CYS 123           HB2      CYS 123  -7.452 -39.531 -39.531
  887   2HB   CYS 123           HB1      CYS 123  -7.684 -37.965 -37.965
  888    HG   CYS 123           HG       CYS 123 -10.015 -39.909 -39.909
  889    HA   PRO 124           HA       PRO 124 -10.583 -34.696 -34.696
  890   1HB   PRO 124           HB2      PRO 124 -13.192 -35.437 -35.437
  891   2HB   PRO 124           HB1      PRO 124 -12.346 -35.677 -35.677
  892   1HG   PRO 124           HG2      PRO 124 -12.860 -37.627 -37.627
  893   2HG   PRO 124           HG1      PRO 124 -12.969 -37.852 -37.852
  894   1HD   PRO 124           HD2      PRO 124 -10.853 -38.718 -38.718
  895   2HD   PRO 124           HD1      PRO 124 -10.696 -38.147 -38.147
  896    H    ASP 125           HN       ASP 125 -11.318 -33.122 -33.122
  897    HA   ASP 125           HA       ASP 125 -11.103 -33.874 -33.874
  898   1HB   ASP 125           HB2      ASP 125 -11.009 -31.426 -31.426
  899   2HB   ASP 125           HB1      ASP 125  -9.898 -31.941 -31.941
  900    H    SER 126           HN       SER 126 -12.729 -32.449 -32.449
  901    HA   SER 126           HA       SER 126 -15.457 -33.309 -33.309
  902   1HB   SER 126           HB2      SER 126 -15.915 -32.844 -32.844
  903   2HB   SER 126           HB1      SER 126 -14.459 -33.823 -33.823
  904    HG   SER 126           HG       SER 126 -13.837 -32.215 -32.215
  905    H    ASP 127           HN       ASP 127 -13.756 -30.646 -30.646
  906    HA   ASP 127           HA       ASP 127 -15.252 -28.403 -28.403
  907   1HB   ASP 127           HB2      ASP 127 -13.031 -28.470 -28.470
  908   2HB   ASP 127           HB1      ASP 127 -13.929 -28.781 -28.781
  909    H    GLN 128           HN       GLN 128 -17.165 -27.477 -27.477
  910    HA   GLN 128           HA       GLN 128 -18.708 -28.998 -28.998
  911   1HB   GLN 128           HB2      GLN 128 -19.532 -27.217 -27.217
  912   2HB   GLN 128           HB1      GLN 128 -20.662 -27.983 -27.983
  913   1HG   GLN 128           HG2      GLN 128 -18.657 -29.477 -29.477
  914   2HG   GLN 128           HG1      GLN 128 -20.368 -29.291 -29.291
  915   1HE2  GLN 128          HE22      GLN 128 -21.396 -31.856 -31.856
  916   2HE2  GLN 128          HE21      GLN 128 -21.843 -30.714 -30.714
  917    H    GLU 129           HN       GLU 129 -19.807 -27.794 -27.794
  918    HA   GLU 129           HA       GLU 129 -20.019 -26.061 -26.061
  919   1HB   GLU 129           HB2      GLU 129 -19.847 -24.523 -24.523
  920   2HB   GLU 129           HB1      GLU 129 -20.401 -23.832 -23.832
  921   1HG   GLU 129           HG2      GLU 129 -22.231 -25.449 -25.449
  922   2HG   GLU 129           HG1      GLU 129 -21.652 -26.241 -26.241
  923    HA   PRO 130           HA       PRO 130 -15.407 -25.016 -25.016
  924   1HB   PRO 130           HB2      PRO 130 -14.345 -26.778 -26.778
  925   2HB   PRO 130           HB1      PRO 130 -14.543 -27.160 -27.160
  926   1HG   PRO 130           HG2      PRO 130 -16.248 -27.933 -27.933
  927   2HG   PRO 130           HG1      PRO 130 -15.762 -28.887 -28.887
  928   1HD   PRO 130           HD2      PRO 130 -18.211 -27.743 -27.743
  929   2HD   PRO 130           HD1      PRO 130 -17.409 -28.003 -28.003
  930    H    LYS 131           HN       LYS 131 -14.303 -23.696 -23.696
  931    HA   LYS 131           HA       LYS 131 -15.651 -23.386 -23.386
  932   1HB   LYS 131           HB2      LYS 131 -16.335 -21.673 -21.673
  933   2HB   LYS 131           HB1      LYS 131 -14.642 -21.218 -21.218
  934   1HG   LYS 131           HG2      LYS 131 -15.570 -19.661 -19.661
  935   2HG   LYS 131           HG1      LYS 131 -14.602 -20.790 -20.790
  936   1HD   LYS 131           HD2      LYS 131 -16.658 -22.096 -22.096
  937   2HD   LYS 131           HD1      LYS 131 -17.608 -20.905 -20.905
  938   1HE   LYS 131           HE2      LYS 131 -15.825 -20.141 -20.141
  939   2HE   LYS 131           HE1      LYS 131 -17.543 -20.543 -20.543
  940   1HZ   LYS 131           HZ3      LYS 131 -18.008 -18.907 -18.907
  941   2HZ   LYS 131           HZ2      LYS 131 -16.379 -18.426 -18.426
  942   3HZ   LYS 131           HZ1      LYS 131 -17.386 -18.205 -18.205
  943    H1   NAG 132           H1       NAG 132  -2.183  -4.507  -4.507
  944    H2   NAG 132           H2       NAG 132  -2.308  -1.423  -1.423
  945    H3   NAG 132           H3       NAG 132   0.141  -3.277  -3.277
  946    H4   NAG 132           H4       NAG 132  -1.229  -1.733  -1.733
  947    H5   NAG 132           H5       NAG 132  -1.241  -4.778  -4.778
  948   1H6   NAG 132           H61      NAG 132  -1.956  -3.107  -3.107
  949   2H6   NAG 132           H62      NAG 132  -3.244  -4.241  -4.241
  950   1H8   NAG 132           H81      NAG 132   1.276  -2.548  -2.548
  951   2H8   NAG 132           H82      NAG 132   0.809  -2.532  -2.532
  952   3H8   NAG 132           H83      NAG 132   1.577  -1.066  -1.066
  953    HN2  NAG 132           HN2      NAG 132  -1.717  -2.888  -2.888
  954    HO3  NAG 132           HO3      NAG 132   1.153  -1.449  -1.449
  955    H1   NAG 133           H1       NAG 133   0.636  -1.692  -1.692
  956    H2   NAG 133           H2       NAG 133   2.919  -2.464  -2.464
  957    H3   NAG 133           H3       NAG 133   3.172  -0.740  -0.740
  958    H4   NAG 133           H4       NAG 133   3.349   0.152   0.152
  959    H5   NAG 133           H5       NAG 133   1.166   0.713   0.713
  960   1H6   NAG 133           H61      NAG 133   0.858   1.352   1.352
  961   2H6   NAG 133           H62      NAG 133   1.989   2.351   2.351
  962   1H8   NAG 133           H81      NAG 133   0.842  -5.514  -5.514
  963   2H8   NAG 133           H82      NAG 133   1.459  -3.989  -3.989
  964   3H8   NAG 133           H83      NAG 133   0.101  -3.943  -3.943
  965    HN2  NAG 133           HN2      NAG 133   3.539  -3.212  -3.212
  966    HO3  NAG 133           HO3      NAG 133   4.950  -1.511  -1.511
  967    HO6  NAG 133           HO6      NAG 133  -0.547   2.715   2.715
  968    H1   FUC 134           H1       FUC 134  -1.697  -5.716  -5.716
  969    H2   FUC 134           H2       FUC 134  -0.381  -7.544  -7.544
  970    H3   FUC 134           H3       FUC 134  -2.569  -8.849  -8.849
  971    H4   FUC 134           H4       FUC 134  -3.288  -9.890  -9.890
  972    H5   FUC 134           H5       FUC 134  -4.370  -7.568  -7.568
  973   1H6   FUC 134           H61      FUC 134  -5.068  -7.114  -7.114
  974   2H6   FUC 134           H62      FUC 134  -4.581  -8.830  -8.830
  975   3H6   FUC 134           H63      FUC 134  -3.491  -7.530  -7.530
  976    HO2  FUC 134           HO2      FUC 134   0.415  -7.460  -7.460
  977    HO3  FUC 134           HO3      FUC 134  -0.459  -9.744  -9.744
  978    HO4  FUC 134           HO4      FUC 134  -1.122  -9.808  -9.808
  979    H1   MAN 135           H1       MAN 135   5.259   0.983   0.983
  980    H2   MAN 135           H2       MAN 135   3.678   2.386   2.386
  981    H3   MAN 135           H3       MAN 135   6.006   2.636   2.636
  982    H4   MAN 135           H4       MAN 135   6.194   4.869   4.869
  983    H5   MAN 135           H5       MAN 135   7.420   2.050   2.050
  984   1H6   MAN 135           H61      MAN 135   7.804   2.776   2.776
  985   2H6   MAN 135           H62      MAN 135   8.876   3.434   3.434
  986    HO2  MAN 135           HO2      MAN 135   4.272   4.492   4.492
  987    HO3  MAN 135           HO3      MAN 135   5.293   4.230   4.230
  988    HO4  MAN 135           HO4      MAN 135   7.954   3.662   3.662
  989    HO6  MAN 135           HO6      MAN 135   7.652   5.364   5.364
  990    H1   NAG 136           H1       NAG 136   0.824  -8.565  -8.565
  991    H2   NAG 136           H2       NAG 136  -1.705  -8.358  -8.358
  992    H3   NAG 136           H3       NAG 136   0.119 -10.799 -10.799
  993    H4   NAG 136           H4       NAG 136  -0.031  -9.062  -9.062
  994    H5   NAG 136           H5       NAG 136   2.164  -9.144  -9.144
  995   1H6   NAG 136           H61      NAG 136   3.065  -7.372  -7.372
  996   2H6   NAG 136           H62      NAG 136   2.971  -8.880  -8.880
  997   1H8   NAG 136           H81      NAG 136  -4.129 -10.831 -10.831
  998   2H8   NAG 136           H82      NAG 136  -2.908 -11.666 -11.666
  999   3H8   NAG 136           H83      NAG 136  -4.433 -11.090 -11.090
 1000    HN2  NAG 136           HN2      NAG 136  -1.193  -9.800  -9.800
 1001    HO3  NAG 136           HO3      NAG 136  -1.244 -11.727 -11.727
 1002    H1   NAG 137           H1       NAG 137   2.698 -10.538 -10.538
 1003    H2   NAG 137           H2       NAG 137   1.579 -13.206 -13.206
 1004    H3   NAG 137           H3       NAG 137   4.059 -12.690 -12.690
 1005    H4   NAG 137           H4       NAG 137   3.995 -13.665 -13.665
 1006    H5   NAG 137           H5       NAG 137   4.856 -10.908 -10.908
 1007   1H6   NAG 137           H61      NAG 137   4.811 -12.227 -12.227
 1008   2H6   NAG 137           H62      NAG 137   6.144 -11.390 -11.390
 1009   1H8   NAG 137           H81      NAG 137   1.677 -15.150 -15.150
 1010   2H8   NAG 137           H82      NAG 137  -0.071 -15.428 -15.428
 1011   3H8   NAG 137           H83      NAG 137   0.574 -15.282 -15.282
 1012    HN2  NAG 137           HN2      NAG 137   1.786 -12.066 -12.066
 1013    HO3  NAG 137           HO3      NAG 137   4.074 -14.806 -14.806
 1014    HO6  NAG 137           HO6      NAG 137   5.082 -10.095 -10.095
 1015    H1   FUC 138           H1       FUC 138   1.562  -8.730  -8.730
 1016    H2   FUC 138           H2       FUC 138   1.435  -6.664  -6.664
 1017    H3   FUC 138           H3       FUC 138   0.711  -5.294  -5.294
 1018    H4   FUC 138           H4       FUC 138   2.904  -3.992  -3.992
 1019    H5   FUC 138           H5       FUC 138   3.446  -6.107  -6.107
 1020   1H6   FUC 138           H61      FUC 138   5.648  -6.609  -6.609
 1021   2H6   FUC 138           H62      FUC 138   5.376  -4.841  -4.841
 1022   3H6   FUC 138           H63      FUC 138   5.259  -5.863  -5.863
 1023    HO2  FUC 138           HO2      FUC 138  -0.579  -7.230  -7.230
 1024    HO3  FUC 138           HO3      FUC 138   0.535  -3.672  -3.672
 1025    HO4  FUC 138           HO4      FUC 138   4.013  -4.498  -4.498
 1026    H1   MAN 139           H1       MAN 139   5.401 -15.388 -15.388
 1027    H2   MAN 139           H2       MAN 139   5.324 -14.409 -14.409
 1028    H3   MAN 139           H3       MAN 139   6.098 -16.702 -16.702
 1029    H4   MAN 139           H4       MAN 139   8.930 -15.611 -15.611
 1030    H5   MAN 139           H5       MAN 139   7.163 -17.036 -17.036
 1031   1H6   MAN 139           H61      MAN 139   8.969 -16.329 -16.329
 1032   2H6   MAN 139           H62      MAN 139   9.433 -17.585 -17.585
 1033    HO2  MAN 139           HO2      MAN 139   6.822 -13.027 -13.027
 1034    HO3  MAN 139           HO3      MAN 139   7.766 -15.093 -15.093
 1035    HO4  MAN 139           HO4      MAN 139   7.876 -18.246 -18.246
 1036    HO6  MAN 139           HO6      MAN 139  11.010 -15.880 -15.880

  Start of MODEL   19
    1   1H    ALA   1           HT2      ALA   1 -15.168   6.921   6.921
    2   2H    ALA   1           HT1      ALA   1 -15.203   8.357   8.357
    3   3H    ALA   1           HT3      ALA   1 -14.065   8.170   8.170
    4    HA   ALA   1           HA       ALA   1 -13.004   7.855   7.855
    5   1HB   ALA   1           HB1      ALA   1 -15.187   5.755   5.755
    6   2HB   ALA   1           HB3      ALA   1 -13.865   5.910   5.910
    7   3HB   ALA   1           HB2      ALA   1 -15.042   7.212   7.212
    8    H    MET   1           HN       MET   1 -11.442   6.028   6.028
    9    HA   MET   1           HA       MET   1  -9.888   4.472   4.472
   10   1HB   MET   1           HB2      MET   1 -11.926   3.081   3.081
   11   2HB   MET   1           HB1      MET   1 -12.427   3.437   3.437
   12   1HG   MET   1           HG2      MET   1 -10.291   2.434   2.434
   13   2HG   MET   1           HG1      MET   1  -9.899   1.988   1.988
   14   1HE   MET   1           HE2      MET   1 -12.079   1.900   1.900
   15   2HE   MET   1           HE1      MET   1 -12.877   0.330   0.330
   16   3HE   MET   1           HE3      MET   1 -13.576   1.657   1.657
   17    H    HIS   2           HN       HIS   2  -8.605   5.731   5.731
   18    HA   HIS   2           HA       HIS   2  -9.535   6.057   6.057
   19   1HB   HIS   2           HB2      HIS   2  -7.300   7.342   7.342
   20   2HB   HIS   2           HB1      HIS   2  -7.703   7.754   7.754
   21    HD1  HIS   2           HD1      HIS   2  -8.807   8.261   8.261
   22    HD2  HIS   2           HD2      HIS   2 -10.250   9.094   9.094
   23    HE1  HIS   2           HE1      HIS   2 -10.711   9.904   9.904
   24    H    VAL   3           HN       VAL   3  -8.510   3.534   3.534
   25    HA   VAL   3           HA       VAL   3  -6.361   3.043   3.043
   26    HB   VAL   3           HB       VAL   3  -6.175   2.363   2.363
   27   1HG1  VAL   3          HG11      VAL   3  -5.042   0.986   0.986
   28   2HG1  VAL   3          HG13      VAL   3  -3.804   2.208   2.208
   29   3HG1  VAL   3          HG12      VAL   3  -4.305   1.138   1.138
   30   1HG2  VAL   3          HG22      VAL   3  -4.842   4.482   4.482
   31   2HG2  VAL   3          HG21      VAL   3  -5.784   4.715   4.715
   32   3HG2  VAL   3          HG23      VAL   3  -4.188   3.969   3.969
   33    H    ALA   4           HN       ALA   4  -6.346   0.830   0.830
   34    HA   ALA   4           HA       ALA   4  -8.434  -0.953  -0.953
   35   1HB   ALA   4           HB3      ALA   4  -8.852   0.439   0.439
   36   2HB   ALA   4           HB2      ALA   4  -8.021  -0.952  -0.952
   37   3HB   ALA   4           HB1      ALA   4  -9.504  -1.183  -1.183
   38    H    GLN   5           HN       GLN   5  -7.766  -3.055  -3.055
   39    HA   GLN   5           HA       GLN   5  -5.380  -4.014  -4.014
   40   1HB   GLN   5           HB2      GLN   5  -5.830  -4.282  -4.282
   41   2HB   GLN   5           HB1      GLN   5  -4.412  -4.825  -4.825
   42   1HG   GLN   5           HG2      GLN   5  -3.567  -2.799  -2.799
   43   2HG   GLN   5           HG1      GLN   5  -4.478  -2.221  -2.221
   44   1HE2  GLN   5          HE22      GLN   5  -6.360  -1.782  -1.782
   45   2HE2  GLN   5          HE21      GLN   5  -5.512  -3.216  -3.216
   46    HA   PRO   6           HA       PRO   6  -7.964  -7.638  -7.638
   47   1HB   PRO   6           HB2      PRO   6  -6.056  -9.515  -9.515
   48   2HB   PRO   6           HB1      PRO   6  -6.647  -8.345  -8.345
   49   1HG   PRO   6           HG2      PRO   6  -4.143  -8.306  -8.306
   50   2HG   PRO   6           HG1      PRO   6  -4.413  -7.834  -7.834
   51   1HD   PRO   6           HD2      PRO   6  -4.192  -6.038  -6.038
   52   2HD   PRO   6           HD1      PRO   6  -5.149  -5.739  -5.739
   53    H    ALA   7           HN       ALA   7  -8.556  -9.373  -9.373
   54    HA   ALA   7           HA       ALA   7  -7.242  -9.360  -9.360
   55   1HB   ALA   7           HB3      ALA   7  -9.681 -10.726 -10.726
   56   2HB   ALA   7           HB2      ALA   7  -9.201 -10.889 -10.889
   57   3HB   ALA   7           HB1      ALA   7  -9.665  -9.311  -9.311
   58    H    VAL   8           HN       VAL   8  -7.216 -11.346 -11.346
   59    HA   VAL   8           HA       VAL   8  -5.202 -13.042 -13.042
   60    HB   VAL   8           HB       VAL   8  -7.625 -13.717 -13.717
   61   1HG1  VAL   8          HG11      VAL   8  -7.845 -14.025 -14.025
   62   2HG1  VAL   8          HG13      VAL   8  -8.018 -15.611 -15.611
   63   3HG1  VAL   8          HG12      VAL   8  -9.070 -14.263 -14.263
   64   1HG2  VAL   8          HG23      VAL   8  -5.379 -15.033 -15.033
   65   2HG2  VAL   8          HG22      VAL   8  -6.906 -15.810 -15.810
   66   3HG2  VAL   8          HG21      VAL   8  -6.137 -16.022 -16.022
   67    H    VAL   9           HN       VAL   9  -4.227 -14.456 -14.456
   68    HA   VAL   9           HA       VAL   9  -4.996 -13.823 -13.823
   69    HB   VAL   9           HB       VAL   9  -2.343 -13.453 -13.453
   70   1HG1  VAL   9          HG13      VAL   9  -2.902 -13.822 -13.822
   71   2HG1  VAL   9          HG12      VAL   9  -1.498 -12.920 -12.920
   72   3HG1  VAL   9          HG11      VAL   9  -1.675 -14.627 -14.627
   73   1HG2  VAL   9          HG23      VAL   9  -4.193 -11.649 -11.649
   74   2HG2  VAL   9          HG22      VAL   9  -2.536 -11.223 -11.223
   75   3HG2  VAL   9          HG21      VAL   9  -3.689 -11.642 -11.642
   76    H    LEU  10           HN       LEU  10  -4.151 -15.395 -15.395
   77    HA   LEU  10           HA       LEU  10  -3.598 -18.067 -18.067
   78   1HB   LEU  10           HB2      LEU  10  -5.109 -17.328 -17.328
   79   2HB   LEU  10           HB1      LEU  10  -4.884 -18.967 -18.967
   80    HG   LEU  10           HG       LEU  10  -6.297 -16.737 -16.737
   81   1HD1  LEU  10          HD13      LEU  10  -7.517 -17.579 -17.579
   82   2HD1  LEU  10          HD12      LEU  10  -7.444 -19.206 -19.206
   83   3HD1  LEU  10          HD11      LEU  10  -8.350 -17.943 -17.943
   84   1HD2  LEU  10          HD22      LEU  10  -5.383 -19.460 -19.460
   85   2HD2  LEU  10          HD21      LEU  10  -5.741 -18.080 -18.080
   86   3HD2  LEU  10          HD23      LEU  10  -7.052 -19.096 -19.096
   87    H    ALA  11           HN       ALA  11  -1.706 -19.023 -19.023
   88    HA   ALA  11           HA       ALA  11  -0.194 -17.801 -17.801
   89   1HB   ALA  11           HB2      ALA  11   0.819 -18.007 -18.007
   90   2HB   ALA  11           HB1      ALA  11   0.632 -19.758 -19.758
   91   3HB   ALA  11           HB3      ALA  11   1.718 -18.918 -18.918
   92    H    SER  12           HN       SER  12   0.074 -18.991 -18.991
   93    HA   SER  12           HA       SER  12  -0.622 -21.916 -21.916
   94   1HB   SER  12           HB2      SER  12  -1.591 -19.784 -19.784
   95   2HB   SER  12           HB1      SER  12  -1.887 -21.507 -21.507
   96    HG   SER  12           HG       SER  12  -2.801 -19.757 -19.757
   97    H    SER  13           HN       SER  13   0.146 -23.142 -23.142
   98    HA   SER  13           HA       SER  13   1.809 -23.835 -23.835
   99   1HB   SER  13           HB2      SER  13   0.701 -21.961 -21.961
  100   2HB   SER  13           HB1      SER  13   1.904 -20.855 -20.855
  101    HG   SER  13           HG       SER  13   2.096 -22.700 -22.700
  102    H    ARG  14           HN       ARG  14   3.876 -21.163 -21.163
  103    HA   ARG  14           HA       ARG  14   6.078 -22.419 -22.419
  104   1HB   ARG  14           HB2      ARG  14   5.450 -19.582 -19.582
  105   2HB   ARG  14           HB1      ARG  14   7.035 -20.065 -20.065
  106   1HG   ARG  14           HG2      ARG  14   6.277 -21.967 -21.967
  107   2HG   ARG  14           HG1      ARG  14   5.936 -20.369 -20.369
  108   1HD   ARG  14           HD2      ARG  14   8.256 -19.656 -19.656
  109   2HD   ARG  14           HD1      ARG  14   8.589 -21.310 -21.310
  110    HE   ARG  14           HE       ARG  14   7.553 -21.717 -21.717
  111   1HH1  ARG  14          HH21      ARG  14  10.109 -19.664 -19.664
  112   2HH1  ARG  14          HH22      ARG  14  10.994 -19.716 -19.716
  113   1HH2  ARG  14          HH11      ARG  14   8.731 -21.756 -21.756
  114   2HH2  ARG  14          HH12      ARG  14  10.225 -20.887 -20.887
  115    H    GLY  15           HN       GLY  15   3.421 -20.750 -20.750
  116   1HA   GLY  15           HA2      GLY  15   3.032 -20.573 -20.573
  117   2HA   GLY  15           HA1      GLY  15   4.740 -20.937 -20.937
  118    H    ILE  16           HN       ILE  16   3.293 -18.536 -18.536
  119    HA   ILE  16           HA       ILE  16   4.887 -16.442 -16.442
  120    HB   ILE  16           HB       ILE  16   3.622 -16.253 -16.253
  121   1HG1  ILE  16          HG12      ILE  16   4.859 -18.322 -18.322
  122   2HG1  ILE  16          HG11      ILE  16   5.735 -17.092 -17.092
  123   1HG2  ILE  16          HG22      ILE  16   5.849 -14.927 -14.927
  124   2HG2  ILE  16          HG21      ILE  16   5.857 -14.933 -14.933
  125   3HG2  ILE  16          HG23      ILE  16   4.513 -14.197 -14.197
  126   1HD1  ILE  16          HD13      ILE  16   6.382 -17.478 -17.478
  127   2HD1  ILE  16          HD12      ILE  16   6.958 -18.684 -18.684
  128   3HD1  ILE  16          HD11      ILE  16   7.430 -16.990 -16.990
  129    H    ALA  17           HN       ALA  17   3.513 -15.467 -15.467
  130    HA   ALA  17           HA       ALA  17   0.648 -15.096 -15.096
  131   1HB   ALA  17           HB2      ALA  17   1.338 -16.093 -16.093
  132   2HB   ALA  17           HB1      ALA  17   2.142 -14.576 -14.576
  133   3HB   ALA  17           HB3      ALA  17   0.392 -14.618 -14.618
  134    H    SER  18           HN       SER  18   0.023 -13.137 -13.137
  135    HA   SER  18           HA       SER  18   1.657 -10.725 -10.725
  136   1HB   SER  18           HB2      SER  18   1.944 -11.635 -11.635
  137   2HB   SER  18           HB1      SER  18   0.239 -11.289 -11.289
  138    HG   SER  18           HG       SER  18   2.288  -9.457  -9.457
  139    H    PHE  19           HN       PHE  19   0.474  -9.090  -9.090
  140    HA   PHE  19           HA       PHE  19  -2.455  -8.946  -8.946
  141   1HB   PHE  19           HB2      PHE  19  -2.835  -8.650  -8.650
  142   2HB   PHE  19           HB1      PHE  19  -2.124 -10.215 -10.215
  143    HD1  PHE  19           HD2      PHE  19   0.424 -10.500 -10.500
  144    HD2  PHE  19           HD1      PHE  19  -1.758  -7.112  -7.112
  145    HE1  PHE  19           HE2      PHE  19   2.323 -10.005 -10.005
  146    HE2  PHE  19           HE1      PHE  19   0.143  -6.617  -6.617
  147    HZ   PHE  19           HZ       PHE  19   2.183  -8.068  -8.068
  148    H    VAL  20           HN       VAL  20  -3.343  -6.786  -6.786
  149    HA   VAL  20           HA       VAL  20  -1.233  -4.670  -4.670
  150    HB   VAL  20           HB       VAL  20  -4.020  -4.767  -4.767
  151   1HG1  VAL  20          HG13      VAL  20  -3.268  -2.474  -2.474
  152   2HG1  VAL  20          HG12      VAL  20  -1.817  -2.717  -2.717
  153   3HG1  VAL  20          HG11      VAL  20  -3.405  -2.687  -2.687
  154   1HG2  VAL  20          HG22      VAL  20  -2.204  -6.249  -6.249
  155   2HG2  VAL  20          HG21      VAL  20  -2.979  -5.104  -5.104
  156   3HG2  VAL  20          HG23      VAL  20  -1.379  -4.754  -4.754
  157    H    CYS  21           HN       CYS  21  -1.203  -3.248  -3.248
  158    HA   CYS  21           HA       CYS  21  -3.616  -2.965  -2.965
  159   1HB   CYS  21           HB2      CYS  21  -1.476  -3.855  -3.855
  160   2HB   CYS  21           HB1      CYS  21  -0.670  -2.366  -2.366
  161    H    GLU  22           HN       GLU  22  -4.693  -1.016  -1.016
  162    HA   GLU  22           HA       GLU  22  -3.208   1.077   1.077
  163   1HB   GLU  22           HB2      GLU  22  -5.361   1.894   1.894
  164   2HB   GLU  22           HB1      GLU  22  -5.473   0.138   0.138
  165   1HG   GLU  22           HG2      GLU  22  -6.431   0.148   0.148
  166   2HG   GLU  22           HG1      GLU  22  -6.365   1.907   1.907
  167    H    TYR  23           HN       TYR  23  -3.176   3.275   3.275
  168    HA   TYR  23           HA       TYR  23  -3.725   3.801   3.801
  169   1HB   TYR  23           HB2      TYR  23  -1.504   4.865   4.865
  170   2HB   TYR  23           HB1      TYR  23  -1.341   3.195   3.195
  171    HD1  TYR  23           HD1      TYR  23  -0.951   2.684   2.684
  172    HD2  TYR  23           HD2      TYR  23  -0.880   6.715   6.715
  173    HE1  TYR  23           HE1      TYR  23   0.273   3.461   3.461
  174    HE2  TYR  23           HE2      TYR  23   0.343   7.491   7.491
  175    HH   TYR  23           HH       TYR  23   1.706   6.625   6.625
  176    H    ALA  24           HN       ALA  24  -3.226   6.419   6.419
  177    HA   ALA  24           HA       ALA  24  -4.671   7.685   7.685
  178   1HB   ALA  24           HB1      ALA  24  -5.049   7.977   7.977
  179   2HB   ALA  24           HB3      ALA  24  -5.800   9.054   9.054
  180   3HB   ALA  24           HB2      ALA  24  -6.205   7.338   7.338
  181    H    SER  25           HN       SER  25  -3.349   9.171   9.171
  182    HA   SER  25           HA       SER  25  -2.108  11.278  11.278
  183   1HB   SER  25           HB2      SER  25  -0.466   9.241   9.241
  184   2HB   SER  25           HB1      SER  25   0.186  10.727  10.727
  185    HG   SER  25           HG       SER  25  -0.634   9.961   9.961
  186    HA   PRO  26           HA       PRO  26  -2.814  13.419  13.419
  187   1HB   PRO  26           HB2      PRO  26  -0.873  15.352  15.352
  188   2HB   PRO  26           HB1      PRO  26  -2.331  15.404  15.404
  189   1HG   PRO  26           HG2      PRO  26   0.428  14.522  14.522
  190   2HG   PRO  26           HG1      PRO  26  -0.722  15.493  15.493
  191   1HD   PRO  26           HD2      PRO  26  -0.319  12.864  12.864
  192   2HD   PRO  26           HD1      PRO  26  -1.894  13.651  13.651
  193    H    GLY  27           HN       GLY  27   0.293  11.978  11.978
  194   1HA   GLY  27           HA2      GLY  27   1.707  10.813  10.813
  195   2HA   GLY  27           HA1      GLY  27   0.629  11.262  11.262
  196    H    LYS  28           HN       LYS  28   2.186  13.548  13.548
  197    HA   LYS  28           HA       LYS  28   3.522  14.790  14.790
  198   1HB   LYS  28           HB2      LYS  28   2.866  15.789  15.789
  199   2HB   LYS  28           HB1      LYS  28   3.673  16.756  16.756
  200   1HG   LYS  28           HG2      LYS  28   1.684  16.293  16.293
  201   2HG   LYS  28           HG1      LYS  28   0.875  15.615  15.615
  202   1HD   LYS  28           HD2      LYS  28   1.680  17.934  17.934
  203   2HD   LYS  28           HD1      LYS  28   1.575  18.449  18.449
  204   1HE   LYS  28           HE2      LYS  28  -0.645  18.765  18.765
  205   2HE   LYS  28           HE1      LYS  28  -0.772  16.997  16.997
  206   1HZ   LYS  28           HZ2      LYS  28  -0.053  16.965  16.965
  207   2HZ   LYS  28           HZ1      LYS  28  -0.261  18.651  18.651
  208   3HZ   LYS  28           HZ3      LYS  28  -1.591  17.640  17.640
  209    H    ALA  29           HN       ALA  29   4.531  12.399  12.399
  210    HA   ALA  29           HA       ALA  29   7.273  13.449  13.449
  211   1HB   ALA  29           HB2      ALA  29   5.544  13.186  13.186
  212   2HB   ALA  29           HB1      ALA  29   6.233  11.562  11.562
  213   3HB   ALA  29           HB3      ALA  29   7.286  12.963  12.963
  214    H    THR  30           HN       THR  30   8.866  11.913  11.913
  215    HA   THR  30           HA       THR  30   8.123   9.536   9.536
  216    HB   THR  30           HB       THR  30  10.651   9.235   9.235
  217    HG1  THR  30           HG1      THR  30  10.769  11.855  11.855
  218   1HG2  THR  30          HG23      THR  30   9.112  11.184  11.184
  219   2HG2  THR  30          HG22      THR  30  10.726  11.810  11.810
  220   3HG2  THR  30          HG21      THR  30  10.538  10.277  10.277
  221    H    GLU  31           HN       GLU  31   9.617  10.220  10.220
  222    HA   GLU  31           HA       GLU  31  10.268   7.461   7.461
  223   1HB   GLU  31           HB2      GLU  31  10.158   9.892   9.892
  224   2HB   GLU  31           HB1      GLU  31  11.066   8.422   8.422
  225   1HG   GLU  31           HG2      GLU  31  11.641   9.688   9.688
  226   2HG   GLU  31           HG1      GLU  31  12.110  10.645  10.645
  227    H    VAL  32           HN       VAL  32   8.097   6.456   6.456
  228    HA   VAL  32           HA       VAL  32   6.252   7.004   7.004
  229    HB   VAL  32           HB       VAL  32   6.124   5.128   5.128
  230   1HG1  VAL  32          HG13      VAL  32   4.745   4.844   4.844
  231   2HG1  VAL  32          HG12      VAL  32   3.653   5.891   5.891
  232   3HG1  VAL  32          HG11      VAL  32   4.132   4.330   4.330
  233   1HG2  VAL  32          HG23      VAL  32   5.287   7.944   7.944
  234   2HG2  VAL  32          HG22      VAL  32   5.805   7.178   7.178
  235   3HG2  VAL  32          HG21      VAL  32   4.162   6.932   6.932
  236    H    ARG  33           HN       ARG  33   7.809   6.229   6.229
  237    HA   ARG  33           HA       ARG  33   9.170   3.745   3.745
  238   1HB   ARG  33           HB2      ARG  33   9.469   5.725   5.725
  239   2HB   ARG  33           HB1      ARG  33   8.064   5.133   5.133
  240   1HG   ARG  33           HG2      ARG  33   9.181   3.007   3.007
  241   2HG   ARG  33           HG1      ARG  33  10.566   3.509   3.509
  242   1HD   ARG  33           HD2      ARG  33  10.946   5.410   5.410
  243   2HD   ARG  33           HD1      ARG  33   9.620   4.799   4.799
  244    HE   ARG  33           HE       ARG  33  11.184   2.566   2.566
  245   1HH1  ARG  33          HH21      ARG  33  11.910   5.836   5.836
  246   2HH1  ARG  33          HH22      ARG  33  13.215   5.337   5.337
  247   1HH2  ARG  33          HH11      ARG  33  12.883   1.969   1.969
  248   2HH2  ARG  33          HH12      ARG  33  13.763   3.175   3.175
  249    H    VAL  34           HN       VAL  34   8.387   1.714   1.714
  250    HA   VAL  34           HA       VAL  34   5.785   1.210   1.210
  251    HB   VAL  34           HB       VAL  34   5.431  -0.524  -0.524
  252   1HG1  VAL  34          HG12      VAL  34   5.800   2.366   2.366
  253   2HG1  VAL  34          HG11      VAL  34   5.384   1.238   1.238
  254   3HG1  VAL  34          HG13      VAL  34   4.315   1.422   1.422
  255   1HG2  VAL  34          HG21      VAL  34   7.951   0.650   0.650
  256   2HG2  VAL  34          HG23      VAL  34   7.793  -0.971  -0.971
  257   3HG2  VAL  34          HG22      VAL  34   6.896  -0.529  -0.529
  258    H    THR  35           HN       THR  35   5.879  -0.345  -0.345
  259    HA   THR  35           HA       THR  35   8.339  -2.060  -2.060
  260    HB   THR  35           HB       THR  35   6.609  -0.941  -0.941
  261    HG1  THR  35           HG1      THR  35   8.338   0.466   0.466
  262   1HG2  THR  35          HG23      THR  35   9.161  -2.565  -2.565
  263   2HG2  THR  35          HG22      THR  35   8.663  -1.638  -1.638
  264   3HG2  THR  35          HG21      THR  35   7.648  -2.951  -2.951
  265    H    VAL  36           HN       VAL  36   7.973  -4.233  -4.233
  266    HA   VAL  36           HA       VAL  36   5.166  -5.189  -5.189
  267    HB   VAL  36           HB       VAL  36   7.613  -6.384  -6.384
  268   1HG1  VAL  36          HG11      VAL  36   4.893  -7.462  -7.462
  269   2HG1  VAL  36          HG13      VAL  36   5.599  -7.861  -7.861
  270   3HG1  VAL  36          HG12      VAL  36   6.441  -8.303  -8.303
  271   1HG2  VAL  36          HG21      VAL  36   5.226  -4.831  -4.831
  272   2HG2  VAL  36          HG23      VAL  36   6.900  -4.742  -4.742
  273   3HG2  VAL  36          HG22      VAL  36   5.876  -6.082  -6.082
  274    H    LEU  37           HN       LEU  37   4.745  -6.436  -6.436
  275    HA   LEU  37           HA       LEU  37   7.189  -7.439  -7.439
  276   1HB   LEU  37           HB2      LEU  37   4.558  -6.362  -6.362
  277   2HB   LEU  37           HB1      LEU  37   5.895  -6.938  -6.938
  278    HG   LEU  37           HG       LEU  37   6.133  -4.664  -4.664
  279   1HD1  LEU  37          HD12      LEU  37   4.581  -4.494  -4.494
  280   2HD1  LEU  37          HD11      LEU  37   6.140  -4.284  -4.284
  281   3HD1  LEU  37          HD13      LEU  37   5.647  -3.164  -3.164
  282   1HD2  LEU  37          HD23      LEU  37   7.888  -5.738  -5.738
  283   2HD2  LEU  37          HD22      LEU  37   8.237  -5.786  -5.786
  284   3HD2  LEU  37          HD21      LEU  37   8.204  -4.239  -4.239
  285    H    ARG  38           HN       ARG  38   6.629  -9.171  -9.171
  286    HA   ARG  38           HA       ARG  38   4.400 -10.947 -10.947
  287   1HB   ARG  38           HB2      ARG  38   6.651 -11.633 -11.633
  288   2HB   ARG  38           HB1      ARG  38   7.221 -11.743 -11.743
  289   1HG   ARG  38           HG2      ARG  38   5.311 -13.375 -13.375
  290   2HG   ARG  38           HG1      ARG  38   5.072 -13.408 -13.408
  291   1HD   ARG  38           HD2      ARG  38   7.362 -14.212 -14.212
  292   2HD   ARG  38           HD1      ARG  38   7.681 -14.097 -14.097
  293    HE   ARG  38           HE       ARG  38   5.365 -15.650 -15.650
  294   1HH1  ARG  38          HH21      ARG  38   8.647 -15.861 -15.861
  295   2HH1  ARG  38          HH22      ARG  38   8.636 -17.589 -17.589
  296   1HH2  ARG  38          HH11      ARG  38   5.395 -17.884 -17.884
  297   2HH2  ARG  38          HH12      ARG  38   6.816 -18.724 -18.724
  298    H    GLN  39           HN       GLN  39   3.035 -11.285 -11.285
  299    HA   GLN  39           HA       GLN  39   4.203 -11.053 -11.053
  300   1HB   GLN  39           HB2      GLN  39   1.453 -10.592 -10.592
  301   2HB   GLN  39           HB1      GLN  39   1.746 -10.643 -10.643
  302   1HG   GLN  39           HG2      GLN  39   3.332  -8.804  -8.804
  303   2HG   GLN  39           HG1      GLN  39   3.168  -8.785  -8.785
  304   1HE2  GLN  39          HE22      GLN  39  -0.239  -7.453  -7.453
  305   2HE2  GLN  39          HE21      GLN  39   0.623  -8.645  -8.645
  306    H    ALA  40           HN       ALA  40   4.186 -12.798 -12.798
  307    HA   ALA  40           HA       ALA  40   2.463 -15.140 -15.140
  308   1HB   ALA  40           HB2      ALA  40   5.207 -14.936 -14.936
  309   2HB   ALA  40           HB1      ALA  40   5.038 -15.668 -15.668
  310   3HB   ALA  40           HB3      ALA  40   4.331 -16.456 -16.456
  311    H    ASP  41           HN       ASP  41   1.735 -16.365 -16.365
  312    HA   ASP  41           HA       ASP  41   1.070 -14.854 -14.854
  313   1HB   ASP  41           HB2      ASP  41   1.226 -17.791 -17.791
  314   2HB   ASP  41           HB1      ASP  41   0.564 -17.183 -17.183
  315    H    SER  42           HN       SER  42   3.669 -17.245 -17.245
  316    HA   SER  42           HA       SER  42   4.712 -17.087 -17.087
  317   1HB   SER  42           HB2      SER  42   6.565 -18.362 -18.362
  318   2HB   SER  42           HB1      SER  42   5.024 -18.970 -18.970
  319    HG   SER  42           HG       SER  42   6.549 -18.639 -18.639
  320    H    GLN  43           HN       GLN  43   5.727 -15.559 -15.559
  321    HA   GLN  43           HA       GLN  43   6.955 -13.329 -13.329
  322   1HB   GLN  43           HB2      GLN  43   8.456 -15.327 -15.327
  323   2HB   GLN  43           HB1      GLN  43   9.121 -13.747 -13.747
  324   1HG   GLN  43           HG2      GLN  43   8.724 -14.330 -14.330
  325   2HG   GLN  43           HG1      GLN  43   8.359 -15.971 -15.971
  326   1HE2  GLN  43          HE22      GLN  43  12.053 -15.615 -15.615
  327   2HE2  GLN  43          HE21      GLN  43  10.657 -15.224 -15.224
  328    H    VAL  44           HN       VAL  44   7.593 -11.546 -11.546
  329    HA   VAL  44           HA       VAL  44   6.386 -11.654 -11.654
  330    HB   VAL  44           HB       VAL  44   6.315  -9.465  -9.465
  331   1HG1  VAL  44          HG11      VAL  44   5.346  -9.496  -9.496
  332   2HG1  VAL  44          HG13      VAL  44   4.832  -8.298  -8.298
  333   3HG1  VAL  44          HG12      VAL  44   6.528  -8.401  -8.401
  334   1HG2  VAL  44          HG21      VAL  44   4.722 -11.626 -11.626
  335   2HG2  VAL  44          HG23      VAL  44   4.116 -10.041 -10.041
  336   3HG2  VAL  44          HG22      VAL  44   3.874 -10.613 -10.613
  337    H    THR  45           HN       THR  45   7.702 -10.744 -10.744
  338    HA   THR  45           HA       THR  45  10.101  -9.173  -9.173
  339    HB   THR  45           HB       THR  45  11.527 -10.701 -10.701
  340    HG1  THR  45           HG1      THR  45   9.156 -12.244 -12.244
  341   1HG2  THR  45          HG23      THR  45  10.949 -11.057 -11.057
  342   2HG2  THR  45          HG22      THR  45   9.934 -12.383 -12.383
  343   3HG2  THR  45          HG21      THR  45  11.671 -12.408 -12.408
  344    H    GLU  46           HN       GLU  46  11.113  -8.055  -8.055
  345    HA   GLU  46           HA       GLU  46   9.172  -7.135  -7.135
  346   1HB   GLU  46           HB2      GLU  46  12.080  -6.557  -6.557
  347   2HB   GLU  46           HB1      GLU  46  11.203  -5.744  -5.744
  348   1HG   GLU  46           HG2      GLU  46   9.836  -4.577  -4.577
  349   2HG   GLU  46           HG1      GLU  46  10.002  -5.784  -5.784
  350    H    VAL  47           HN       VAL  47   9.500  -7.243  -7.243
  351    HA   VAL  47           HA       VAL  47  11.080  -9.642  -9.642
  352    HB   VAL  47           HB       VAL  47   8.519  -8.390  -8.390
  353   1HG1  VAL  47          HG12      VAL  47  10.361 -10.422 -10.422
  354   2HG1  VAL  47          HG11      VAL  47   8.627 -10.731 -10.731
  355   3HG1  VAL  47          HG13      VAL  47   9.310  -9.258  -9.258
  356   1HG2  VAL  47          HG22      VAL  47   9.221 -10.749 -10.749
  357   2HG2  VAL  47          HG21      VAL  47   7.859  -9.638  -9.638
  358   3HG2  VAL  47          HG23      VAL  47   7.849 -10.897 -10.897
  359    H    CYS  48           HN       CYS  48   9.635  -7.121  -7.121
  360    HA   CYS  48           HA       CYS  48  12.405  -6.420  -6.420
  361   1HB   CYS  48           HB2      CYS  48   9.790  -6.704  -6.704
  362   2HB   CYS  48           HB1      CYS  48  11.298  -6.143  -6.143
  363    H    ALA  49           HN       ALA  49  12.613  -4.210  -4.210
  364    HA   ALA  49           HA       ALA  49  10.473  -2.259  -2.259
  365   1HB   ALA  49           HB3      ALA  49  12.607  -2.918  -2.918
  366   2HB   ALA  49           HB2      ALA  49  12.503  -1.192  -1.192
  367   3HB   ALA  49           HB1      ALA  49  11.094  -2.051  -2.051
  368    H    ALA  50           HN       ALA  50  10.754  -0.492  -0.492
  369    HA   ALA  50           HA       ALA  50  13.354   0.560   0.560
  370   1HB   ALA  50           HB1      ALA  50  11.774  -1.119  -1.119
  371   2HB   ALA  50           HB3      ALA  50  13.197  -0.162  -0.162
  372   3HB   ALA  50           HB2      ALA  50  13.341  -1.532  -1.532
  373    H    THR  51           HN       THR  51  13.093   2.324   2.324
  374    HA   THR  51           HA       THR  51  10.411   3.600   3.600
  375    HB   THR  51           HB       THR  51  12.914   4.808   4.808
  376    HG1  THR  51           HG1      THR  51  12.204   4.599   4.599
  377   1HG2  THR  51          HG23      THR  51  10.322   5.740   5.740
  378   2HG2  THR  51          HG22      THR  51  11.238   6.406   6.406
  379   3HG2  THR  51          HG21      THR  51  11.749   6.728   6.728
  380    H    TYR  52           HN       TYR  52   9.042   3.441   3.441
  381    HA   TYR  52           HA       TYR  52  10.093   2.422   2.422
  382   1HB   TYR  52           HB2      TYR  52   7.967   1.645   1.645
  383   2HB   TYR  52           HB1      TYR  52   7.294   3.254   3.254
  384    HD1  TYR  52           HD2      TYR  52   7.188   4.159   4.159
  385    HD2  TYR  52           HD1      TYR  52   8.020   0.020   0.020
  386    HE1  TYR  52           HE2      TYR  52   6.618   3.497   3.497
  387    HE2  TYR  52           HE1      TYR  52   7.460  -0.640  -0.640
  388    HH   TYR  52           HH       TYR  52   5.780   1.280   1.280
  389    H    MET  53           HN       MET  53  11.094   4.018   4.018
  390    HA   MET  53           HA       MET  53  10.151   6.786   6.786
  391   1HB   MET  53           HB2      MET  53  12.529   5.891   5.891
  392   2HB   MET  53           HB1      MET  53  11.960   5.354   5.354
  393   1HG   MET  53           HG2      MET  53  12.309   7.410   7.410
  394   2HG   MET  53           HG1      MET  53  11.145   8.066   8.066
  395   1HE   MET  53           HE3      MET  53  11.660   7.796   7.796
  396   2HE   MET  53           HE2      MET  53  13.242   7.353   7.353
  397   3HE   MET  53           HE1      MET  53  12.756   9.049   9.049
  398    H    MET  54           HN       MET  54   9.125   7.715   7.715
  399    HA   MET  54           HA       MET  54   7.007   6.096   6.096
  400   1HB   MET  54           HB2      MET  54   8.356   8.604   8.604
  401   2HB   MET  54           HB1      MET  54   6.843   7.966   7.966
  402   1HG   MET  54           HG2      MET  54   7.317   8.779   8.779
  403   2HG   MET  54           HG1      MET  54   6.411   9.712   9.712
  404   1HE   MET  54           HE3      MET  54   6.957   6.950   6.950
  405   2HE   MET  54           HE2      MET  54   5.468   7.230   7.230
  406   3HE   MET  54           HE1      MET  54   5.623   5.795   5.795
  407    H    GLY  55           HN       GLY  55  10.321   6.523   6.523
  408   1HA   GLY  55           HA2      GLY  55  10.036   5.464   5.464
  409   2HA   GLY  55           HA1      GLY  55  11.534   5.477   5.477
  410    H    ASN  56           HN       ASN  56  11.811   3.711   3.711
  411    HA   ASN  56           HA       ASN  56  10.062   1.340   1.340
  412   1HB   ASN  56           HB2      ASN  56  11.998   1.620   1.620
  413   2HB   ASN  56           HB1      ASN  56  12.979   0.944   0.944
  414   1HD2  ASN  56          HD22      ASN  56  11.965  -2.257  -2.257
  415   2HD2  ASN  56          HD21      ASN  56  13.257  -1.195  -1.195
  416    H    GLU  57           HN       GLU  57  11.190  -0.547  -0.547
  417    HA   GLU  57           HA       GLU  57  12.325   0.617   0.617
  418   1HB   GLU  57           HB2      GLU  57   9.965  -0.192  -0.192
  419   2HB   GLU  57           HB1      GLU  57  10.516  -1.786  -1.786
  420   1HG   GLU  57           HG2      GLU  57  10.310  -1.830  -1.830
  421   2HG   GLU  57           HG1      GLU  57  12.030  -1.820  -1.820
  422    H    LEU  58           HN       LEU  58  14.427  -0.066  -0.066
  423    HA   LEU  58           HA       LEU  58  15.211  -2.755  -2.755
  424   1HB   LEU  58           HB2      LEU  58  16.753  -0.148  -0.148
  425   2HB   LEU  58           HB1      LEU  58  17.411  -1.652  -1.652
  426    HG   LEU  58           HG       LEU  58  16.817  -0.384  -0.384
  427   1HD1  LEU  58          HD12      LEU  58  15.714  -2.827  -2.827
  428   2HD1  LEU  58          HD11      LEU  58  14.267  -1.875  -1.875
  429   3HD1  LEU  58          HD13      LEU  58  15.584  -1.919  -1.919
  430   1HD2  LEU  58          HD22      LEU  58  15.009   0.901   0.901
  431   2HD2  LEU  58          HD21      LEU  58  15.220   1.192   1.192
  432   3HD2  LEU  58          HD23      LEU  58  13.978   0.073   0.073
  433    H    THR  59           HN       THR  59  14.237  -2.501  -2.501
  434    HA   THR  59           HA       THR  59  16.672  -2.544  -2.544
  435    HB   THR  59           HB       THR  59  14.904  -1.943  -1.943
  436    HG1  THR  59           HG1      THR  59  13.234  -1.361  -1.361
  437   1HG2  THR  59          HG23      THR  59  16.325  -0.344  -0.344
  438   2HG2  THR  59          HG22      THR  59  14.732   0.042   0.042
  439   3HG2  THR  59          HG21      THR  59  15.074   0.306   0.306
  440    H    PHE  60           HN       PHE  60  14.486  -3.733  -3.733
  441    HA   PHE  60           HA       PHE  60  13.899  -5.858  -5.858
  442   1HB   PHE  60           HB2      PHE  60  14.097  -6.678  -6.678
  443   2HB   PHE  60           HB1      PHE  60  13.142  -7.449  -7.449
  444    HD1  PHE  60           HD1      PHE  60  11.420  -5.783  -5.783
  445    HD2  PHE  60           HD2      PHE  60  13.018  -5.213  -5.213
  446    HE1  PHE  60           HE1      PHE  60   9.487  -4.300  -4.300
  447    HE2  PHE  60           HE2      PHE  60  11.088  -3.729  -3.729
  448    HZ   PHE  60           HZ       PHE  60   9.318  -3.273  -3.273
  449    H    LEU  61           HN       LEU  61  16.785  -5.017  -5.017
  450    HA   LEU  61           HA       LEU  61  18.310  -7.295  -7.295
  451   1HB   LEU  61           HB2      LEU  61  19.074  -4.930  -4.930
  452   2HB   LEU  61           HB1      LEU  61  19.040  -4.997  -4.997
  453    HG   LEU  61           HG       LEU  61  20.680  -6.876  -6.876
  454   1HD1  LEU  61          HD12      LEU  61  20.532  -6.282  -6.282
  455   2HD1  LEU  61          HD11      LEU  61  21.901  -7.123  -7.123
  456   3HD1  LEU  61          HD13      LEU  61  20.287  -7.831  -7.831
  457   1HD2  LEU  61          HD23      LEU  61  21.392  -4.250  -4.250
  458   2HD2  LEU  61          HD22      LEU  61  21.597  -4.695  -4.695
  459   3HD2  LEU  61          HD21      LEU  61  22.609  -5.441  -5.441
  460    H    ASP  62           HN       ASP  62  17.169  -6.254  -6.254
  461    HA   ASP  62           HA       ASP  62  18.721  -8.024  -8.024
  462   1HB   ASP  62           HB2      ASP  62  17.000  -7.610  -7.610
  463   2HB   ASP  62           HB1      ASP  62  17.465  -6.128  -6.128
  464    H    ASP  63           HN       ASP  63  15.595  -8.564  -8.564
  465    HA   ASP  63           HA       ASP  63  15.610 -11.320 -11.320
  466   1HB   ASP  63           HB2      ASP  63  13.583  -9.587  -9.587
  467   2HB   ASP  63           HB1      ASP  63  13.297 -11.295 -11.295
  468    H    SER  64           HN       SER  64  16.533  -9.536  -9.536
  469    HA   SER  64           HA       SER  64  17.077 -10.069 -10.069
  470   1HB   SER  64           HB2      SER  64  18.818 -11.091 -11.091
  471   2HB   SER  64           HB1      SER  64  17.865 -12.569 -12.569
  472    HG   SER  64           HG       SER  64  19.498 -12.602 -12.602
  473    H    ILE  67           HN       ILE  67  14.259 -11.029 -11.029
  474    HA   ILE  67           HA       ILE  67  13.861 -12.897 -12.897
  475    HB   ILE  67           HB       ILE  67  13.015 -13.376 -13.376
  476   1HG1  ILE  67          HG12      ILE  67  14.798 -14.953 -14.953
  477   2HG1  ILE  67          HG11      ILE  67  15.372 -13.952 -13.952
  478   1HG2  ILE  67          HG22      ILE  67  11.948 -14.380 -14.380
  479   2HG2  ILE  67          HG21      ILE  67  12.393 -15.658 -15.658
  480   3HG2  ILE  67          HG23      ILE  67  11.229 -14.423 -14.423
  481   1HD1  ILE  67          HD11      ILE  67  13.330 -15.824 -15.824
  482   2HD1  ILE  67          HD13      ILE  67  14.715 -16.641 -16.641
  483   3HD1  ILE  67          HD12      ILE  67  14.948 -15.546 -15.546
  484    H    CYS  68           HN       CYS  68  12.280 -10.963 -10.963
  485    HA   CYS  68           HA       CYS  68   9.680 -10.919 -10.919
  486   1HB   CYS  68           HB2      CYS  68   9.320  -9.025  -9.025
  487   2HB   CYS  68           HB1      CYS  68  10.044 -10.447 -10.447
  488    H    THR  69           HN       THR  69   8.849  -9.642  -9.642
  489    HA   THR  69           HA       THR  69  10.397  -7.252  -7.252
  490    HB   THR  69           HB       THR  69  10.739  -9.194  -9.194
  491    HG1  THR  69           HG1      THR  69  10.646  -7.771  -7.771
  492   1HG2  THR  69          HG23      THR  69   8.638 -10.383 -10.383
  493   2HG2  THR  69          HG22      THR  69   7.725  -9.165  -9.165
  494   3HG2  THR  69          HG21      THR  69   8.847 -10.222 -10.222
  495    H    GLY  70           HN       GLY  70   9.044  -5.446  -5.446
  496   1HA   GLY  70           HA2      GLY  70   6.106  -5.936  -5.936
  497   2HA   GLY  70           HA1      GLY  70   6.816  -4.790  -4.790
  498    H    THR  71           HN       THR  71   4.840  -4.170  -4.170
  499    HA   THR  71           HA       THR  71   6.296  -2.220  -2.220
  500    HB   THR  71           HB       THR  71   3.795  -3.764  -3.764
  501    HG1  THR  71           HG1      THR  71   6.356  -4.040  -4.040
  502   1HG2  THR  71          HG21      THR  71   5.146  -1.521  -1.521
  503   2HG2  THR  71          HG23      THR  71   4.746  -2.854  -2.854
  504   3HG2  THR  71          HG22      THR  71   3.476  -2.073  -2.073
  505    H    SER  72           HN       SER  72   4.984  -0.269  -0.269
  506    HA   SER  72           HA       SER  72   2.631   0.128   0.128
  507   1HB   SER  72           HB2      SER  72   5.154   1.810   1.810
  508   2HB   SER  72           HB1      SER  72   3.694   2.173   2.173
  509    HG   SER  72           HG       SER  72   3.972   0.088   0.088
  510    H    SER  73           HN       SER  73   1.080   1.194   1.194
  511    HA   SER  73           HA       SER  73   1.915   3.154   3.154
  512   1HB   SER  73           HB2      SER  73   1.511   0.900   0.900
  513   2HB   SER  73           HB1      SER  73  -0.112   0.912   0.912
  514    HG   SER  73           HG       SER  73   0.854   2.122   2.122
  515    H    GLY  74           HN       GLY  74   0.716   5.015   5.015
  516   1HA   GLY  74           HA2      GLY  74  -0.970   6.490   6.490
  517   2HA   GLY  74           HA1      GLY  74  -2.079   5.126   5.126
  518    H    ASN  75           HN       ASN  75  -3.138   4.772   4.772
  519    HA   ASN  75           HA       ASN  75  -1.737   5.320   5.320
  520   1HB   ASN  75           HB2      ASN  75  -4.658   5.062   5.062
  521   2HB   ASN  75           HB1      ASN  75  -4.094   5.384   5.384
  522   1HD2  ASN  75          HD22      ASN  75  -4.568   8.490   8.490
  523   2HD2  ASN  75          HD21      ASN  75  -5.330   6.984   6.984
  524    H    GLN  76           HN       GLN  76  -1.839   2.739   2.739
  525    HA   GLN  76           HA       GLN  76  -2.660   0.836   0.836
  526   1HB   GLN  76           HB2      GLN  76  -2.762   0.710   0.710
  527   2HB   GLN  76           HB1      GLN  76  -3.049  -0.693  -0.693
  528   1HG   GLN  76           HG2      GLN  76  -4.869   0.542   0.542
  529   2HG   GLN  76           HG1      GLN  76  -4.616   1.899   1.899
  530   1HE2  GLN  76          HE22      GLN  76  -5.628  -0.359  -0.359
  531   2HE2  GLN  76          HE21      GLN  76  -4.184   0.434   0.434
  532    H    VAL  77           HN       VAL  77  -0.932  -0.292  -0.292
  533    HA   VAL  77           HA       VAL  77   1.550  -0.476  -0.476
  534    HB   VAL  77           HB       VAL  77   2.690  -0.575  -0.575
  535   1HG1  VAL  77          HG12      VAL  77   1.085   1.559   1.559
  536   2HG1  VAL  77          HG11      VAL  77   0.621   1.175   1.175
  537   3HG1  VAL  77          HG13      VAL  77   2.308   1.520   1.520
  538   1HG2  VAL  77          HG23      VAL  77   0.141  -1.607  -1.607
  539   2HG2  VAL  77          HG22      VAL  77   1.794  -2.104  -2.104
  540   3HG2  VAL  77          HG21      VAL  77   1.134  -0.641  -0.641
  541    H    ASN  78           HN       ASN  78   1.946  -2.436  -2.436
  542    HA   ASN  78           HA       ASN  78   0.475  -4.828  -4.828
  543   1HB   ASN  78           HB2      ASN  78   0.323  -4.038  -4.038
  544   2HB   ASN  78           HB1      ASN  78   2.051  -4.359  -4.359
  545    HD2  ASN  78          HD22      ASN  78   2.581  -6.770  -6.770
  546    H    LEU  79           HN       LEU  79   1.682  -5.890  -5.890
  547    HA   LEU  79           HA       LEU  79   4.633  -6.165  -6.165
  548   1HB   LEU  79           HB2      LEU  79   2.655  -6.678  -6.678
  549   2HB   LEU  79           HB1      LEU  79   4.334  -7.202  -7.202
  550    HG   LEU  79           HG       LEU  79   3.550  -4.334  -4.334
  551   1HD1  LEU  79          HD11      LEU  79   3.948  -5.785  -5.785
  552   2HD1  LEU  79          HD13      LEU  79   4.313  -4.065  -4.065
  553   3HD1  LEU  79          HD12      LEU  79   2.677  -4.648  -4.648
  554   1HD2  LEU  79          HD21      LEU  79   6.071  -5.876  -5.876
  555   2HD2  LEU  79          HD23      LEU  79   5.786  -4.480  -4.480
  556   3HD2  LEU  79          HD22      LEU  79   5.979  -4.254  -4.254
  557    H    THR  80           HN       THR  80   5.500  -8.107  -8.107
  558    HA   THR  80           HA       THR  80   3.679 -10.492 -10.492
  559    HB   THR  80           HB       THR  80   5.826  -9.638  -9.638
  560    HG1  THR  80           HG1      THR  80   4.235  -8.313  -8.313
  561   1HG2  THR  80          HG23      THR  80   4.203 -12.076 -12.076
  562   2HG2  THR  80          HG22      THR  80   4.175 -11.415 -11.415
  563   3HG2  THR  80          HG21      THR  80   5.712 -11.844 -11.844
  564    H    ILE  81           HN       ILE  81   4.547 -12.406 -12.406
  565    HA   ILE  81           HA       ILE  81   7.399 -12.370 -12.370
  566    HB   ILE  81           HB       ILE  81   4.937 -13.880 -13.880
  567   1HG1  ILE  81          HG12      ILE  81   6.602 -11.825 -11.825
  568   2HG1  ILE  81          HG11      ILE  81   5.157 -11.405 -11.405
  569   1HG2  ILE  81          HG22      ILE  81   6.998 -15.239 -15.239
  570   2HG2  ILE  81          HG21      ILE  81   7.766 -13.906 -13.906
  571   3HG2  ILE  81          HG23      ILE  81   6.377 -14.734 -14.734
  572   1HD1  ILE  81          HD11      ILE  81   4.133 -13.420 -13.420
  573   2HD1  ILE  81          HD13      ILE  81   5.400 -12.923 -12.923
  574   3HD1  ILE  81          HD12      ILE  81   4.168 -11.767 -11.767
  575    H    GLN  82           HN       GLN  82   8.741 -13.846 -13.846
  576    HA   GLN  82           HA       GLN  82   7.453 -16.008 -16.008
  577   1HB   GLN  82           HB2      GLN  82  10.125 -14.603 -14.603
  578   2HB   GLN  82           HB1      GLN  82   9.579 -15.921 -15.921
  579   1HG   GLN  82           HG2      GLN  82   7.690 -14.589 -14.589
  580   2HG   GLN  82           HG1      GLN  82   8.117 -13.285 -13.285
  581   1HE2  GLN  82          HE21      GLN  82  10.543 -12.508 -12.508
  582   2HE2  GLN  82          HE22      GLN  82  11.042 -12.342 -12.342
  583    H    GLY  83           HN       GLY  83   7.635 -17.936 -17.936
  584   1HA   GLY  83           HA2      GLY  83   9.113 -19.806 -19.806
  585   2HA   GLY  83           HA1      GLY  83  10.171 -18.631 -18.631
  586    H    LEU  84           HN       LEU  84   6.646 -19.225 -19.225
  587    HA   LEU  84           HA       LEU  84   6.711 -18.824 -18.824
  588   1HB   LEU  84           HB2      LEU  84   4.596 -19.433 -19.433
  589   2HB   LEU  84           HB1      LEU  84   4.223 -19.270 -19.270
  590    HG   LEU  84           HG       LEU  84   5.714 -17.149 -17.149
  591   1HD1  LEU  84          HD12      LEU  84   3.463 -17.495 -17.495
  592   2HD1  LEU  84          HD11      LEU  84   2.751 -17.308 -17.308
  593   3HD1  LEU  84          HD13      LEU  84   3.574 -15.949 -15.949
  594   1HD2  LEU  84          HD22      LEU  84   4.570 -17.469 -17.469
  595   2HD2  LEU  84          HD21      LEU  84   6.072 -16.694 -16.694
  596   3HD2  LEU  84          HD23      LEU  84   4.533 -15.864 -15.864
  597    H    ARG  85           HN       ARG  85   6.840 -20.416 -20.416
  598    HA   ARG  85           HA       ARG  85   6.504 -23.261 -23.261
  599   1HB   ARG  85           HB2      ARG  85   8.097 -21.950 -21.950
  600   2HB   ARG  85           HB1      ARG  85   8.016 -23.690 -23.690
  601   1HG   ARG  85           HG2      ARG  85   8.732 -22.015 -22.015
  602   2HG   ARG  85           HG1      ARG  85   9.946 -22.139 -22.139
  603   1HD   ARG  85           HD2      ARG  85   8.583 -24.525 -24.525
  604   2HD   ARG  85           HD1      ARG  85  10.208 -23.942 -23.942
  605    HE   ARG  85           HE       ARG  85   9.911 -24.315 -24.315
  606   1HH1  ARG  85          HH21      ARG  85  10.485 -26.009 -26.009
  607   2HH1  ARG  85          HH22      ARG  85  11.328 -27.304 -27.304
  608   1HH2  ARG  85          HH11      ARG  85  11.008 -26.011 -26.011
  609   2HH2  ARG  85          HH12      ARG  85  11.622 -27.307 -27.307
  610    H    ALA  86           HN       ALA  86   5.830 -24.638 -24.638
  611    HA   ALA  86           HA       ALA  86   3.214 -23.880 -23.880
  612   1HB   ALA  86           HB2      ALA  86   4.398 -26.165 -26.165
  613   2HB   ALA  86           HB1      ALA  86   5.147 -25.694 -25.694
  614   3HB   ALA  86           HB3      ALA  86   3.392 -25.855 -25.855
  615    H    MET  87           HN       MET  87   6.350 -23.718 -23.718
  616    HA   MET  87           HA       MET  87   5.447 -22.655 -22.655
  617   1HB   MET  87           HB2      MET  87   8.056 -22.647 -22.647
  618   2HB   MET  87           HB1      MET  87   7.922 -22.053 -22.053
  619   1HG   MET  87           HG2      MET  87   7.124 -24.832 -24.832
  620   2HG   MET  87           HG1      MET  87   8.637 -24.440 -24.440
  621   1HE   MET  87           HE3      MET  87   6.983 -26.609 -26.609
  622   2HE   MET  87           HE2      MET  87   8.212 -26.094 -26.094
  623   3HE   MET  87           HE1      MET  87   6.561 -26.373 -26.373
  624    H    ASP  88           HN       ASP  88   6.394 -21.109 -21.109
  625    HA   ASP  88           HA       ASP  88   6.674 -18.425 -18.425
  626   1HB   ASP  88           HB2      ASP  88   5.870 -19.552 -19.552
  627   2HB   ASP  88           HB1      ASP  88   6.349 -17.878 -17.878
  628    H    THR  89           HN       THR  89   3.820 -20.328 -20.328
  629    HA   THR  89           HA       THR  89   1.889 -18.418 -18.418
  630    HB   THR  89           HB       THR  89   1.638 -20.793 -20.793
  631    HG1  THR  89           HG1      THR  89   1.788 -21.975 -21.975
  632   1HG2  THR  89          HG22      THR  89  -0.287 -19.078 -19.078
  633   2HG2  THR  89          HG21      THR  89  -0.436 -19.768 -19.768
  634   3HG2  THR  89          HG23      THR  89  -0.653 -20.791 -20.791
  635    H    GLY  90           HN       GLY  90   0.814 -16.899 -16.899
  636   1HA   GLY  90           HA2      GLY  90   0.243 -16.768 -16.768
  637   2HA   GLY  90           HA1      GLY  90   1.901 -16.176 -16.176
  638    H    LEU  91           HN       LEU  91   0.870 -14.139 -14.139
  639    HA   LEU  91           HA       LEU  91  -0.764 -12.640 -12.640
  640   1HB   LEU  91           HB2      LEU  91  -1.303 -12.766 -12.766
  641   2HB   LEU  91           HB1      LEU  91   0.234 -11.983 -11.983
  642    HG   LEU  91           HG       LEU  91  -0.576 -10.111 -10.111
  643   1HD1  LEU  91          HD12      LEU  91  -2.478 -11.456 -11.456
  644   2HD1  LEU  91          HD11      LEU  91  -3.229 -11.397 -11.397
  645   3HD1  LEU  91          HD13      LEU  91  -2.992  -9.910  -9.910
  646   1HD2  LEU  91          HD22      LEU  91  -0.523 -10.270 -10.270
  647   2HD2  LEU  91          HD21      LEU  91  -1.342  -8.924  -8.924
  648   3HD2  LEU  91          HD23      LEU  91  -2.278 -10.286 -10.286
  649    H    TYR  92           HN       TYR  92   0.064 -11.126 -11.126
  650    HA   TYR  92           HA       TYR  92   2.811 -10.063 -10.063
  651   1HB   TYR  92           HB2      TYR  92   1.261 -10.621 -10.621
  652   2HB   TYR  92           HB1      TYR  92   2.743  -9.663  -9.663
  653    HD1  TYR  92           HD2      TYR  92   4.905 -10.659 -10.659
  654    HD2  TYR  92           HD1      TYR  92   1.310 -13.042 -13.042
  655    HE1  TYR  92           HE2      TYR  92   6.287 -12.740 -12.740
  656    HE2  TYR  92           HE1      TYR  92   2.690 -15.129 -15.129
  657    HH   TYR  92           HH       TYR  92   5.763 -15.326 -15.326
  658    H    ILE  93           HN       ILE  93   2.973  -7.833  -7.833
  659    HA   ILE  93           HA       ILE  93   0.422  -6.301  -6.301
  660    HB   ILE  93           HB       ILE  93   3.109  -5.831  -5.831
  661   1HG1  ILE  93          HG12      ILE  93   1.595  -6.067  -6.067
  662   2HG1  ILE  93          HG11      ILE  93   0.429  -6.810  -6.810
  663   1HG2  ILE  93          HG21      ILE  93   0.720  -4.092  -4.092
  664   2HG2  ILE  93          HG23      ILE  93   1.414  -4.147  -4.147
  665   3HG2  ILE  93          HG22      ILE  93   2.406  -3.656  -3.656
  666   1HD1  ILE  93          HD13      ILE  93   3.234  -7.808  -7.808
  667   2HD1  ILE  93          HD12      ILE  93   2.283  -8.243  -8.243
  668   3HD1  ILE  93          HD11      ILE  93   1.724  -8.693  -8.693
  669    H    CYS  94           HN       CYS  94   0.110  -4.673  -4.673
  670    HA   CYS  94           HA       CYS  94   2.372  -3.874  -3.874
  671   1HB   CYS  94           HB2      CYS  94   0.556  -2.976  -2.976
  672   2HB   CYS  94           HB1      CYS  94   0.144  -4.626  -4.626
  673    H    LYS  95           HN       LYS  95   3.413  -1.985  -1.985
  674    HA   LYS  95           HA       LYS  95   1.899  -0.044  -0.044
  675   1HB   LYS  95           HB2      LYS  95   4.836  -0.774  -0.774
  676   2HB   LYS  95           HB1      LYS  95   4.133   0.444   0.444
  677   1HG   LYS  95           HG2      LYS  95   2.565  -1.888  -1.888
  678   2HG   LYS  95           HG1      LYS  95   4.245  -2.425  -2.425
  679   1HD   LYS  95           HD2      LYS  95   4.788  -0.818  -0.818
  680   2HD   LYS  95           HD1      LYS  95   3.162  -0.146  -0.146
  681   1HE   LYS  95           HE2      LYS  95   2.178  -2.075  -2.075
  682   2HE   LYS  95           HE1      LYS  95   3.608  -3.062  -3.062
  683   1HZ   LYS  95           HZ3      LYS  95   4.870  -1.593  -1.593
  684   2HZ   LYS  95           HZ2      LYS  95   3.440  -0.756  -0.756
  685   3HZ   LYS  95           HZ1      LYS  95   3.611  -2.389  -2.389
  686    H    VAL  96           HN       VAL  96   2.033   2.153   2.153
  687    HA   VAL  96           HA       VAL  96   3.673   2.791   2.791
  688    HB   VAL  96           HB       VAL  96   0.821   3.693   3.693
  689   1HG1  VAL  96          HG13      VAL  96   2.608   4.784   4.784
  690   2HG1  VAL  96          HG12      VAL  96   2.085   3.460   3.460
  691   3HG1  VAL  96          HG11      VAL  96   0.911   4.633   4.633
  692   1HG2  VAL  96          HG21      VAL  96   1.832   1.270   1.270
  693   2HG2  VAL  96          HG23      VAL  96   0.662   1.302   1.302
  694   3HG2  VAL  96          HG22      VAL  96   0.230   1.964   1.964
  695    H    GLU  97           HN       GLU  97   5.088   4.342   4.342
  696    HA   GLU  97           HA       GLU  97   3.917   6.589   6.589
  697   1HB   GLU  97           HB2      GLU  97   6.550   5.118   5.118
  698   2HB   GLU  97           HB1      GLU  97   6.086   6.556   6.556
  699   1HG   GLU  97           HG2      GLU  97   4.086   5.337   5.337
  700   2HG   GLU  97           HG1      GLU  97   4.596   3.905   3.905
  701    H    LEU  98           HN       LEU  98   4.387   8.563   8.563
  702    HA   LEU  98           HA       LEU  98   6.351   8.801   8.801
  703   1HB   LEU  98           HB2      LEU  98   4.654  10.929  10.929
  704   2HB   LEU  98           HB1      LEU  98   5.336  11.005  11.005
  705    HG   LEU  98           HG       LEU  98   3.270   8.979   8.979
  706   1HD1  LEU  98          HD11      LEU  98   3.002  11.680  11.680
  707   2HD1  LEU  98          HD13      LEU  98   1.827  10.409  10.409
  708   3HD1  LEU  98          HD12      LEU  98   2.071  10.954  10.954
  709   1HD2  LEU  98          HD21      LEU  98   5.007   8.790   8.790
  710   2HD2  LEU  98          HD23      LEU  98   3.381   8.104   8.104
  711   3HD2  LEU  98          HD22      LEU  98   3.693   9.673   9.673
  712    H    MET  99           HN       MET  99   8.096   8.167   8.167
  713    HA   MET  99           HA       MET  99   8.524   9.628   9.628
  714   1HB   MET  99           HB2      MET  99   9.137   7.249   7.249
  715   2HB   MET  99           HB1      MET  99  10.439   7.868   7.868
  716   1HG   MET  99           HG2      MET  99  11.732   8.418   8.418
  717   2HG   MET  99           HG1      MET  99  10.366   9.078   9.078
  718   1HE   MET  99           HE2      MET  99   8.627   7.880   7.880
  719   2HE   MET  99           HE1      MET  99   8.302   6.475   6.475
  720   3HE   MET  99           HE3      MET  99   8.690   6.265   6.265
  721    H    TYR 100           HN       TYR 100  10.298   9.602   9.602
  722    HA   TYR 100           HA       TYR 100  12.260  11.559  11.559
  723   1HB   TYR 100           HB2      TYR 100  11.294  10.526  10.526
  724   2HB   TYR 100           HB1      TYR 100  12.675  11.602  11.602
  725    HD1  TYR 100           HD1      TYR 100  11.363   8.192   8.192
  726    HD2  TYR 100           HD2      TYR 100  14.768  10.854  10.854
  727    HE1  TYR 100           HE1      TYR 100  12.832   6.250   6.250
  728    HE2  TYR 100           HE2      TYR 100  16.236   8.914   8.914
  729    HH   TYR 100           HH       TYR 100  15.728   5.956   5.956
  730    HA   PRO 101           HA       PRO 101   9.739  14.825  14.825
  731   1HB   PRO 101           HB2      PRO 101   7.163  14.330  14.330
  732   2HB   PRO 101           HB1      PRO 101   8.565  13.809  13.809
  733   1HG   PRO 101           HG2      PRO 101   6.811  12.203  12.203
  734   2HG   PRO 101           HG1      PRO 101   7.588  11.767  11.767
  735   1HD   PRO 101           HD2      PRO 101   8.518  11.082  11.082
  736   2HD   PRO 101           HD1      PRO 101   9.472  11.073  11.073
  737    HA   PRO 102           HA       PRO 102   7.473  15.698  15.698
  738   1HB   PRO 102           HB2      PRO 102   7.782  18.540  18.540
  739   2HB   PRO 102           HB1      PRO 102   9.136  17.473  17.473
  740   1HG   PRO 102           HG2      PRO 102   8.763  19.035  19.035
  741   2HG   PRO 102           HG1      PRO 102  10.207  18.239  18.239
  742   1HD   PRO 102           HD2      PRO 102   8.346  17.337  17.337
  743   2HD   PRO 102           HD1      PRO 102   9.924  16.639  16.639
  744    HA   PRO 103           HA       PRO 103   6.515  16.873  16.873
  745   1HB   PRO 103           HB2      PRO 103   5.287  17.390  17.390
  746   2HB   PRO 103           HB1      PRO 103   6.080  18.633  18.633
  747   1HG   PRO 103           HG2      PRO 103   3.489  18.396  18.396
  748   2HG   PRO 103           HG1      PRO 103   4.152  19.432  19.432
  749   1HD   PRO 103           HD2      PRO 103   3.270  16.496  16.496
  750   2HD   PRO 103           HD1      PRO 103   2.621  17.823  17.823
  751    H    TYR 104           HN       TYR 104   5.484  14.659  14.659
  752    HA   TYR 104           HA       TYR 104   4.980  12.459  12.459
  753   1HB   TYR 104           HB2      TYR 104   6.957  12.511  12.511
  754   2HB   TYR 104           HB1      TYR 104   6.061  13.139  13.139
  755    HD1  TYR 104           HD2      TYR 104   4.428  10.655  10.655
  756    HD2  TYR 104           HD1      TYR 104   6.875  11.209  11.209
  757    HE1  TYR 104           HE2      TYR 104   3.865   8.340   8.340
  758    HE2  TYR 104           HE1      TYR 104   6.329   8.878   8.878
  759    HH   TYR 104           HH       TYR 104   5.542   6.776   6.776
  760    H    TYR 105           HN       TYR 105   2.851  11.957  11.957
  761    HA   TYR 105           HA       TYR 105   1.155  12.071  12.071
  762   1HB   TYR 105           HB2      TYR 105   0.882  14.145  14.145
  763   2HB   TYR 105           HB1      TYR 105   0.256  13.012  13.012
  764    HD1  TYR 105           HD2      TYR 105  -1.852  11.901  11.901
  765    HD2  TYR 105           HD1      TYR 105  -0.401  14.584  14.584
  766    HE1  TYR 105           HE2      TYR 105  -4.139  11.942  11.942
  767    HE2  TYR 105           HE1      TYR 105  -2.679  14.635  14.635
  768    HH   TYR 105           HH       TYR 105  -4.929  12.545  12.545
  769    H    LEU 106           HN       LEU 106   0.820   9.802   9.802
  770    HA   LEU 106           HA       LEU 106  -0.770   8.711   8.711
  771   1HB   LEU 106           HB2      LEU 106   2.104   8.378   8.378
  772   2HB   LEU 106           HB1      LEU 106   1.306   6.827   6.827
  773    HG   LEU 106           HG       LEU 106   1.390   8.969   8.969
  774   1HD1  LEU 106          HD11      LEU 106   2.900   7.026   7.026
  775   2HD1  LEU 106          HD13      LEU 106   1.495   5.964   5.964
  776   3HD1  LEU 106          HD12      LEU 106   1.797   7.082   7.082
  777   1HD2  LEU 106          HD22      LEU 106  -0.936   7.157   7.157
  778   2HD2  LEU 106          HD21      LEU 106  -0.907   8.837   8.837
  779   3HD2  LEU 106          HD23      LEU 106  -0.452   7.530   7.530
  780    H    GLY 108           HN       GLY 108  -0.281   5.967   5.967
  781   1HA   GLY 108           HA2      GLY 108  -0.949   5.505   5.505
  782   2HA   GLY 108           HA1      GLY 108  -2.211   5.133   5.133
  783    H    ILE 109           HN       ILE 109  -1.849   2.918   2.918
  784    HA   ILE 109           HA       ILE 109   0.257   1.424   1.424
  785    HB   ILE 109           HB       ILE 109  -0.635   1.233   1.233
  786   1HG1  ILE 109          HG12      ILE 109   0.824   3.152   3.152
  787   2HG1  ILE 109          HG11      ILE 109   1.643   1.939   1.939
  788   1HG2  ILE 109          HG22      ILE 109   1.335  -0.425  -0.425
  789   2HG2  ILE 109          HG21      ILE 109   1.219  -0.412  -0.412
  790   3HG2  ILE 109          HG23      ILE 109  -0.142  -0.971  -0.971
  791   1HD1  ILE 109          HD12      ILE 109   2.101   1.246   1.246
  792   2HD1  ILE 109          HD11      ILE 109   2.407   2.975   2.975
  793   3HD1  ILE 109          HD13      ILE 109   3.271   1.839   1.839
  794    H    GLY 110           HN       GLY 110  -0.300  -0.986  -0.986
  795   1HA   GLY 110           HA2      GLY 110  -3.249  -1.358  -1.358
  796   2HA   GLY 110           HA1      GLY 110  -2.019  -2.334  -2.334
  797    H    ASN 111           HN       ASN 111  -4.281  -2.947  -2.947
  798    HA   ASN 111           HA       ASN 111  -3.154  -3.766  -3.766
  799   1HB   ASN 111           HB2      ASN 111  -5.593  -3.591  -3.591
  800   2HB   ASN 111           HB1      ASN 111  -5.381  -5.159  -5.159
  801    HD2  ASN 111          HD22      ASN 111  -5.630  -3.623  -3.623
  802    H    GLY 112           HN       GLY 112  -3.324  -5.459  -5.459
  803   1HA   GLY 112           HA2      GLY 112  -1.280  -6.910  -6.910
  804   2HA   GLY 112           HA1      GLY 112  -1.653  -7.640  -7.640
  805    H    THR 113           HN       THR 113  -1.466  -8.733  -8.733
  806    HA   THR 113           HA       THR 113  -4.218  -9.907  -9.907
  807    HB   THR 113           HB       THR 113  -1.882  -9.599  -9.599
  808    HG1  THR 113           HG1      THR 113  -4.371  -8.260  -8.260
  809   1HG2  THR 113          HG21      THR 113  -4.639 -10.798 -10.798
  810   2HG2  THR 113          HG23      THR 113  -3.725 -10.211 -10.211
  811   3HG2  THR 113          HG22      THR 113  -3.080 -11.532 -11.532
  812    H    GLN 114           HN       GLN 114  -4.324 -12.184 -12.184
  813    HA   GLN 114           HA       GLN 114  -1.783 -13.538 -13.538
  814   1HB   GLN 114           HB2      GLN 114  -3.855 -13.877 -13.877
  815   2HB   GLN 114           HB1      GLN 114  -4.629 -14.608 -14.608
  816   1HG   GLN 114           HG2      GLN 114  -3.406 -16.532 -16.532
  817   2HG   GLN 114           HG1      GLN 114  -1.971 -15.703 -15.703
  818   1HE2  GLN 114          HE22      GLN 114  -2.766 -17.185 -17.185
  819   2HE2  GLN 114          HE21      GLN 114  -1.701 -17.184 -17.184
  820    H    ILE 115           HN       ILE 115  -0.621 -14.636 -14.636
  821    HA   ILE 115           HA       ILE 115  -1.890 -15.135 -15.135
  822    HB   ILE 115           HB       ILE 115   0.945 -15.458 -15.458
  823   1HG1  ILE 115          HG12      ILE 115  -0.269 -13.420 -13.420
  824   2HG1  ILE 115          HG11      ILE 115   0.071 -13.122 -13.122
  825   1HG2  ILE 115          HG22      ILE 115  -0.197 -15.809 -15.809
  826   2HG2  ILE 115          HG21      ILE 115   1.525 -15.623 -15.623
  827   3HG2  ILE 115          HG23      ILE 115   0.651 -17.018 -17.018
  828   1HD1  ILE 115          HD12      ILE 115   2.490 -13.928 -13.928
  829   2HD1  ILE 115          HD11      ILE 115   1.996 -13.537 -13.537
  830   3HD1  ILE 115          HD13      ILE 115   1.998 -12.282 -12.282
  831    H    TYR 116           HN       TYR 116  -2.637 -17.183 -17.183
  832    HA   TYR 116           HA       TYR 116  -2.215 -19.388 -19.388
  833   1HB   TYR 116           HB2      TYR 116  -4.180 -18.786 -18.786
  834   2HB   TYR 116           HB1      TYR 116  -4.092 -20.386 -20.386
  835    HD1  TYR 116           HD1      TYR 116  -3.338 -19.004 -19.004
  836    HD2  TYR 116           HD2      TYR 116  -6.573 -18.595 -18.595
  837    HE1  TYR 116           HE1      TYR 116  -4.883 -18.298 -18.298
  838    HE2  TYR 116           HE2      TYR 116  -8.103 -17.923 -17.923
  839    HH   TYR 116           HH       TYR 116  -7.779 -18.497 -18.497
  840    H    VAL 117           HN       VAL 117  -1.243 -21.295 -21.295
  841    HA   VAL 117           HA       VAL 117   0.082 -21.478 -21.478
  842    HB   VAL 117           HB       VAL 117   1.425 -21.833 -21.833
  843   1HG1  VAL 117          HG12      VAL 117  -0.693 -23.915 -23.915
  844   2HG1  VAL 117          HG11      VAL 117   0.905 -24.000 -24.000
  845   3HG1  VAL 117          HG13      VAL 117  -0.136 -22.612 -22.612
  846   1HG2  VAL 117          HG23      VAL 117   1.893 -23.145 -23.145
  847   2HG2  VAL 117          HG22      VAL 117   2.433 -23.955 -23.955
  848   3HG2  VAL 117          HG21      VAL 117   0.947 -24.473 -24.473
  849    H    ILE 118           HN       ILE 118  -0.034 -23.761 -23.761
  850    HA   ILE 118           HA       ILE 118  -2.868 -24.644 -24.644
  851    HB   ILE 118           HB       ILE 118  -0.527 -25.161 -25.161
  852   1HG1  ILE 118          HG12      ILE 118  -1.100 -22.819 -22.819
  853   2HG1  ILE 118          HG11      ILE 118  -1.715 -23.558 -23.558
  854   1HG2  ILE 118          HG23      ILE 118  -3.452 -25.865 -25.865
  855   2HG2  ILE 118          HG22      ILE 118  -2.433 -25.759 -25.759
  856   3HG2  ILE 118          HG21      ILE 118  -2.062 -26.936 -26.936
  857   1HD1  ILE 118          HD12      ILE 118  -3.834 -23.919 -23.919
  858   2HD1  ILE 118          HD11      ILE 118  -3.188 -22.411 -22.411
  859   3HD1  ILE 118          HD13      ILE 118  -3.654 -22.514 -22.514
  860    H    ASP 119           HN       ASP 119  -3.353 -26.409 -26.409
  861    HA   ASP 119           HA       ASP 119  -1.367 -28.639 -28.639
  862   1HB   ASP 119           HB2      ASP 119  -1.330 -27.158 -27.158
  863   2HB   ASP 119           HB1      ASP 119  -3.051 -27.461 -27.461
  864    HA   PRO 120           HA       PRO 120  -5.146 -30.725 -30.725
  865   1HB   PRO 120           HB2      PRO 120  -4.190 -33.291 -33.291
  866   2HB   PRO 120           HB1      PRO 120  -3.847 -32.168 -32.168
  867   1HG   PRO 120           HG2      PRO 120  -2.145 -32.915 -32.915
  868   2HG   PRO 120           HG1      PRO 120  -1.692 -32.671 -32.671
  869   1HD   PRO 120           HD2      PRO 120  -1.256 -30.806 -30.806
  870   2HD   PRO 120           HD1      PRO 120  -1.584 -30.386 -30.386
  871    H    GLU 121           HN       GLU 121  -6.687 -32.235 -32.235
  872    HA   GLU 121           HA       GLU 121  -6.277 -32.437 -32.437
  873   1HB   GLU 121           HB2      GLU 121  -8.752 -32.303 -32.303
  874   2HB   GLU 121           HB1      GLU 121  -8.787 -32.458 -32.458
  875   1HG   GLU 121           HG2      GLU 121  -7.459 -30.183 -30.183
  876   2HG   GLU 121           HG1      GLU 121  -9.051 -30.095 -30.095
  877    HA   PRO 122           HA       PRO 122  -6.242 -36.842 -36.842
  878   1HB   PRO 122           HB2      PRO 122  -7.063 -37.603 -37.603
  879   2HB   PRO 122           HB1      PRO 122  -5.428 -37.004 -37.004
  880   1HG   PRO 122           HG2      PRO 122  -7.764 -35.556 -35.556
  881   2HG   PRO 122           HG1      PRO 122  -6.055 -35.488 -35.488
  882   1HD   PRO 122           HD2      PRO 122  -7.227 -33.573 -33.573
  883   2HD   PRO 122           HD1      PRO 122  -5.516 -34.022 -34.022
  884    H    CYS 123           HN       CYS 123  -9.117 -35.087 -35.087
  885    HA   CYS 123           HA       CYS 123 -10.787 -37.378 -37.378
  886   1HB   CYS 123           HB2      CYS 123 -11.263 -35.435 -35.435
  887   2HB   CYS 123           HB1      CYS 123 -12.449 -36.612 -36.612
  888    HG   CYS 123           HG       CYS 123 -10.693 -38.514 -38.514
  889    HA   PRO 124           HA       PRO 124 -12.268 -34.266 -34.266
  890   1HB   PRO 124           HB2      PRO 124 -14.575 -35.486 -35.486
  891   2HB   PRO 124           HB1      PRO 124 -12.963 -35.973 -35.973
  892   1HG   PRO 124           HG2      PRO 124 -14.683 -37.204 -37.204
  893   2HG   PRO 124           HG1      PRO 124 -13.681 -37.981 -37.981
  894   1HD   PRO 124           HD2      PRO 124 -12.906 -37.752 -37.752
  895   2HD   PRO 124           HD1      PRO 124 -11.755 -37.763 -37.763
  896    H    ASP 125           HN       ASP 125 -14.086 -35.410 -35.410
  897    HA   ASP 125           HA       ASP 125 -15.455 -32.784 -32.784
  898   1HB   ASP 125           HB2      ASP 125 -17.645 -33.891 -33.891
  899   2HB   ASP 125           HB1      ASP 125 -16.914 -34.295 -34.295
  900    H    SER 126           HN       SER 126 -16.766 -32.778 -32.778
  901    HA   SER 126           HA       SER 126 -14.933 -33.498 -33.498
  902   1HB   SER 126           HB2      SER 126 -16.642 -32.379 -32.379
  903   2HB   SER 126           HB1      SER 126 -16.337 -31.443 -31.443
  904    HG   SER 126           HG       SER 126 -18.634 -32.157 -32.157
  905    H    ASP 127           HN       ASP 127 -15.677 -34.791 -34.791
  906    HA   ASP 127           HA       ASP 127 -16.571 -37.415 -37.415
  907   1HB   ASP 127           HB2      ASP 127 -15.157 -36.680 -36.680
  908   2HB   ASP 127           HB1      ASP 127 -16.633 -36.083 -36.083
  909    H    GLN 128           HN       GLN 128 -18.611 -38.320 -38.320
  910    HA   GLN 128           HA       GLN 128 -20.954 -36.639 -36.639
  911   1HB   GLN 128           HB2      GLN 128 -20.561 -39.641 -39.641
  912   2HB   GLN 128           HB1      GLN 128 -22.099 -38.864 -38.864
  913   1HG   GLN 128           HG2      GLN 128 -21.138 -37.870 -37.870
  914   2HG   GLN 128           HG1      GLN 128 -19.554 -38.537 -38.537
  915   1HE2  GLN 128          HE22      GLN 128 -22.122 -40.814 -40.814
  916   2HE2  GLN 128          HE21      GLN 128 -22.304 -39.138 -39.138
  917    H    GLU 129           HN       GLU 129 -19.539 -38.742 -38.742
  918    HA   GLU 129           HA       GLU 129 -21.719 -37.933 -37.933
  919   1HB   GLU 129           HB2      GLU 129 -21.347 -40.349 -40.349
  920   2HB   GLU 129           HB1      GLU 129 -19.693 -40.191 -40.191
  921   1HG   GLU 129           HG2      GLU 129 -20.507 -39.548 -39.548
  922   2HG   GLU 129           HG1      GLU 129 -22.174 -39.587 -39.587
  923    HA   PRO 130           HA       PRO 130 -18.529 -35.417 -35.417
  924   1HB   PRO 130           HB2      PRO 130 -19.902 -34.710 -34.710
  925   2HB   PRO 130           HB1      PRO 130 -20.190 -33.959 -33.959
  926   1HG   PRO 130           HG2      PRO 130 -21.730 -36.099 -36.099
  927   2HG   PRO 130           HG1      PRO 130 -22.315 -34.719 -34.719
  928   1HD   PRO 130           HD2      PRO 130 -22.198 -37.238 -37.238
  929   2HD   PRO 130           HD1      PRO 130 -22.009 -35.788 -35.788
  930    H    LYS 131           HN       LYS 131 -17.172 -35.539 -35.539
  931    HA   LYS 131           HA       LYS 131 -17.528 -38.031 -38.031
  932   1HB   LYS 131           HB2      LYS 131 -15.074 -37.041 -37.041
  933   2HB   LYS 131           HB1      LYS 131 -15.045 -38.363 -38.363
  934   1HG   LYS 131           HG2      LYS 131 -16.749 -39.564 -39.564
  935   2HG   LYS 131           HG1      LYS 131 -16.660 -38.271 -38.271
  936   1HD   LYS 131           HD2      LYS 131 -14.290 -38.731 -38.731
  937   2HD   LYS 131           HD1      LYS 131 -14.304 -39.959 -39.959
  938   1HE   LYS 131           HE2      LYS 131 -15.880 -41.325 -41.325
  939   2HE   LYS 131           HE1      LYS 131 -15.977 -40.070 -40.070
  940   1HZ   LYS 131           HZ3      LYS 131 -13.571 -40.243 -40.243
  941   2HZ   LYS 131           HZ2      LYS 131 -13.512 -41.493 -41.493
  942   3HZ   LYS 131           HZ1      LYS 131 -14.333 -41.724 -41.724
  943    H1   NAG 132           H1       NAG 132  -3.823  -5.827  -5.827
  944    H2   NAG 132           H2       NAG 132  -4.036  -2.900  -2.900
  945    H3   NAG 132           H3       NAG 132  -1.964  -5.008  -5.008
  946    H4   NAG 132           H4       NAG 132  -4.244  -3.837  -3.837
  947    H5   NAG 132           H5       NAG 132  -3.962  -6.672  -6.672
  948   1H6   NAG 132           H61      NAG 132  -5.136  -6.974  -6.974
  949   2H6   NAG 132           H62      NAG 132  -5.850  -5.353  -5.353
  950   1H8   NAG 132           H81      NAG 132  -0.824  -1.021  -1.021
  951   2H8   NAG 132           H82      NAG 132   0.034  -2.271  -2.271
  952   3H8   NAG 132           H83      NAG 132  -0.906  -2.734  -2.734
  953    HN2  NAG 132           HN2      NAG 132  -2.146  -4.235  -4.235
  954    HO3  NAG 132           HO3      NAG 132  -2.543  -2.361  -2.361
  955    H1   NAG 133           H1       NAG 133  -4.383  -4.734  -4.734
  956    H2   NAG 133           H2       NAG 133  -1.668  -5.798  -5.798
  957    H3   NAG 133           H3       NAG 133  -4.209  -5.248  -5.248
  958    H4   NAG 133           H4       NAG 133  -1.589  -3.672  -3.672
  959    H5   NAG 133           H5       NAG 133  -4.297  -2.812  -2.812
  960   1H6   NAG 133           H61      NAG 133  -1.705  -1.425  -1.425
  961   2H6   NAG 133           H62      NAG 133  -2.518  -1.182  -1.182
  962   1H8   NAG 133           H81      NAG 133  -5.065  -7.590  -7.590
  963   2H8   NAG 133           H82      NAG 133  -5.572  -7.991  -7.991
  964   3H8   NAG 133           H83      NAG 133  -4.929  -9.273  -9.273
  965    HN2  NAG 133           HN2      NAG 133  -3.613  -7.274  -7.274
  966    HO3  NAG 133           HO3      NAG 133  -3.000  -5.948  -5.948
  967    HO6  NAG 133           HO6      NAG 133  -3.316  -0.406  -0.406
  968    H1   FUC 134           H1       FUC 134  -7.686  -7.135  -7.135
  969    H2   FUC 134           H2       FUC 134  -6.696  -7.613  -7.613
  970    H3   FUC 134           H3       FUC 134  -8.708  -9.759  -9.759
  971    H4   FUC 134           H4       FUC 134  -6.770 -11.367 -11.367
  972    H5   FUC 134           H5       FUC 134  -6.894 -10.567 -10.567
  973   1H6   FUC 134           H61      FUC 134  -4.862 -11.333 -11.333
  974   2H6   FUC 134           H62      FUC 134  -4.788 -11.821 -11.821
  975   3H6   FUC 134           H63      FUC 134  -4.017 -10.295 -10.295
  976    HO2  FUC 134           HO2      FUC 134  -8.915  -7.220  -7.220
  977    HO3  FUC 134           HO3      FUC 134  -8.985  -9.578  -9.578
  978    HO4  FUC 134           HO4      FUC 134  -5.117 -10.706 -10.706
  979    H1   MAN 135           H1       MAN 135  -1.458  -3.786  -3.786
  980    H2   MAN 135           H2       MAN 135  -1.230  -1.389  -1.389
  981    H3   MAN 135           H3       MAN 135   0.043  -2.040  -2.040
  982    H4   MAN 135           H4       MAN 135  -2.394  -1.319  -1.319
  983    H5   MAN 135           H5       MAN 135  -1.227  -4.097  -4.097
  984   1H6   MAN 135           H61      MAN 135  -3.382  -4.823  -4.823
  985   2H6   MAN 135           H62      MAN 135  -2.148  -4.159  -4.159
  986    HO2  MAN 135           HO2      MAN 135  -2.608   0.139   0.139
  987    HO3  MAN 135           HO3      MAN 135   0.038   0.018   0.018
  988    HO4  MAN 135           HO4      MAN 135   0.109  -2.536  -2.536
  989    HO6  MAN 135           HO6      MAN 135  -3.492  -2.593  -2.593
  990    H1   NAG 136           H1       NAG 136   1.842  -8.301  -8.301
  991    H2   NAG 136           H2       NAG 136  -0.597  -6.686  -6.686
  992    H3   NAG 136           H3       NAG 136  -0.513  -9.369  -9.369
  993    H4   NAG 136           H4       NAG 136  -0.460  -6.510  -6.510
  994    H5   NAG 136           H5       NAG 136   1.942  -8.119  -8.119
  995   1H6   NAG 136           H61      NAG 136   1.245  -6.396  -6.396
  996   2H6   NAG 136           H62      NAG 136   1.559  -5.244  -5.244
  997   1H8   NAG 136           H81      NAG 136  -2.596  -7.067  -7.067
  998   2H8   NAG 136           H82      NAG 136  -3.827  -8.347  -8.347
  999   3H8   NAG 136           H83      NAG 136  -3.170  -8.017  -8.017
 1000    HN2  NAG 136           HN2      NAG 136   0.097  -8.893  -8.893
 1001    HO3  NAG 136           HO3      NAG 136  -2.447  -9.083  -9.083
 1002    H1   NAG 137           H1       NAG 137   1.467  -8.381  -8.381
 1003    H2   NAG 137           H2       NAG 137  -0.512 -10.692 -10.692
 1004    H3   NAG 137           H3       NAG 137   2.551 -10.743 -10.743
 1005    H4   NAG 137           H4       NAG 137   0.442 -11.046 -11.046
 1006    H5   NAG 137           H5       NAG 137   2.296  -8.655  -8.655
 1007   1H6   NAG 137           H61      NAG 137   1.901  -8.816  -8.816
 1008   2H6   NAG 137           H62      NAG 137   0.802  -7.576  -7.576
 1009   1H8   NAG 137           H81      NAG 137   2.672 -12.136 -12.136
 1010   2H8   NAG 137           H82      NAG 137   1.648 -12.687 -12.687
 1011   3H8   NAG 137           H83      NAG 137   1.720 -13.643 -13.643
 1012    HN2  NAG 137           HN2      NAG 137   1.190  -9.958  -9.958
 1013    HO3  NAG 137           HO3      NAG 137   0.569 -12.717 -12.717
 1014    HO6  NAG 137           HO6      NAG 137  -0.582  -8.789  -8.789
 1015    H1   FUC 138           H1       FUC 138   3.652  -6.634  -6.634
 1016    H2   FUC 138           H2       FUC 138   6.084  -5.077  -5.077
 1017    H3   FUC 138           H3       FUC 138   5.091  -5.657  -5.657
 1018    H4   FUC 138           H4       FUC 138   4.876  -3.006  -3.006
 1019    H5   FUC 138           H5       FUC 138   2.741  -4.097  -4.097
 1020   1H6   FUC 138           H61      FUC 138   2.365  -2.373  -2.373
 1021   2H6   FUC 138           H62      FUC 138   2.432  -1.856  -1.856
 1022   3H6   FUC 138           H63      FUC 138   3.854  -1.621  -1.621
 1023    HO2  FUC 138           HO2      FUC 138   6.791  -7.167  -7.167
 1024    HO3  FUC 138           HO3      FUC 138   7.140  -5.572  -5.572
 1025    HO4  FUC 138           HO4      FUC 138   5.691  -1.876  -1.876
 1026    H1   MAN 139           H1       MAN 139   1.620 -12.955 -12.955
 1027    H2   MAN 139           H2       MAN 139   0.917 -11.880 -11.880
 1028    H3   MAN 139           H3       MAN 139   1.091 -14.294 -14.294
 1029    H4   MAN 139           H4       MAN 139   4.005 -13.932 -13.932
 1030    H5   MAN 139           H5       MAN 139   2.873 -14.990 -14.990
 1031   1H6   MAN 139           H61      MAN 139   5.158 -14.992 -14.992
 1032   2H6   MAN 139           H62      MAN 139   4.964 -16.041 -16.041
 1033    HO2  MAN 139           HO2      MAN 139   2.641 -10.568 -10.568
 1034    HO3  MAN 139           HO3      MAN 139   0.943 -14.200 -14.200
 1035    HO4  MAN 139           HO4      MAN 139   2.687 -16.294 -16.294
 1036    HO6  MAN 139           HO6      MAN 139   6.205 -13.490 -13.490

  Start of MODEL   20
    1   1H    ALA   1           HT1      ALA   1  -8.114  11.736  11.736
    2   2H    ALA   1           HT3      ALA   1  -9.436  12.541  12.541
    3   3H    ALA   1           HT2      ALA   1  -9.376  12.302  12.302
    4    HA   ALA   1           HA       ALA   1 -10.917  10.731  10.731
    5   1HB   ALA   1           HB3      ALA   1  -8.380  10.133  10.133
    6   2HB   ALA   1           HB2      ALA   1  -9.788   9.070   9.070
    7   3HB   ALA   1           HB1      ALA   1  -9.915  10.715  10.715
    8    H    MET   1           HN       MET   1  -7.475   9.875   9.875
    9    HA   MET   1           HA       MET   1  -6.490   8.351   8.351
   10   1HB   MET   1           HB2      MET   1  -8.944   9.275   9.275
   11   2HB   MET   1           HB1      MET   1  -7.583   8.423   8.423
   12   1HG   MET   1           HG2      MET   1  -6.062  10.222  10.222
   13   2HG   MET   1           HG1      MET   1  -7.381  11.060  11.060
   14   1HE   MET   1           HE1      MET   1  -5.794   9.742   9.742
   15   2HE   MET   1           HE3      MET   1  -6.460  10.591  10.591
   16   3HE   MET   1           HE2      MET   1  -7.328   9.229   9.229
   17    H    HIS   2           HN       HIS   2  -8.239   7.181   7.181
   18    HA   HIS   2           HA       HIS   2  -9.523   4.934   4.934
   19   1HB   HIS   2           HB2      HIS   2  -9.883   6.022   6.022
   20   2HB   HIS   2           HB1      HIS   2 -10.760   4.637   4.637
   21    HD1  HIS   2           HD1      HIS   2 -11.734   5.415   5.415
   22    HD2  HIS   2           HD2      HIS   2 -11.513   8.230   8.230
   23    HE1  HIS   2           HE1      HIS   2 -13.320   7.286   7.286
   24    H    VAL   3           HN       VAL   3  -8.559   2.949   2.949
   25    HA   VAL   3           HA       VAL   3  -6.580   2.495   2.495
   26    HB   VAL   3           HB       VAL   3  -6.497   1.681   1.681
   27   1HG1  VAL   3          HG11      VAL   3  -4.679   1.075   1.075
   28   2HG1  VAL   3          HG13      VAL   3  -4.107   1.010   1.010
   29   3HG1  VAL   3          HG12      VAL   3  -5.406  -0.059  -0.059
   30   1HG2  VAL   3          HG21      VAL   3  -4.947   3.705   3.705
   31   2HG2  VAL   3          HG23      VAL   3  -5.983   4.026   4.026
   32   3HG2  VAL   3          HG22      VAL   3  -4.453   3.177   3.177
   33    H    ALA   4           HN       ALA   4  -6.957   0.648   0.648
   34    HA   ALA   4           HA       ALA   4  -8.982  -1.302  -1.302
   35   1HB   ALA   4           HB2      ALA   4  -8.172  -0.311  -0.311
   36   2HB   ALA   4           HB1      ALA   4  -9.086  -1.808  -1.808
   37   3HB   ALA   4           HB3      ALA   4  -9.770  -0.280  -0.280
   38    H    GLN   5           HN       GLN   5  -8.269  -3.395  -3.395
   39    HA   GLN   5           HA       GLN   5  -5.700  -4.231  -4.231
   40   1HB   GLN   5           HB2      GLN   5  -6.507  -4.527  -4.527
   41   2HB   GLN   5           HB1      GLN   5  -5.023  -5.160  -5.160
   42   1HG   GLN   5           HG2      GLN   5  -5.820  -2.240  -2.240
   43   2HG   GLN   5           HG1      GLN   5  -4.618  -3.006  -3.006
   44   1HE2  GLN   5          HE22      GLN   5  -3.215  -1.444  -1.444
   45   2HE2  GLN   5          HE21      GLN   5  -4.480  -0.880  -0.880
   46    HA   PRO   6           HA       PRO   6  -7.987  -7.982  -7.982
   47   1HB   PRO   6           HB2      PRO   6  -5.905  -9.728  -9.728
   48   2HB   PRO   6           HB1      PRO   6  -6.373  -8.553  -8.553
   49   1HG   PRO   6           HG2      PRO   6  -4.158  -8.424  -8.424
   50   2HG   PRO   6           HG1      PRO   6  -4.181  -7.928  -7.928
   51   1HD   PRO   6           HD2      PRO   6  -4.388  -6.167  -6.167
   52   2HD   PRO   6           HD1      PRO   6  -5.136  -5.895  -5.895
   53    H    ALA   7           HN       ALA   7  -8.561  -9.902  -9.902
   54    HA   ALA   7           HA       ALA   7  -7.327 -10.049 -10.049
   55   1HB   ALA   7           HB3      ALA   7  -9.662  -9.230  -9.230
   56   2HB   ALA   7           HB2      ALA   7 -10.128 -10.696 -10.696
   57   3HB   ALA   7           HB1      ALA   7  -9.588 -10.794 -10.794
   58    H    VAL   8           HN       VAL   8  -7.816 -11.800 -11.800
   59    HA   VAL   8           HA       VAL   8  -6.859 -14.241 -14.241
   60    HB   VAL   8           HB       VAL   8  -9.475 -14.028 -14.028
   61   1HG1  VAL   8          HG12      VAL   8  -8.919 -13.288 -13.288
   62   2HG1  VAL   8          HG11      VAL   8  -8.319 -14.945 -14.945
   63   3HG1  VAL   8          HG13      VAL   8 -10.040 -14.659 -14.659
   64   1HG2  VAL   8          HG21      VAL   8  -8.579 -16.202 -16.202
   65   2HG2  VAL   8          HG23      VAL   8  -9.748 -16.394 -16.394
   66   3HG2  VAL   8          HG22      VAL   8  -8.028 -16.534 -16.534
   67    H    VAL   9           HN       VAL   9  -5.117 -15.137 -15.137
   68    HA   VAL   9           HA       VAL   9  -5.042 -14.126 -14.126
   69    HB   VAL   9           HB       VAL   9  -3.016 -13.766 -13.766
   70   1HG1  VAL   9          HG12      VAL   9  -2.422 -13.793 -13.793
   71   2HG1  VAL   9          HG11      VAL   9  -1.340 -13.123 -13.123
   72   3HG1  VAL   9          HG13      VAL   9  -1.700 -14.850 -14.850
   73   1HG2  VAL   9          HG21      VAL   9  -4.720 -12.038 -12.038
   74   2HG2  VAL   9          HG23      VAL   9  -3.040 -11.502 -11.502
   75   3HG2  VAL   9          HG22      VAL   9  -3.875 -11.980 -11.980
   76    H    LEU  10           HN       LEU  10  -4.097 -15.541 -15.541
   77    HA   LEU  10           HA       LEU  10  -3.460 -18.269 -18.269
   78   1HB   LEU  10           HB2      LEU  10  -4.573 -17.415 -17.415
   79   2HB   LEU  10           HB1      LEU  10  -4.383 -19.075 -19.075
   80    HG   LEU  10           HG       LEU  10  -6.183 -16.966 -16.966
   81   1HD1  LEU  10          HD12      LEU  10  -6.993 -17.892 -17.892
   82   2HD1  LEU  10          HD11      LEU  10  -6.835 -19.523 -19.523
   83   3HD1  LEU  10          HD13      LEU  10  -8.006 -18.404 -18.404
   84   1HD2  LEU  10          HD23      LEU  10  -5.076 -19.420 -19.420
   85   2HD2  LEU  10          HD22      LEU  10  -6.101 -18.221 -18.221
   86   3HD2  LEU  10          HD21      LEU  10  -6.831 -19.544 -19.544
   87    H    ALA  11           HN       ALA  11  -1.656 -19.375 -19.375
   88    HA   ALA  11           HA       ALA  11   0.276 -17.656 -17.656
   89   1HB   ALA  11           HB3      ALA  11   0.531 -19.894 -19.894
   90   2HB   ALA  11           HB2      ALA  11   1.906 -19.373 -19.373
   91   3HB   ALA  11           HB1      ALA  11   1.127 -18.239 -18.239
   92    H    SER  12           HN       SER  12   1.999 -19.465 -19.465
   93    HA   SER  12           HA       SER  12   0.340 -21.310 -21.310
   94   1HB   SER  12           HB2      SER  12   1.150 -19.241 -19.241
   95   2HB   SER  12           HB1      SER  12   2.804 -19.691 -19.691
   96    HG   SER  12           HG       SER  12   1.038 -20.773 -20.773
   97    H    SER  13           HN       SER  13   1.849 -23.042 -23.042
   98    HA   SER  13           HA       SER  13   3.099 -24.619 -24.619
   99   1HB   SER  13           HB2      SER  13   2.198 -25.406 -25.406
  100   2HB   SER  13           HB1      SER  13   3.539 -24.608 -24.608
  101    HG   SER  13           HG       SER  13   4.056 -26.765 -26.765
  102    H    ARG  14           HN       ARG  14   4.469 -22.364 -22.364
  103    HA   ARG  14           HA       ARG  14   7.245 -22.808 -22.808
  104   1HB   ARG  14           HB2      ARG  14   5.609 -20.408 -20.408
  105   2HB   ARG  14           HB1      ARG  14   7.373 -20.397 -20.397
  106   1HG   ARG  14           HG2      ARG  14   5.871 -22.598 -22.598
  107   2HG   ARG  14           HG1      ARG  14   6.156 -21.053 -21.053
  108   1HD   ARG  14           HD2      ARG  14   8.611 -21.311 -21.311
  109   2HD   ARG  14           HD1      ARG  14   8.260 -22.943 -22.943
  110    HE   ARG  14           HE       ARG  14   7.846 -23.644 -23.644
  111   1HH1  ARG  14          HH21      ARG  14   7.918 -20.149 -20.149
  112   2HH1  ARG  14          HH22      ARG  14   7.893 -19.964 -19.964
  113   1HH2  ARG  14          HH11      ARG  14   7.811 -23.353 -23.353
  114   2HH2  ARG  14          HH12      ARG  14   7.832 -21.754 -21.754
  115    H    GLY  15           HN       GLY  15   4.803 -21.011 -21.011
  116   1HA   GLY  15           HA2      GLY  15   5.035 -20.488 -20.488
  117   2HA   GLY  15           HA1      GLY  15   6.790 -20.456 -20.456
  118    H    ILE  16           HN       ILE  16   4.675 -18.928 -18.928
  119    HA   ILE  16           HA       ILE  16   5.824 -16.290 -16.290
  120    HB   ILE  16           HB       ILE  16   4.503 -17.557 -17.557
  121   1HG1  ILE  16          HG12      ILE  16   6.530 -16.985 -16.985
  122   2HG1  ILE  16          HG11      ILE  16   7.044 -15.915 -15.915
  123   1HG2  ILE  16          HG21      ILE  16   4.629 -14.664 -14.664
  124   2HG2  ILE  16          HG23      ILE  16   5.020 -15.092 -15.092
  125   3HG2  ILE  16          HG22      ILE  16   3.451 -15.528 -15.528
  126   1HD1  ILE  16          HD11      ILE  16   6.662 -18.861 -18.861
  127   2HD1  ILE  16          HD13      ILE  16   8.159 -18.256 -18.256
  128   3HD1  ILE  16          HD12      ILE  16   7.656 -17.699 -17.699
  129    H    ALA  17           HN       ALA  17   4.536 -15.564 -15.564
  130    HA   ALA  17           HA       ALA  17   1.564 -15.598 -15.598
  131   1HB   ALA  17           HB3      ALA  17   2.717 -16.552 -16.552
  132   2HB   ALA  17           HB2      ALA  17   3.218 -14.904 -14.904
  133   3HB   ALA  17           HB1      ALA  17   1.504 -15.314 -15.314
  134    H    SER  18           HN       SER  18   0.624 -13.689 -13.689
  135    HA   SER  18           HA       SER  18   2.066 -11.144 -11.144
  136   1HB   SER  18           HB2      SER  18   1.538 -10.395 -10.395
  137   2HB   SER  18           HB1      SER  18   2.449 -11.900 -11.900
  138    HG   SER  18           HG       SER  18   0.795 -12.397 -12.397
  139    H    PHE  19           HN       PHE  19   0.733  -9.363  -9.363
  140    HA   PHE  19           HA       PHE  19  -2.186  -9.553  -9.553
  141   1HB   PHE  19           HB2      PHE  19  -2.522  -9.135  -9.135
  142   2HB   PHE  19           HB1      PHE  19  -1.828 -10.711 -10.711
  143    HD1  PHE  19           HD2      PHE  19   0.640 -11.108 -11.108
  144    HD2  PHE  19           HD1      PHE  19  -1.308  -7.461  -7.461
  145    HE1  PHE  19           HE2      PHE  19   2.587 -10.596 -10.596
  146    HE2  PHE  19           HE1      PHE  19   0.641  -6.951  -6.951
  147    HZ   PHE  19           HZ       PHE  19   2.588  -8.522  -8.522
  148    H    VAL  20           HN       VAL  20  -3.186  -7.403  -7.403
  149    HA   VAL  20           HA       VAL  20  -1.168  -5.225  -5.225
  150    HB   VAL  20           HB       VAL  20  -3.989  -5.492  -5.492
  151   1HG1  VAL  20          HG13      VAL  20  -1.910  -3.329  -3.329
  152   2HG1  VAL  20          HG12      VAL  20  -3.453  -3.440  -3.440
  153   3HG1  VAL  20          HG11      VAL  20  -3.423  -3.141  -3.141
  154   1HG2  VAL  20          HG21      VAL  20  -2.191  -6.934  -6.934
  155   2HG2  VAL  20          HG23      VAL  20  -2.970  -5.806  -5.806
  156   3HG2  VAL  20          HG22      VAL  20  -1.368  -5.444  -5.444
  157    H    CYS  21           HN       CYS  21  -1.053  -3.803  -3.803
  158    HA   CYS  21           HA       CYS  21  -3.325  -3.537  -3.537
  159   1HB   CYS  21           HB2      CYS  21  -1.032  -4.189  -4.189
  160   2HB   CYS  21           HB1      CYS  21  -0.411  -2.679  -2.679
  161    H    GLU  22           HN       GLU  22  -4.664  -1.913  -1.913
  162    HA   GLU  22           HA       GLU  22  -3.564   0.345   0.345
  163   1HB   GLU  22           HB2      GLU  22  -5.578  -0.811  -0.811
  164   2HB   GLU  22           HB1      GLU  22  -6.346  -0.454  -0.454
  165   1HG   GLU  22           HG2      GLU  22  -6.276   1.944   1.944
  166   2HG   GLU  22           HG1      GLU  22  -5.425   1.630   1.630
  167    H    TYR  23           HN       TYR  23  -3.438   2.443   2.443
  168    HA   TYR  23           HA       TYR  23  -4.237   3.135   3.135
  169   1HB   TYR  23           HB2      TYR  23  -2.111   4.306   4.306
  170   2HB   TYR  23           HB1      TYR  23  -1.759   2.682   2.682
  171    HD1  TYR  23           HD2      TYR  23  -1.948   6.274   6.274
  172    HD2  TYR  23           HD1      TYR  23  -0.934   2.295   2.295
  173    HE1  TYR  23           HE2      TYR  23  -0.802   7.255   7.255
  174    HE2  TYR  23           HE1      TYR  23   0.214   3.275   3.275
  175    HH   TYR  23           HH       TYR  23   1.053   6.522   6.522
  176    H    ALA  24           HN       ALA  24  -4.241   5.698   5.698
  177    HA   ALA  24           HA       ALA  24  -5.128   6.880   6.880
  178   1HB   ALA  24           HB2      ALA  24  -6.719   6.667   6.667
  179   2HB   ALA  24           HB1      ALA  24  -7.176   7.721   7.721
  180   3HB   ALA  24           HB3      ALA  24  -7.127   5.973   5.973
  181    H    SER  25           HN       SER  25  -4.398   8.949   8.949
  182    HA   SER  25           HA       SER  25  -4.178  10.786  10.786
  183   1HB   SER  25           HB2      SER  25  -2.183   9.659   9.659
  184   2HB   SER  25           HB1      SER  25  -1.782   9.413   9.413
  185    HG   SER  25           HG       SER  25  -0.855  11.301  11.301
  186    HA   PRO  26           HA       PRO  26  -4.579  13.603  13.603
  187   1HB   PRO  26           HB2      PRO  26  -3.613  15.894  15.894
  188   2HB   PRO  26           HB1      PRO  26  -5.194  15.203  15.203
  189   1HG   PRO  26           HG2      PRO  26  -2.616  15.047  15.047
  190   2HG   PRO  26           HG1      PRO  26  -4.264  15.226  15.226
  191   1HD   PRO  26           HD2      PRO  26  -2.891  12.862  12.862
  192   2HD   PRO  26           HD1      PRO  26  -4.664  12.976  12.976
  193    H    GLY  27           HN       GLY  27  -3.306  14.570  14.570
  194   1HA   GLY  27           HA2      GLY  27  -1.388  14.974  14.974
  195   2HA   GLY  27           HA1      GLY  27  -0.549  15.267  15.267
  196    H    LYS  28           HN       LYS  28   1.067  14.113  14.113
  197    HA   LYS  28           HA       LYS  28   1.085  11.209  11.209
  198   1HB   LYS  28           HB2      LYS  28   1.738  12.528  12.528
  199   2HB   LYS  28           HB1      LYS  28   2.001  10.820  10.820
  200   1HG   LYS  28           HG2      LYS  28  -0.390  10.505  10.505
  201   2HG   LYS  28           HG1      LYS  28  -0.682  12.225  12.225
  202   1HD   LYS  28           HD2      LYS  28   0.134  12.024  12.024
  203   2HD   LYS  28           HD1      LYS  28   0.443  10.306  10.306
  204   1HE   LYS  28           HE2      LYS  28  -2.302  11.534  11.534
  205   2HE   LYS  28           HE1      LYS  28  -1.775  10.830  10.830
  206   1HZ   LYS  28           HZ1      LYS  28  -1.108   8.822   8.822
  207   2HZ   LYS  28           HZ3      LYS  28  -1.898   9.485   9.485
  208   3HZ   LYS  28           HZ2      LYS  28  -2.784   9.095   9.095
  209    H    ALA  29           HN       ALA  29   3.203  10.342  10.342
  210    HA   ALA  29           HA       ALA  29   5.495  12.264  12.264
  211   1HB   ALA  29           HB2      ALA  29   4.273  12.045  12.045
  212   2HB   ALA  29           HB1      ALA  29   4.936  10.412  10.412
  213   3HB   ALA  29           HB3      ALA  29   6.020  11.803  11.803
  214    H    THR  30           HN       THR  30   7.577  11.157  11.157
  215    HA   THR  30           HA       THR  30   7.441   8.594   8.594
  216    HB   THR  30           HB       THR  30   9.852   8.905   8.905
  217    HG1  THR  30           HG1      THR  30  10.914  10.371  10.371
  218   1HG2  THR  30          HG23      THR  30   7.981  10.784  10.784
  219   2HG2  THR  30          HG22      THR  30   9.319  11.721  11.721
  220   3HG2  THR  30          HG21      THR  30   9.620  10.541  10.541
  221    H    GLU  31           HN       GLU  31   8.622   9.755   9.755
  222    HA   GLU  31           HA       GLU  31   9.784   7.206   7.206
  223   1HB   GLU  31           HB2      GLU  31   9.096   9.716   9.716
  224   2HB   GLU  31           HB1      GLU  31  10.152   8.435   8.435
  225   1HG   GLU  31           HG2      GLU  31  10.749   9.706   9.706
  226   2HG   GLU  31           HG1      GLU  31  11.159  10.583  10.583
  227    H    VAL  32           HN       VAL  32   7.689   5.904   5.904
  228    HA   VAL  32           HA       VAL  32   5.755   6.217   6.217
  229    HB   VAL  32           HB       VAL  32   5.856   4.366   4.366
  230   1HG1  VAL  32          HG11      VAL  32   4.486   3.920   3.920
  231   2HG1  VAL  32          HG13      VAL  32   3.298   4.838   4.838
  232   3HG1  VAL  32          HG12      VAL  32   3.961   3.342   3.342
  233   1HG2  VAL  32          HG21      VAL  32   4.711   7.066   7.066
  234   2HG2  VAL  32          HG23      VAL  32   5.335   6.390   6.390
  235   3HG2  VAL  32          HG22      VAL  32   3.720   5.953   5.953
  236    H    ARG  33           HN       ARG  33   7.427   5.628   5.628
  237    HA   ARG  33           HA       ARG  33   9.000   3.272   3.272
  238   1HB   ARG  33           HB2      ARG  33   9.143   5.275   5.275
  239   2HB   ARG  33           HB1      ARG  33   7.765   4.612   4.612
  240   1HG   ARG  33           HG2      ARG  33   9.014   2.568   2.568
  241   2HG   ARG  33           HG1      ARG  33  10.382   3.150   3.150
  242   1HD   ARG  33           HD2      ARG  33  11.137   3.930   3.930
  243   2HD   ARG  33           HD1      ARG  33   9.983   5.249   5.249
  244    HE   ARG  33           HE       ARG  33   8.526   4.269   4.269
  245   1HH1  ARG  33          HH21      ARG  33  11.014   1.990   1.990
  246   2HH1  ARG  33          HH22      ARG  33  10.575   0.858   0.858
  247   1HH2  ARG  33          HH11      ARG  33   7.994   2.772   2.772
  248   2HH2  ARG  33          HH12      ARG  33   8.885   1.292   1.292
  249    H    VAL  34           HN       VAL  34   8.356   1.179   1.179
  250    HA   VAL  34           HA       VAL  34   5.855   0.493   0.493
  251    HB   VAL  34           HB       VAL  34   5.527  -1.240  -1.240
  252   1HG1  VAL  34          HG13      VAL  34   5.650   1.684   1.684
  253   2HG1  VAL  34          HG12      VAL  34   5.204   0.538   0.538
  254   3HG1  VAL  34          HG11      VAL  34   4.241   0.645   0.645
  255   1HG2  VAL  34          HG22      VAL  34   8.225  -0.576  -0.576
  256   2HG2  VAL  34          HG21      VAL  34   7.195  -1.770  -1.770
  257   3HG2  VAL  34          HG23      VAL  34   7.244  -0.114  -0.114
  258    H    THR  35           HN       THR  35   5.989  -1.262  -1.262
  259    HA   THR  35           HA       THR  35   8.509  -2.888  -2.888
  260    HB   THR  35           HB       THR  35   7.085  -1.667  -1.667
  261    HG1  THR  35           HG1      THR  35   8.190  -0.101  -0.101
  262   1HG2  THR  35          HG23      THR  35   8.558  -3.939  -3.939
  263   2HG2  THR  35          HG22      THR  35   9.850  -2.752  -2.752
  264   3HG2  THR  35          HG21      THR  35   8.549  -2.810  -2.810
  265    H    VAL  36           HN       VAL  36   8.078  -5.063  -5.063
  266    HA   VAL  36           HA       VAL  36   5.275  -5.867  -5.867
  267    HB   VAL  36           HB       VAL  36   7.568  -7.235  -7.235
  268   1HG1  VAL  36          HG11      VAL  36   4.730  -8.150  -8.150
  269   2HG1  VAL  36          HG13      VAL  36   5.773  -8.888  -8.888
  270   3HG1  VAL  36          HG12      VAL  36   6.223  -8.951  -8.951
  271   1HG2  VAL  36          HG22      VAL  36   5.787  -5.253  -5.253
  272   2HG2  VAL  36          HG21      VAL  36   6.749  -6.315  -6.315
  273   3HG2  VAL  36          HG23      VAL  36   5.093  -6.753  -6.753
  274    H    LEU  37           HN       LEU  37   4.887  -7.044  -7.044
  275    HA   LEU  37           HA       LEU  37   7.331  -8.102  -8.102
  276   1HB   LEU  37           HB2      LEU  37   4.824  -6.821  -6.821
  277   2HB   LEU  37           HB1      LEU  37   6.170  -7.441  -7.441
  278    HG   LEU  37           HG       LEU  37   6.435  -5.249  -5.249
  279   1HD1  LEU  37          HD13      LEU  37   5.027  -4.908  -4.908
  280   2HD1  LEU  37          HD12      LEU  37   6.636  -4.801  -4.801
  281   3HD1  LEU  37          HD11      LEU  37   6.165  -3.675  -3.675
  282   1HD2  LEU  37          HD22      LEU  37   8.258  -6.298  -6.298
  283   2HD2  LEU  37          HD21      LEU  37   8.478  -6.545  -6.545
  284   3HD2  LEU  37          HD23      LEU  37   8.615  -4.923  -4.923
  285    H    ARG  38           HN       ARG  38   6.756  -9.763  -9.763
  286    HA   ARG  38           HA       ARG  38   4.355 -11.395 -11.395
  287   1HB   ARG  38           HB2      ARG  38   6.516 -12.244 -12.244
  288   2HB   ARG  38           HB1      ARG  38   7.146 -12.385 -12.385
  289   1HG   ARG  38           HG2      ARG  38   5.261 -13.920 -13.920
  290   2HG   ARG  38           HG1      ARG  38   4.735 -13.838 -13.838
  291   1HD   ARG  38           HD2      ARG  38   6.109 -15.852 -15.852
  292   2HD   ARG  38           HD1      ARG  38   6.992 -14.707 -14.707
  293    HE   ARG  38           HE       ARG  38   7.621 -14.109 -14.109
  294   1HH1  ARG  38          HH21      ARG  38   8.137 -16.646 -16.646
  295   2HH1  ARG  38          HH22      ARG  38   9.628 -17.146 -17.146
  296   1HH2  ARG  38          HH11      ARG  38   9.551 -14.791 -14.791
  297   2HH2  ARG  38          HH12      ARG  38  10.421 -16.109 -16.109
  298    H    GLN  39           HN       GLN  39   3.106 -11.848 -11.848
  299    HA   GLN  39           HA       GLN  39   4.378 -11.418 -11.418
  300   1HB   GLN  39           HB2      GLN  39   1.572 -11.134 -11.134
  301   2HB   GLN  39           HB1      GLN  39   1.910 -11.124 -11.124
  302   1HG   GLN  39           HG2      GLN  39   3.363  -9.211  -9.211
  303   2HG   GLN  39           HG1      GLN  39   3.266  -9.286  -9.286
  304   1HE2  GLN  39          HE22      GLN  39  -0.222  -8.126  -8.126
  305   2HE2  GLN  39          HE21      GLN  39   0.706  -9.341  -9.341
  306    H    ALA  40           HN       ALA  40   4.518 -13.083 -13.083
  307    HA   ALA  40           HA       ALA  40   3.378 -15.718 -15.718
  308   1HB   ALA  40           HB1      ALA  40   5.846 -14.991 -14.991
  309   2HB   ALA  40           HB3      ALA  40   5.160 -15.282 -15.282
  310   3HB   ALA  40           HB2      ALA  40   5.188 -16.577 -16.577
  311    H    ASP  41           HN       ASP  41   2.798 -17.044 -17.044
  312    HA   ASP  41           HA       ASP  41   0.418 -15.968 -15.968
  313   1HB   ASP  41           HB2      ASP  41   2.278 -18.179 -18.179
  314   2HB   ASP  41           HB1      ASP  41   0.749 -17.906 -17.906
  315    H    SER  42           HN       SER  42   3.722 -16.069 -16.069
  316    HA   SER  42           HA       SER  42   2.727 -14.325 -14.325
  317   1HB   SER  42           HB2      SER  42   5.011 -16.313 -16.313
  318   2HB   SER  42           HB1      SER  42   4.577 -15.360 -15.360
  319    HG   SER  42           HG       SER  42   2.723 -16.480 -16.480
  320    H    GLN  43           HN       GLN  43   5.049 -14.563 -14.563
  321    HA   GLN  43           HA       GLN  43   6.225 -11.957 -11.957
  322   1HB   GLN  43           HB2      GLN  43   7.568 -14.437 -14.437
  323   2HB   GLN  43           HB1      GLN  43   8.374 -12.869 -12.869
  324   1HG   GLN  43           HG2      GLN  43   7.138 -14.223 -14.223
  325   2HG   GLN  43           HG1      GLN  43   8.853 -14.270 -14.270
  326   1HE2  GLN  43          HE22      GLN  43   7.449 -11.111 -11.111
  327   2HE2  GLN  43          HE21      GLN  43   6.594 -12.566 -12.566
  328    H    VAL  44           HN       VAL  44   7.617 -11.070 -11.070
  329    HA   VAL  44           HA       VAL  44   6.377 -11.499 -11.499
  330    HB   VAL  44           HB       VAL  44   6.358  -8.888  -8.888
  331   1HG1  VAL  44          HG11      VAL  44   6.795  -8.603  -8.603
  332   2HG1  VAL  44          HG13      VAL  44   5.294  -9.467  -9.467
  333   3HG1  VAL  44          HG12      VAL  44   5.251  -7.917  -7.917
  334   1HG2  VAL  44          HG22      VAL  44   4.202 -10.832 -10.832
  335   2HG2  VAL  44          HG21      VAL  44   4.575 -10.273 -10.273
  336   3HG2  VAL  44          HG23      VAL  44   3.843  -9.169  -9.169
  337    H    THR  45           HN       THR  45   7.827 -10.941 -10.941
  338    HA   THR  45           HA       THR  45  10.354  -9.525  -9.525
  339    HB   THR  45           HB       THR  45  11.618 -11.289 -11.289
  340    HG1  THR  45           HG1      THR  45  10.620 -12.746 -12.746
  341   1HG2  THR  45          HG22      THR  45  11.168 -11.520 -11.520
  342   2HG2  THR  45          HG21      THR  45   9.716 -12.448 -12.448
  343   3HG2  THR  45          HG23      THR  45  11.305 -13.084 -13.084
  344    H    GLU  46           HN       GLU  46  11.437  -8.554  -8.554
  345    HA   GLU  46           HA       GLU  46   9.610  -7.651  -7.651
  346   1HB   GLU  46           HB2      GLU  46  12.507  -7.154  -7.154
  347   2HB   GLU  46           HB1      GLU  46  11.725  -6.394  -6.394
  348   1HG   GLU  46           HG2      GLU  46  10.201  -5.202  -5.202
  349   2HG   GLU  46           HG1      GLU  46  10.544  -6.214  -6.214
  350    H    VAL  47           HN       VAL  47   9.754  -8.021  -8.021
  351    HA   VAL  47           HA       VAL  47  11.256 -10.483 -10.483
  352    HB   VAL  47           HB       VAL  47   8.901  -8.967  -8.967
  353   1HG1  VAL  47          HG13      VAL  47  10.242 -10.110 -10.110
  354   2HG1  VAL  47          HG12      VAL  47  10.058 -11.622 -11.622
  355   3HG1  VAL  47          HG11      VAL  47   8.643 -10.823 -10.823
  356   1HG2  VAL  47          HG21      VAL  47   9.229 -11.288 -11.288
  357   2HG2  VAL  47          HG23      VAL  47   7.963 -10.061 -10.061
  358   3HG2  VAL  47          HG22      VAL  47   7.940 -11.394 -11.394
  359    H    CYS  48           HN       CYS  48  10.181  -7.630  -7.630
  360    HA   CYS  48           HA       CYS  48  12.929  -6.773  -6.773
  361   1HB   CYS  48           HB2      CYS  48  12.693  -7.246  -7.246
  362   2HB   CYS  48           HB1      CYS  48  12.805  -8.689  -8.689
  363    H    ALA  49           HN       ALA  49  12.925  -4.817  -4.817
  364    HA   ALA  49           HA       ALA  49  10.356  -3.529  -3.529
  365   1HB   ALA  49           HB2      ALA  49  10.820  -3.512  -3.512
  366   2HB   ALA  49           HB1      ALA  49  11.998  -2.258  -2.258
  367   3HB   ALA  49           HB3      ALA  49  10.294  -2.014  -2.014
  368    H    ALA  50           HN       ALA  50  10.660  -1.364  -1.364
  369    HA   ALA  50           HA       ALA  50  13.256  -0.141  -0.141
  370   1HB   ALA  50           HB1      ALA  50  13.098  -2.352  -2.352
  371   2HB   ALA  50           HB3      ALA  50  12.140  -1.329  -1.329
  372   3HB   ALA  50           HB2      ALA  50  13.806  -0.894  -0.894
  373    H    THR  51           HN       THR  51  13.003   1.871   1.871
  374    HA   THR  51           HA       THR  51  10.244   2.897   2.897
  375    HB   THR  51           HB       THR  51  12.635   4.334   4.334
  376    HG1  THR  51           HG1      THR  51  12.019   4.000   4.000
  377   1HG2  THR  51          HG21      THR  51   9.994   5.006   5.006
  378   2HG2  THR  51          HG23      THR  51  11.326   6.041   6.041
  379   3HG2  THR  51          HG22      THR  51  10.961   5.865   5.865
  380    H    TYR  52           HN       TYR  52   8.862   2.616   2.616
  381    HA   TYR  52           HA       TYR  52   9.870   1.799   1.799
  382   1HB   TYR  52           HB2      TYR  52   7.719   1.058   1.058
  383   2HB   TYR  52           HB1      TYR  52   7.082   2.671   2.671
  384    HD1  TYR  52           HD2      TYR  52   6.633   3.421   3.421
  385    HD2  TYR  52           HD1      TYR  52   8.190  -0.527  -0.527
  386    HE1  TYR  52           HE2      TYR  52   6.093   2.718   2.718
  387    HE2  TYR  52           HE1      TYR  52   7.659  -1.236  -1.236
  388    HH   TYR  52           HH       TYR  52   5.593   0.354   0.354
  389    H    MET  53           HN       MET  53  11.010   3.540   3.540
  390    HA   MET  53           HA       MET  53  10.033   6.277   6.277
  391   1HB   MET  53           HB2      MET  53  11.950   4.866   4.866
  392   2HB   MET  53           HB1      MET  53  11.814   6.611   6.611
  393   1HG   MET  53           HG2      MET  53  12.229   5.200   5.200
  394   2HG   MET  53           HG1      MET  53  13.541   4.927   4.927
  395   1HE   MET  53           HE1      MET  53  11.558   7.277   7.277
  396   2HE   MET  53           HE3      MET  53  12.042   8.911   8.911
  397   3HE   MET  53           HE2      MET  53  11.069   7.925   7.925
  398    H    MET  54           HN       MET  54   8.579   7.204   7.204
  399    HA   MET  54           HA       MET  54   6.975   5.411   5.411
  400   1HB   MET  54           HB2      MET  54   6.461   7.735   7.735
  401   2HB   MET  54           HB1      MET  54   7.204   8.390   8.390
  402   1HG   MET  54           HG2      MET  54   4.623   7.948   7.948
  403   2HG   MET  54           HG1      MET  54   5.559   7.481   7.481
  404   1HE   MET  54           HE3      MET  54   4.954   6.579   6.579
  405   2HE   MET  54           HE2      MET  54   3.878   5.185   5.185
  406   3HE   MET  54           HE1      MET  54   5.623   4.940   4.940
  407    H    GLY  55           HN       GLY  55   9.976   7.061   7.061
  408   1HA   GLY  55           HA2      GLY  55   9.710   6.543   6.543
  409   2HA   GLY  55           HA1      GLY  55  10.869   7.658   7.658
  410    H    ASN  56           HN       ASN  56  11.370   5.495   5.495
  411    HA   ASN  56           HA       ASN  56  13.093   3.702   3.702
  412   1HB   ASN  56           HB2      ASN  56  13.673   5.119   5.119
  413   2HB   ASN  56           HB1      ASN  56  14.758   3.957   3.957
  414   1HD2  ASN  56          HD22      ASN  56  15.020   7.737   7.737
  415   2HD2  ASN  56          HD21      ASN  56  14.373   7.211   7.211
  416    H    GLU  57           HN       GLU  57  13.639   1.631   1.631
  417    HA   GLU  57           HA       GLU  57  11.551   0.785   0.785
  418   1HB   GLU  57           HB2      GLU  57  11.276  -0.067  -0.067
  419   2HB   GLU  57           HB1      GLU  57  12.883  -0.788  -0.788
  420   1HG   GLU  57           HG2      GLU  57  12.173  -2.208  -2.208
  421   2HG   GLU  57           HG1      GLU  57  10.585  -1.440  -1.440
  422    H    LEU  58           HN       LEU  58  12.437   0.137   0.137
  423    HA   LEU  58           HA       LEU  58  15.345  -0.437  -0.437
  424   1HB   LEU  58           HB2      LEU  58  13.130  -0.024  -0.024
  425   2HB   LEU  58           HB1      LEU  58  14.783  -0.423  -0.423
  426    HG   LEU  58           HG       LEU  58  13.945   2.004   2.004
  427   1HD1  LEU  58          HD13      LEU  58  13.549   1.679   1.679
  428   2HD1  LEU  58          HD12      LEU  58  15.241   2.183   2.183
  429   3HD1  LEU  58          HD11      LEU  58  14.024   3.229   3.229
  430   1HD2  LEU  58          HD23      LEU  58  16.614   0.944   0.944
  431   2HD2  LEU  58          HD22      LEU  58  16.156   1.428   1.428
  432   3HD2  LEU  58          HD21      LEU  58  16.378   2.650   2.650
  433    H    THR  59           HN       THR  59  16.016  -2.319  -2.319
  434    HA   THR  59           HA       THR  59  14.257  -4.685  -4.685
  435    HB   THR  59           HB       THR  59  16.525  -5.796  -5.796
  436    HG1  THR  59           HG1      THR  59  18.068  -4.579  -4.579
  437   1HG2  THR  59          HG21      THR  59  15.068  -4.851  -4.851
  438   2HG2  THR  59          HG23      THR  59  16.351  -3.647  -3.647
  439   3HG2  THR  59          HG22      THR  59  16.726  -5.357  -5.357
  440    H    PHE  60           HN       PHE  60  13.835  -5.884  -5.884
  441    HA   PHE  60           HA       PHE  60  14.532  -4.921  -4.921
  442   1HB   PHE  60           HB2      PHE  60  13.264  -7.379  -7.379
  443   2HB   PHE  60           HB1      PHE  60  13.546  -7.281  -7.281
  444    HD1  PHE  60           HD2      PHE  60  12.881  -4.086  -4.086
  445    HD2  PHE  60           HD1      PHE  60  11.036  -7.430  -7.430
  446    HE1  PHE  60           HE2      PHE  60  10.795  -2.755  -2.755
  447    HE2  PHE  60           HE1      PHE  60   8.944  -6.094  -6.094
  448    HZ   PHE  60           HZ       PHE  60   8.821  -3.759  -3.759
  449    H    LEU  61           HN       LEU  61  16.243  -5.501  -5.501
  450    HA   LEU  61           HA       LEU  61  18.582  -6.706  -6.706
  451   1HB   LEU  61           HB2      LEU  61  18.479  -4.961  -4.961
  452   2HB   LEU  61           HB1      LEU  61  17.885  -6.180  -6.180
  453    HG   LEU  61           HG       LEU  61  20.401  -6.756  -6.756
  454   1HD1  LEU  61          HD13      LEU  61  20.671  -4.440  -4.440
  455   2HD1  LEU  61          HD12      LEU  61  20.268  -5.018  -5.018
  456   3HD1  LEU  61          HD11      LEU  61  21.736  -5.582  -5.582
  457   1HD2  LEU  61          HD23      LEU  61  19.086  -7.521  -7.521
  458   2HD2  LEU  61          HD22      LEU  61  19.817  -8.553  -8.553
  459   3HD2  LEU  61          HD21      LEU  61  20.841  -7.638  -7.638
  460    H    ASP  62           HN       ASP  62  16.235  -8.048  -8.048
  461    HA   ASP  62           HA       ASP  62  17.651 -10.677 -10.677
  462   1HB   ASP  62           HB2      ASP  62  16.889 -11.108 -11.108
  463   2HB   ASP  62           HB1      ASP  62  17.809  -9.609  -9.609
  464    H    ASP  63           HN       ASP  63  15.943 -12.437 -12.437
  465    HA   ASP  63           HA       ASP  63  14.091 -13.782 -13.782
  466   1HB   ASP  63           HB2      ASP  63  12.957 -10.986 -10.986
  467   2HB   ASP  63           HB1      ASP  63  11.951 -12.428 -12.428
  468    H    SER  64           HN       SER  64  15.715 -13.787 -13.787
  469    HA   SER  64           HA       SER  64  15.863 -14.047 -14.047
  470   1HB   SER  64           HB2      SER  64  12.896 -14.378 -14.378
  471   2HB   SER  64           HB1      SER  64  13.691 -14.833 -14.833
  472    HG   SER  64           HG       SER  64  14.262 -15.815 -15.815
  473    H    ILE  67           HN       ILE  67  15.319 -11.290 -11.290
  474    HA   ILE  67           HA       ILE  67  14.877  -9.121  -9.121
  475    HB   ILE  67           HB       ILE  67  15.273 -10.630 -10.630
  476   1HG1  ILE  67          HG12      ILE  67  17.221  -9.087  -9.087
  477   2HG1  ILE  67          HG11      ILE  67  17.106 -10.844 -10.844
  478   1HG2  ILE  67          HG22      ILE  67  15.377  -7.674  -7.674
  479   2HG2  ILE  67          HG21      ILE  67  16.033  -8.353  -8.353
  480   3HG2  ILE  67          HG23      ILE  67  14.304  -8.459  -8.459
  481   1HD1  ILE  67          HD11      ILE  67  17.467 -10.628 -10.628
  482   2HD1  ILE  67          HD13      ILE  67  17.917  -8.955  -8.955
  483   3HD1  ILE  67          HD12      ILE  67  18.860 -10.268 -10.268
  484    H    CYS  68           HN       CYS  68  12.538  -9.504  -9.504
  485    HA   CYS  68           HA       CYS  68  10.457 -10.329 -10.329
  486   1HB   CYS  68           HB2      CYS  68   9.665  -8.318  -8.318
  487   2HB   CYS  68           HB1      CYS  68   9.215 -10.017 -10.017
  488    H    THR  69           HN       THR  69   9.052  -8.987  -8.987
  489    HA   THR  69           HA       THR  69  10.181  -6.266  -6.266
  490    HB   THR  69           HB       THR  69  10.537  -7.963  -7.963
  491    HG1  THR  69           HG1      THR  69   9.542  -6.785  -6.785
  492   1HG2  THR  69          HG21      THR  69   7.521  -8.206  -8.206
  493   2HG2  THR  69          HG23      THR  69   8.508  -8.849  -8.849
  494   3HG2  THR  69          HG22      THR  69   8.703  -9.473  -9.473
  495    H    GLY  70           HN       GLY  70   8.726  -4.562  -4.562
  496   1HA   GLY  70           HA2      GLY  70   5.837  -5.190  -5.190
  497   2HA   GLY  70           HA1      GLY  70   6.635  -3.921  -3.921
  498    H    THR  71           HN       THR  71   4.430  -3.935  -3.935
  499    HA   THR  71           HA       THR  71   5.643  -1.936  -1.936
  500    HB   THR  71           HB       THR  71   3.211  -3.658  -3.658
  501    HG1  THR  71           HG1      THR  71   4.778  -5.071  -5.071
  502   1HG2  THR  71          HG23      THR  71   4.421  -1.535  -1.535
  503   2HG2  THR  71          HG22      THR  71   3.864  -2.969  -2.969
  504   3HG2  THR  71          HG21      THR  71   2.737  -2.045  -2.045
  505    H    SER  72           HN       SER  72   4.176  -0.127  -0.127
  506    HA   SER  72           HA       SER  72   1.961   0.364   0.364
  507   1HB   SER  72           HB2      SER  72   4.047   1.270   1.270
  508   2HB   SER  72           HB1      SER  72   4.334   2.186   2.186
  509    HG   SER  72           HG       SER  72   3.105   3.658   3.658
  510    H    SER  73           HN       SER  73   0.278   0.662   0.662
  511    HA   SER  73           HA       SER  73   0.509   2.863   2.863
  512   1HB   SER  73           HB2      SER  73   1.283   0.828   0.828
  513   2HB   SER  73           HB1      SER  73  -0.195  -0.009  -0.009
  514    HG   SER  73           HG       SER  73  -1.004   0.815   0.815
  515    H    GLY  74           HN       GLY  74  -1.483   3.887   3.887
  516   1HA   GLY  74           HA2      GLY  74  -3.756   4.385   4.385
  517   2HA   GLY  74           HA1      GLY  74  -4.039   2.643   2.643
  518    H    ASN  75           HN       ASN  75  -2.014   4.521   4.521
  519    HA   ASN  75           HA       ASN  75  -2.071   4.707   4.707
  520   1HB   ASN  75           HB2      ASN  75  -5.038   4.480   4.480
  521   2HB   ASN  75           HB1      ASN  75  -4.383   4.987   4.987
  522   1HD2  ASN  75          HD22      ASN  75  -2.887   7.991   7.991
  523   2HD2  ASN  75          HD21      ASN  75  -2.272   6.670   6.670
  524    H    GLN  76           HN       GLN  76  -2.138   1.955   1.955
  525    HA   GLN  76           HA       GLN  76  -2.944   0.345   0.345
  526   1HB   GLN  76           HB2      GLN  76  -3.178  -0.154  -0.154
  527   2HB   GLN  76           HB1      GLN  76  -3.372  -1.436  -1.436
  528   1HG   GLN  76           HG2      GLN  76  -5.213  -0.240  -0.240
  529   2HG   GLN  76           HG1      GLN  76  -4.990   1.123   1.123
  530   1HE2  GLN  76          HE22      GLN  76  -6.449  -2.376  -2.376
  531   2HE2  GLN  76          HE21      GLN  76  -5.336  -2.465  -2.465
  532    H    VAL  77           HN       VAL  77  -1.150  -0.698  -0.698
  533    HA   VAL  77           HA       VAL  77   1.267  -0.895  -0.895
  534    HB   VAL  77           HB       VAL  77   2.489  -0.824  -0.824
  535   1HG1  VAL  77          HG12      VAL  77   0.660   1.171   1.171
  536   2HG1  VAL  77          HG11      VAL  77   0.462   0.898   0.898
  537   3HG1  VAL  77          HG13      VAL  77   2.049   1.309   1.309
  538   1HG2  VAL  77          HG23      VAL  77   0.056  -1.950  -1.950
  539   2HG2  VAL  77          HG22      VAL  77   1.745  -2.282  -2.282
  540   3HG2  VAL  77          HG21      VAL  77   0.971  -0.834  -0.834
  541    H    ASN  78           HN       ASN  78   1.816  -2.877  -2.877
  542    HA   ASN  78           HA       ASN  78   0.480  -5.293  -5.293
  543   1HB   ASN  78           HB2      ASN  78   0.308  -4.587  -4.587
  544   2HB   ASN  78           HB1      ASN  78   2.030  -4.925  -4.925
  545    HD2  ASN  78          HD22      ASN  78  -0.840  -6.642  -6.642
  546    H    LEU  79           HN       LEU  79   1.700  -6.424  -6.424
  547    HA   LEU  79           HA       LEU  79   4.681  -6.395  -6.395
  548   1HB   LEU  79           HB2      LEU  79   2.696  -7.197  -7.197
  549   2HB   LEU  79           HB1      LEU  79   4.434  -7.440  -7.440
  550    HG   LEU  79           HG       LEU  79   3.182  -4.741  -4.741
  551   1HD1  LEU  79          HD11      LEU  79   3.302  -6.249  -6.249
  552   2HD1  LEU  79          HD13      LEU  79   4.250  -4.766  -4.766
  553   3HD1  LEU  79          HD12      LEU  79   2.546  -4.690  -4.690
  554   1HD2  LEU  79          HD22      LEU  79   5.939  -5.796  -5.796
  555   2HD2  LEU  79          HD21      LEU  79   5.415  -4.576  -4.576
  556   3HD2  LEU  79          HD23      LEU  79   5.533  -4.170  -4.170
  557    H    THR  80           HN       THR  80   5.791  -8.302  -8.302
  558    HA   THR  80           HA       THR  80   4.156 -10.801 -10.801
  559    HB   THR  80           HB       THR  80   6.375  -9.747  -9.747
  560    HG1  THR  80           HG1      THR  80   4.558  -9.509  -9.509
  561   1HG2  THR  80          HG22      THR  80   4.787 -12.264 -12.264
  562   2HG2  THR  80          HG21      THR  80   5.113 -11.589 -11.589
  563   3HG2  THR  80          HG23      THR  80   6.450 -12.008 -12.008
  564    H    ILE  81           HN       ILE  81   5.031 -12.563 -12.563
  565    HA   ILE  81           HA       ILE  81   7.834 -12.368 -12.368
  566    HB   ILE  81           HB       ILE  81   5.394 -13.968 -13.968
  567   1HG1  ILE  81          HG12      ILE  81   6.833 -11.831 -11.831
  568   2HG1  ILE  81          HG11      ILE  81   5.541 -11.423 -11.423
  569   1HG2  ILE  81          HG23      ILE  81   7.560 -15.166 -15.166
  570   2HG2  ILE  81          HG22      ILE  81   8.115 -13.768 -13.768
  571   3HG2  ILE  81          HG21      ILE  81   6.738 -14.710 -14.710
  572   1HD1  ILE  81          HD13      ILE  81   4.298 -13.406 -13.406
  573   2HD1  ILE  81          HD12      ILE  81   5.395 -12.906 -12.906
  574   3HD1  ILE  81          HD11      ILE  81   4.263 -11.745 -11.745
  575    H    GLN  82           HN       GLN  82   9.293 -13.981 -13.981
  576    HA   GLN  82           HA       GLN  82   8.193 -16.268 -16.268
  577   1HB   GLN  82           HB2      GLN  82  10.771 -14.716 -14.716
  578   2HB   GLN  82           HB1      GLN  82  10.287 -16.130 -16.130
  579   1HG   GLN  82           HG2      GLN  82   8.322 -14.962 -14.962
  580   2HG   GLN  82           HG1      GLN  82   8.687 -13.563 -13.563
  581   1HE2  GLN  82          HE22      GLN  82  10.929 -12.188 -12.188
  582   2HE2  GLN  82          HE21      GLN  82  10.017 -11.976 -11.976
  583    H    GLY  83           HN       GLY  83   8.572 -18.134 -18.134
  584   1HA   GLY  83           HA2      GLY  83  10.324 -19.747 -19.747
  585   2HA   GLY  83           HA1      GLY  83  11.028 -18.418 -18.418
  586    H    LEU  84           HN       LEU  84   7.552 -18.889 -18.889
  587    HA   LEU  84           HA       LEU  84   7.470 -19.185 -19.185
  588   1HB   LEU  84           HB2      LEU  84   5.444 -18.884 -18.884
  589   2HB   LEU  84           HB1      LEU  84   4.975 -19.081 -19.081
  590    HG   LEU  84           HG       LEU  84   6.906 -16.948 -16.948
  591   1HD1  LEU  84          HD12      LEU  84   3.895 -16.906 -16.906
  592   2HD1  LEU  84          HD11      LEU  84   4.865 -15.435 -15.435
  593   3HD1  LEU  84          HD13      LEU  84   4.869 -16.426 -16.426
  594   1HD2  LEU  84          HD21      LEU  84   5.601 -17.770 -17.770
  595   2HD2  LEU  84          HD23      LEU  84   7.178 -17.026 -17.026
  596   3HD2  LEU  84          HD22      LEU  84   5.719 -16.035 -16.035
  597    H    ARG  85           HN       ARG  85   7.220 -21.085 -21.085
  598    HA   ARG  85           HA       ARG  85   6.622 -23.557 -23.557
  599   1HB   ARG  85           HB2      ARG  85   7.792 -23.039 -23.039
  600   2HB   ARG  85           HB1      ARG  85   7.581 -24.638 -24.638
  601   1HG   ARG  85           HG2      ARG  85   8.973 -23.764 -23.764
  602   2HG   ARG  85           HG1      ARG  85   9.406 -22.416 -22.416
  603   1HD   ARG  85           HD2      ARG  85  10.232 -24.049 -24.049
  604   2HD   ARG  85           HD1      ARG  85   9.891 -25.363 -25.363
  605    HE   ARG  85           HE       ARG  85  11.399 -23.559 -23.559
  606   1HH1  ARG  85          HH21      ARG  85  11.858 -25.263 -25.263
  607   2HH1  ARG  85          HH22      ARG  85  13.577 -25.323 -25.323
  608   1HH2  ARG  85          HH11      ARG  85  13.625 -23.660 -23.660
  609   2HH2  ARG  85          HH12      ARG  85  14.568 -24.426 -24.426
  610    H    ALA  86           HN       ALA  86   5.367 -25.202 -25.202
  611    HA   ALA  86           HA       ALA  86   2.717 -24.238 -24.238
  612   1HB   ALA  86           HB3      ALA  86   3.639 -26.621 -26.621
  613   2HB   ALA  86           HB2      ALA  86   4.061 -26.575 -26.575
  614   3HB   ALA  86           HB1      ALA  86   2.372 -26.442 -26.442
  615    H    MET  87           HN       MET  87   5.407 -24.869 -24.869
  616    HA   MET  87           HA       MET  87   4.078 -24.174 -24.174
  617   1HB   MET  87           HB2      MET  87   6.951 -24.323 -24.323
  618   2HB   MET  87           HB1      MET  87   6.503 -24.049 -24.049
  619   1HG   MET  87           HG2      MET  87   5.611 -26.418 -26.418
  620   2HG   MET  87           HG1      MET  87   6.923 -26.457 -26.457
  621   1HE   MET  87           HE2      MET  87   3.664 -26.824 -26.824
  622   2HE   MET  87           HE1      MET  87   2.742 -27.356 -27.356
  623   3HE   MET  87           HE3      MET  87   2.752 -25.648 -25.648
  624    H    ASP  88           HN       ASP  88   5.806 -22.255 -22.255
  625    HA   ASP  88           HA       ASP  88   6.250 -19.905 -19.905
  626   1HB   ASP  88           HB2      ASP  88   5.956 -20.419 -20.419
  627   2HB   ASP  88           HB1      ASP  88   6.436 -18.856 -18.856
  628    H    THR  89           HN       THR  89   3.329 -21.160 -21.160
  629    HA   THR  89           HA       THR  89   1.786 -18.963 -18.963
  630    HB   THR  89           HB       THR  89   0.924 -21.293 -21.293
  631    HG1  THR  89           HG1      THR  89   1.293 -21.073 -21.073
  632   1HG2  THR  89          HG22      THR  89  -0.592 -19.240 -19.240
  633   2HG2  THR  89          HG21      THR  89  -0.654 -20.127 -20.127
  634   3HG2  THR  89          HG23      THR  89  -1.217 -20.889 -20.889
  635    H    GLY  90           HN       GLY  90   0.455 -17.546 -17.546
  636   1HA   GLY  90           HA2      GLY  90  -0.228 -17.411 -17.411
  637   2HA   GLY  90           HA1      GLY  90   1.474 -16.956 -16.956
  638    H    LEU  91           HN       LEU  91   0.387 -14.915 -14.915
  639    HA   LEU  91           HA       LEU  91  -0.936 -13.193 -13.193
  640   1HB   LEU  91           HB2      LEU  91  -1.617 -13.378 -13.378
  641   2HB   LEU  91           HB1      LEU  91  -0.049 -12.731 -12.731
  642    HG   LEU  91           HG       LEU  91  -0.691 -10.767 -10.767
  643   1HD1  LEU  91          HD12      LEU  91  -2.747 -11.923 -11.923
  644   2HD1  LEU  91          HD11      LEU  91  -3.408 -11.821 -11.821
  645   3HD1  LEU  91          HD13      LEU  91  -3.088 -10.347 -10.347
  646   1HD2  LEU  91          HD23      LEU  91  -0.498 -10.921 -10.921
  647   2HD2  LEU  91          HD22      LEU  91  -1.283  -9.524  -9.524
  648   3HD2  LEU  91          HD21      LEU  91  -2.260 -10.827 -10.827
  649    H    TYR  92           HN       TYR  92   0.051 -11.686 -11.686
  650    HA   TYR  92           HA       TYR  92   2.810 -10.772 -10.772
  651   1HB   TYR  92           HB2      TYR  92   1.463 -11.348 -11.348
  652   2HB   TYR  92           HB1      TYR  92   2.935 -10.381 -10.381
  653    HD1  TYR  92           HD2      TYR  92   1.471 -13.758 -13.758
  654    HD2  TYR  92           HD1      TYR  92   5.073 -11.357 -11.357
  655    HE1  TYR  92           HE2      TYR  92   2.853 -15.838 -15.838
  656    HE2  TYR  92           HE1      TYR  92   6.456 -13.431 -13.431
  657    HH   TYR  92           HH       TYR  92   5.083 -16.518 -16.518
  658    H    ILE  93           HN       ILE  93   3.090  -8.510  -8.510
  659    HA   ILE  93           HA       ILE  93   0.604  -6.890  -6.890
  660    HB   ILE  93           HB       ILE  93   3.376  -6.414  -6.414
  661   1HG1  ILE  93          HG12      ILE  93   1.976  -6.304  -6.304
  662   2HG1  ILE  93          HG11      ILE  93   0.691  -7.058  -7.058
  663   1HG2  ILE  93          HG22      ILE  93   1.307  -4.492  -4.492
  664   2HG2  ILE  93          HG21      ILE  93   1.563  -4.518  -4.518
  665   3HG2  ILE  93          HG23      ILE  93   2.916  -4.206  -4.206
  666   1HD1  ILE  93          HD11      ILE  93   3.445  -8.263  -8.263
  667   2HD1  ILE  93          HD13      ILE  93   2.339  -8.573  -8.573
  668   3HD1  ILE  93          HD12      ILE  93   1.896  -9.050  -9.050
  669    H    CYS  94           HN       CYS  94   0.368  -5.147  -5.147
  670    HA   CYS  94           HA       CYS  94   2.484  -4.651  -4.651
  671   1HB   CYS  94           HB2      CYS  94   0.647  -3.935  -3.935
  672   2HB   CYS  94           HB1      CYS  94   0.129  -5.443  -5.443
  673    H    LYS  95           HN       LYS  95   3.638  -2.790  -2.790
  674    HA   LYS  95           HA       LYS  95   2.165  -0.736  -0.736
  675   1HB   LYS  95           HB2      LYS  95   5.088  -1.455  -1.455
  676   2HB   LYS  95           HB1      LYS  95   4.475  -0.136  -0.136
  677   1HG   LYS  95           HG2      LYS  95   2.938  -2.428  -2.428
  678   2HG   LYS  95           HG1      LYS  95   4.623  -2.949  -2.949
  679   1HD   LYS  95           HD2      LYS  95   5.251  -1.092  -1.092
  680   2HD   LYS  95           HD1      LYS  95   3.571  -0.552  -0.552
  681   1HE   LYS  95           HE2      LYS  95   2.898  -2.291  -2.291
  682   2HE   LYS  95           HE1      LYS  95   4.133  -3.393  -3.393
  683   1HZ   LYS  95           HZ1      LYS  95   5.802  -1.822  -1.822
  684   2HZ   LYS  95           HZ3      LYS  95   4.503  -1.105  -1.105
  685   3HZ   LYS  95           HZ2      LYS  95   4.883  -2.737  -2.737
  686    H    VAL  96           HN       VAL  96   2.170   1.405   1.405
  687    HA   VAL  96           HA       VAL  96   3.724   2.056   2.056
  688    HB   VAL  96           HB       VAL  96   0.790   2.694   2.694
  689   1HG1  VAL  96          HG13      VAL  96   2.344   3.948   3.948
  690   2HG1  VAL  96          HG12      VAL  96   2.308   2.455   2.455
  691   3HG1  VAL  96          HG11      VAL  96   0.812   3.331   3.331
  692   1HG2  VAL  96          HG22      VAL  96   2.048   0.285   0.285
  693   2HG2  VAL  96          HG21      VAL  96   0.835   0.297   0.297
  694   3HG2  VAL  96          HG23      VAL  96   0.402   0.820   0.820
  695    H    GLU  97           HN       GLU  97   4.992   3.697   3.697
  696    HA   GLU  97           HA       GLU  97   3.493   5.881   5.881
  697   1HB   GLU  97           HB2      GLU  97   6.260   4.776   4.776
  698   2HB   GLU  97           HB1      GLU  97   5.530   6.135   6.135
  699   1HG   GLU  97           HG2      GLU  97   4.851   4.503   4.503
  700   2HG   GLU  97           HG1      GLU  97   3.571   4.249   4.249
  701    H    LEU  98           HN       LEU  98   3.707   7.810   7.810
  702    HA   LEU  98           HA       LEU  98   5.801   8.237   8.237
  703   1HB   LEU  98           HB2      LEU  98   3.786  10.170  10.170
  704   2HB   LEU  98           HB1      LEU  98   4.599  10.346  10.346
  705    HG   LEU  98           HG       LEU  98   2.645   8.138   8.138
  706   1HD1  LEU  98          HD11      LEU  98   2.356  10.742  10.742
  707   2HD1  LEU  98          HD13      LEU  98   1.243   9.397   9.397
  708   3HD1  LEU  98          HD12      LEU  98   1.390  10.131  10.131
  709   1HD2  LEU  98          HD23      LEU  98   4.636   8.233   8.233
  710   2HD2  LEU  98          HD22      LEU  98   3.259   7.130   7.130
  711   3HD2  LEU  98          HD21      LEU  98   3.143   8.644   8.644
  712    H    MET  99           HN       MET  99   7.436   7.764   7.764
  713    HA   MET  99           HA       MET  99   7.650   9.467   9.467
  714   1HB   MET  99           HB2      MET  99   8.347   7.014   7.014
  715   2HB   MET  99           HB1      MET  99   9.814   7.708   7.708
  716   1HG   MET  99           HG2      MET  99  10.582   8.456   8.456
  717   2HG   MET  99           HG1      MET  99   8.964   8.810   8.810
  718   1HE   MET  99           HE2      MET  99   7.293   7.251   7.251
  719   2HE   MET  99           HE1      MET  99   7.416   5.885   5.885
  720   3HE   MET  99           HE3      MET  99   7.532   5.627   5.627
  721    H    TYR 100           HN       TYR 100   9.763   9.081   9.081
  722    HA   TYR 100           HA       TYR 100  11.592  11.137  11.137
  723   1HB   TYR 100           HB2      TYR 100  10.816   9.916   9.916
  724   2HB   TYR 100           HB1      TYR 100  12.182  11.011  11.011
  725    HD1  TYR 100           HD2      TYR 100  14.133  10.379  10.379
  726    HD2  TYR 100           HD1      TYR 100  10.885   7.627   7.627
  727    HE1  TYR 100           HE2      TYR 100  15.536   8.474   8.474
  728    HE2  TYR 100           HE1      TYR 100  12.292   5.727   5.727
  729    HH   TYR 100           HH       TYR 100  14.264   5.432   5.432
  730    HA   PRO 101           HA       PRO 101   9.102  14.208  14.208
  731   1HB   PRO 101           HB2      PRO 101   6.606  13.583  13.583
  732   2HB   PRO 101           HB1      PRO 101   8.097  13.204  13.204
  733   1HG   PRO 101           HG2      PRO 101   6.273  11.415  11.415
  734   2HG   PRO 101           HG1      PRO 101   7.475  11.050  11.050
  735   1HD   PRO 101           HD2      PRO 101   7.699  10.720  10.720
  736   2HD   PRO 101           HD1      PRO 101   8.890  10.293  10.293
  737    HA   PRO 102           HA       PRO 102   6.660  15.001  15.001
  738   1HB   PRO 102           HB2      PRO 102   7.701  17.502  17.502
  739   2HB   PRO 102           HB1      PRO 102   8.574  15.991  15.991
  740   1HG   PRO 102           HG2      PRO 102   8.915  17.974  17.974
  741   2HG   PRO 102           HG1      PRO 102  10.136  16.922  16.922
  742   1HD   PRO 102           HD2      PRO 102   8.718  16.564  16.564
  743   2HD   PRO 102           HD1      PRO 102   9.871  15.422  15.422
  744    HA   PRO 103           HA       PRO 103   5.887  16.148  16.148
  745   1HB   PRO 103           HB2      PRO 103   3.766  15.918  15.918
  746   2HB   PRO 103           HB1      PRO 103   4.936  17.239  17.239
  747   1HG   PRO 103           HG2      PRO 103   2.301  17.417  17.417
  748   2HG   PRO 103           HG1      PRO 103   3.525  18.624  18.624
  749   1HD   PRO 103           HD2      PRO 103   2.671  16.173  16.173
  750   2HD   PRO 103           HD1      PRO 103   2.463  17.802  17.802
  751    H    TYR 104           HN       TYR 104   5.060  14.018  14.018
  752    HA   TYR 104           HA       TYR 104   4.434  12.035  12.035
  753   1HB   TYR 104           HB2      TYR 104   6.121  11.337  11.337
  754   2HB   TYR 104           HB1      TYR 104   5.310  11.954  11.954
  755    HD1  TYR 104           HD2      TYR 104   3.551   9.860   9.860
  756    HD2  TYR 104           HD1      TYR 104   5.485   9.950   9.950
  757    HE1  TYR 104           HE2      TYR 104   2.694   7.553   7.553
  758    HE2  TYR 104           HE1      TYR 104   4.647   7.633   7.633
  759    HH   TYR 104           HH       TYR 104   2.315   6.298   6.298
  760    H    TYR 105           HN       TYR 105   2.282  11.247  11.247
  761    HA   TYR 105           HA       TYR 105   0.279  11.403  11.403
  762   1HB   TYR 105           HB2      TYR 105   0.332  13.528  13.528
  763   2HB   TYR 105           HB1      TYR 105  -0.099  12.582  12.582
  764    HD1  TYR 105           HD2      TYR 105  -1.267  13.819  13.819
  765    HD2  TYR 105           HD1      TYR 105  -2.308  11.669  11.669
  766    HE1  TYR 105           HE2      TYR 105  -3.690  13.973  13.973
  767    HE2  TYR 105           HE1      TYR 105  -4.739  11.820  11.820
  768    HH   TYR 105           HH       TYR 105  -5.834  12.612  12.612
  769    H    LEU 106           HN       LEU 106   0.389   9.074   9.074
  770    HA   LEU 106           HA       LEU 106  -1.409   7.960   7.960
  771   1HB   LEU 106           HB2      LEU 106   1.299   8.042   8.042
  772   2HB   LEU 106           HB1      LEU 106   1.117   6.446   6.446
  773    HG   LEU 106           HG       LEU 106  -0.737   5.961   5.961
  774   1HD1  LEU 106          HD11      LEU 106  -0.087   8.755   8.755
  775   2HD1  LEU 106          HD13      LEU 106  -0.586   7.591   7.591
  776   3HD1  LEU 106          HD12      LEU 106  -1.652   7.952   7.952
  777   1HD2  LEU 106          HD23      LEU 106   1.878   5.637   5.637
  778   2HD2  LEU 106          HD22      LEU 106   0.694   5.245   5.245
  779   3HD2  LEU 106          HD21      LEU 106   1.567   6.771   6.771
  780    H    GLY 108           HN       GLY 108  -0.362   5.187   5.187
  781   1HA   GLY 108           HA2      GLY 108  -0.756   4.898   4.898
  782   2HA   GLY 108           HA1      GLY 108  -2.172   4.425   4.425
  783    H    ILE 109           HN       ILE 109  -1.482   2.328   2.328
  784    HA   ILE 109           HA       ILE 109   0.432   0.788   0.788
  785    HB   ILE 109           HB       ILE 109  -0.107   0.803   0.803
  786   1HG1  ILE 109          HG12      ILE 109   2.353   1.329   1.329
  787   2HG1  ILE 109          HG11      ILE 109   1.304   2.579   2.579
  788   1HG2  ILE 109          HG21      ILE 109   0.241  -1.523  -1.523
  789   2HG2  ILE 109          HG23      ILE 109   1.794  -0.986  -0.986
  790   3HG2  ILE 109          HG22      ILE 109   1.499  -0.994  -0.994
  791   1HD1  ILE 109          HD11      ILE 109   2.713   0.486   0.486
  792   2HD1  ILE 109          HD13      ILE 109   3.288   2.133   2.133
  793   3HD1  ILE 109          HD12      ILE 109   1.763   1.827   1.827
  794    H    GLY 110           HN       GLY 110  -0.135  -1.554  -1.554
  795   1HA   GLY 110           HA2      GLY 110  -3.074  -2.010  -2.010
  796   2HA   GLY 110           HA1      GLY 110  -1.963  -2.973  -2.973
  797    H    ASN 111           HN       ASN 111  -3.803  -3.373  -3.373
  798    HA   ASN 111           HA       ASN 111  -2.078  -4.192  -4.192
  799   1HB   ASN 111           HB2      ASN 111  -4.886  -4.877  -4.877
  800   2HB   ASN 111           HB1      ASN 111  -4.159  -5.628  -5.628
  801    HD2  ASN 111          HD22      ASN 111  -5.622  -3.231  -3.231
  802    H    GLY 112           HN       GLY 112  -3.092  -5.934  -5.934
  803   1HA   GLY 112           HA2      GLY 112  -1.158  -7.524  -7.524
  804   2HA   GLY 112           HA1      GLY 112  -1.470  -8.254  -8.254
  805    H    THR 113           HN       THR 113  -1.508  -9.447  -9.447
  806    HA   THR 113           HA       THR 113  -4.342 -10.443 -10.443
  807    HB   THR 113           HB       THR 113  -2.216 -10.071 -10.071
  808    HG1  THR 113           HG1      THR 113  -3.142  -8.234  -8.234
  809   1HG2  THR 113          HG21      THR 113  -4.857 -11.490 -11.490
  810   2HG2  THR 113          HG23      THR 113  -4.357 -10.656 -10.656
  811   3HG2  THR 113          HG22      THR 113  -3.351 -11.956 -11.956
  812    H    GLN 114           HN       GLN 114  -4.438 -12.792 -12.792
  813    HA   GLN 114           HA       GLN 114  -1.880 -14.123 -14.123
  814   1HB   GLN 114           HB2      GLN 114  -3.919 -14.526 -14.526
  815   2HB   GLN 114           HB1      GLN 114  -4.713 -15.193 -15.193
  816   1HG   GLN 114           HG2      GLN 114  -3.139 -16.993 -16.993
  817   2HG   GLN 114           HG1      GLN 114  -2.078 -16.247 -16.247
  818   1HE2  GLN 114          HE22      GLN 114  -3.616 -18.550 -18.550
  819   2HE2  GLN 114          HE21      GLN 114  -2.236 -18.251 -18.251
  820    H    ILE 115           HN       ILE 115  -0.695 -15.008 -15.008
  821    HA   ILE 115           HA       ILE 115  -1.871 -15.444 -15.444
  822    HB   ILE 115           HB       ILE 115   0.888 -15.936 -15.936
  823   1HG1  ILE 115          HG12      ILE 115  -0.019 -13.807 -13.807
  824   2HG1  ILE 115          HG11      ILE 115  -0.015 -13.556 -13.556
  825   1HG2  ILE 115          HG21      ILE 115   0.425 -17.397 -17.397
  826   2HG2  ILE 115          HG23      ILE 115   0.046 -15.956 -15.956
  827   3HG2  ILE 115          HG22      ILE 115   1.679 -16.200 -16.200
  828   1HD1  ILE 115          HD12      ILE 115   2.466 -14.375 -14.375
  829   2HD1  ILE 115          HD11      ILE 115   2.316 -13.970 -13.970
  830   3HD1  ILE 115          HD13      ILE 115   2.083 -12.722 -12.722
  831    H    TYR 116           HN       TYR 116  -2.382 -17.488 -17.488
  832    HA   TYR 116           HA       TYR 116  -2.216 -19.846 -19.846
  833   1HB   TYR 116           HB2      TYR 116  -4.237 -19.095 -19.095
  834   2HB   TYR 116           HB1      TYR 116  -4.324 -20.529 -20.529
  835    HD1  TYR 116           HD1      TYR 116  -3.870 -19.901 -19.901
  836    HD2  TYR 116           HD2      TYR 116  -5.682 -17.295 -17.295
  837    HE1  TYR 116           HE1      TYR 116  -4.977 -18.561 -18.561
  838    HE2  TYR 116           HE2      TYR 116  -6.687 -16.003 -16.003
  839    HH   TYR 116           HH       TYR 116  -6.597 -15.528 -15.528
  840    H    VAL 117           HN       VAL 117  -1.837 -21.900 -21.900
  841    HA   VAL 117           HA       VAL 117  -0.418 -21.892 -21.892
  842    HB   VAL 117           HB       VAL 117   0.485 -23.164 -23.164
  843   1HG1  VAL 117          HG13      VAL 117  -2.254 -23.831 -23.831
  844   2HG1  VAL 117          HG12      VAL 117  -1.405 -25.340 -25.340
  845   3HG1  VAL 117          HG11      VAL 117  -0.875 -24.300 -24.300
  846   1HG2  VAL 117          HG22      VAL 117   0.773 -24.000 -24.000
  847   2HG2  VAL 117          HG21      VAL 117   0.827 -25.285 -25.285
  848   3HG2  VAL 117          HG23      VAL 117  -0.629 -25.042 -25.042
  849    H    ILE 118           HN       ILE 118  -1.177 -23.704 -23.704
  850    HA   ILE 118           HA       ILE 118  -4.126 -23.508 -23.508
  851    HB   ILE 118           HB       ILE 118  -1.910 -24.416 -24.416
  852   1HG1  ILE 118          HG12      ILE 118  -1.705 -22.057 -22.057
  853   2HG1  ILE 118          HG11      ILE 118  -2.350 -22.228 -22.228
  854   1HG2  ILE 118          HG21      ILE 118  -4.873 -24.074 -24.074
  855   2HG2  ILE 118          HG23      ILE 118  -3.745 -23.954 -23.954
  856   3HG2  ILE 118          HG22      ILE 118  -3.860 -25.453 -25.453
  857   1HD1  ILE 118          HD13      ILE 118  -4.652 -22.195 -22.195
  858   2HD1  ILE 118          HD12      ILE 118  -3.653 -21.187 -21.187
  859   3HD1  ILE 118          HD11      ILE 118  -3.903 -20.734 -20.734
  860    H    ASP 119           HN       ASP 119  -5.251 -25.149 -25.149
  861    HA   ASP 119           HA       ASP 119  -4.349 -27.956 -27.956
  862   1HB   ASP 119           HB2      ASP 119  -3.632 -27.135 -27.135
  863   2HB   ASP 119           HB1      ASP 119  -5.314 -26.775 -26.775
  864    HA   PRO 120           HA       PRO 120  -8.702 -27.925 -27.925
  865   1HB   PRO 120           HB2      PRO 120  -8.898 -30.564 -30.564
  866   2HB   PRO 120           HB1      PRO 120  -8.173 -29.332 -29.332
  867   1HG   PRO 120           HG2      PRO 120  -6.845 -31.320 -31.320
  868   2HG   PRO 120           HG1      PRO 120  -6.398 -30.787 -30.787
  869   1HD   PRO 120           HD2      PRO 120  -5.158 -29.884 -29.884
  870   2HD   PRO 120           HD1      PRO 120  -5.332 -28.902 -28.902
  871    H    GLU 121           HN       GLU 121 -10.687 -28.887 -28.887
  872    HA   GLU 121           HA       GLU 121 -10.318 -29.956 -29.956
  873   1HB   GLU 121           HB2      GLU 121 -12.662 -28.761 -28.761
  874   2HB   GLU 121           HB1      GLU 121 -12.722 -29.263 -29.263
  875   1HG   GLU 121           HG2      GLU 121 -10.967 -27.665 -27.665
  876   2HG   GLU 121           HG1      GLU 121 -10.796 -27.206 -27.206
  877    HA   PRO 122           HA       PRO 122 -11.494 -33.908 -33.908
  878   1HB   PRO 122           HB2      PRO 122 -11.404 -35.389 -35.389
  879   2HB   PRO 122           HB1      PRO 122  -9.956 -34.942 -34.942
  880   1HG   PRO 122           HG2      PRO 122 -11.082 -33.704 -33.704
  881   2HG   PRO 122           HG1      PRO 122  -9.395 -34.030 -34.030
  882   1HD   PRO 122           HD2      PRO 122 -10.513 -31.568 -31.568
  883   2HD   PRO 122           HD1      PRO 122  -9.209 -32.126 -32.126
  884    H    CYS 123           HN       CYS 123 -13.082 -32.211 -32.211
  885    HA   CYS 123           HA       CYS 123 -15.514 -33.929 -33.929
  886   1HB   CYS 123           HB2      CYS 123 -14.464 -33.718 -33.718
  887   2HB   CYS 123           HB1      CYS 123 -14.704 -31.973 -31.973
  888    HG   CYS 123           HG       CYS 123 -17.032 -34.054 -34.054
  889    HA   PRO 124           HA       PRO 124 -17.045 -30.266 -30.266
  890   1HB   PRO 124           HB2      PRO 124 -19.529 -31.254 -31.254
  891   2HB   PRO 124           HB1      PRO 124 -18.073 -31.662 -31.662
  892   1HG   PRO 124           HG2      PRO 124 -19.465 -33.228 -33.228
  893   2HG   PRO 124           HG1      PRO 124 -18.737 -33.780 -33.780
  894   1HD   PRO 124           HD2      PRO 124 -17.516 -34.057 -34.057
  895   2HD   PRO 124           HD1      PRO 124 -16.620 -33.848 -33.848
  896    H    ASP 125           HN       ASP 125 -18.208 -31.740 -31.740
  897    HA   ASP 125           HA       ASP 125 -19.615 -29.224 -29.224
  898   1HB   ASP 125           HB2      ASP 125 -21.569 -30.527 -30.527
  899   2HB   ASP 125           HB1      ASP 125 -21.260 -30.813 -30.813
  900    H    SER 126           HN       SER 126 -20.500 -29.839 -29.839
  901    HA   SER 126           HA       SER 126 -18.089 -30.009 -30.009
  902   1HB   SER 126           HB2      SER 126 -19.695 -29.827 -29.827
  903   2HB   SER 126           HB1      SER 126 -20.146 -28.721 -28.721
  904    HG   SER 126           HG       SER 126 -21.883 -30.047 -30.047
  905    H    ASP 127           HN       ASP 127 -17.851 -31.657 -31.657
  906    HA   ASP 127           HA       ASP 127 -18.966 -34.345 -34.345
  907   1HB   ASP 127           HB2      ASP 127 -16.695 -33.857 -33.857
  908   2HB   ASP 127           HB1      ASP 127 -16.049 -33.772 -33.772
  909    H    GLN 128           HN       GLN 128 -18.768 -35.875 -35.875
  910    HA   GLN 128           HA       GLN 128 -19.416 -34.745 -34.745
  911   1HB   GLN 128           HB2      GLN 128 -18.493 -37.510 -37.510
  912   2HB   GLN 128           HB1      GLN 128 -19.208 -37.140 -37.140
  913   1HG   GLN 128           HG2      GLN 128 -20.560 -36.644 -36.644
  914   2HG   GLN 128           HG1      GLN 128 -20.882 -38.027 -38.027
  915   1HE2  GLN 128          HE21      GLN 128 -22.862 -35.983 -35.983
  916   2HE2  GLN 128          HE22      GLN 128 -23.317 -35.210 -35.210
  917    H    GLU 129           HN       GLU 129 -16.378 -35.947 -35.947
  918    HA   GLU 129           HA       GLU 129 -14.901 -35.831 -35.831
  919   1HB   GLU 129           HB2      GLU 129 -14.395 -37.337 -37.337
  920   2HB   GLU 129           HB1      GLU 129 -13.976 -35.925 -35.925
  921   1HG   GLU 129           HG2      GLU 129 -12.173 -35.350 -35.350
  922   2HG   GLU 129           HG1      GLU 129 -12.622 -36.686 -36.686
  923    HA   PRO 130           HA       PRO 130 -14.268 -31.402 -31.402
  924   1HB   PRO 130           HB2      PRO 130 -12.409 -31.155 -31.155
  925   2HB   PRO 130           HB1      PRO 130 -14.146 -31.350 -31.350
  926   1HG   PRO 130           HG2      PRO 130 -11.968 -33.380 -33.380
  927   2HG   PRO 130           HG1      PRO 130 -13.351 -33.158 -33.158
  928   1HD   PRO 130           HD2      PRO 130 -13.283 -35.062 -35.062
  929   2HD   PRO 130           HD1      PRO 130 -14.789 -34.290 -34.290
  930    H    LYS 131           HN       LYS 131 -12.475 -29.947 -29.947
  931    HA   LYS 131           HA       LYS 131  -9.985 -31.330 -31.330
  932   1HB   LYS 131           HB2      LYS 131 -11.821 -29.490 -29.490
  933   2HB   LYS 131           HB1      LYS 131 -10.250 -30.053 -30.053
  934   1HG   LYS 131           HG2      LYS 131 -11.043 -32.405 -32.405
  935   2HG   LYS 131           HG1      LYS 131 -12.633 -31.793 -31.793
  936   1HD   LYS 131           HD2      LYS 131 -11.251 -31.103 -31.103
  937   2HD   LYS 131           HD1      LYS 131 -12.442 -32.394 -32.394
  938   1HE   LYS 131           HE2      LYS 131 -14.143 -30.785 -30.785
  939   2HE   LYS 131           HE1      LYS 131 -12.951 -29.470 -29.470
  940   1HZ   LYS 131           HZ2      LYS 131 -13.589 -31.225 -31.225
  941   2HZ   LYS 131           HZ1      LYS 131 -14.297 -29.699 -29.699
  942   3HZ   LYS 131           HZ3      LYS 131 -12.625 -29.826 -29.826
  943    H1   NAG 132           H1       NAG 132  -3.693  -5.289  -5.289
  944    H2   NAG 132           H2       NAG 132  -3.040  -2.535  -2.535
  945    H3   NAG 132           H3       NAG 132  -1.453  -5.138  -5.138
  946    H4   NAG 132           H4       NAG 132  -3.068  -3.750  -3.750
  947    H5   NAG 132           H5       NAG 132  -3.729  -6.363  -6.363
  948   1H6   NAG 132           H61      NAG 132  -4.660  -5.047  -5.047
  949   2H6   NAG 132           H62      NAG 132  -5.966  -5.373  -5.373
  950   1H8   NAG 132           H81      NAG 132  -0.059  -2.804  -2.804
  951   2H8   NAG 132           H82      NAG 132  -1.293  -1.987  -1.987
  952   3H8   NAG 132           H83      NAG 132  -0.270  -1.001  -1.001
  953    HN2  NAG 132           HN2      NAG 132  -1.343  -4.069  -4.069
  954    HO3  NAG 132           HO3      NAG 132  -1.211  -2.516  -2.516
  955    H1   NAG 133           H1       NAG 133  -2.199  -4.172  -4.172
  956    H2   NAG 133           H2       NAG 133  -0.606  -6.791  -6.791
  957    H3   NAG 133           H3       NAG 133  -1.242  -4.752  -4.752
  958    H4   NAG 133           H4       NAG 133   1.467  -5.330  -5.330
  959    H5   NAG 133           H5       NAG 133  -0.321  -2.845  -2.845
  960   1H6   NAG 133           H61      NAG 133   1.880  -3.333  -3.333
  961   2H6   NAG 133           H62      NAG 133   2.408  -3.049  -3.049
  962   1H8   NAG 133           H81      NAG 133  -3.941  -9.452  -9.452
  963   2H8   NAG 133           H82      NAG 133  -4.034  -8.287  -8.287
  964   3H8   NAG 133           H83      NAG 133  -4.676  -7.838  -7.838
  965    HN2  NAG 133           HN2      NAG 133  -3.328  -6.100  -6.100
  966    HO3  NAG 133           HO3      NAG 133  -0.714  -6.424  -6.424
  967    HO6  NAG 133           HO6      NAG 133   1.687  -1.211  -1.211
  968    H1   FUC 134           H1       FUC 134  -5.523  -7.554  -7.554
  969    H2   FUC 134           H2       FUC 134  -5.128  -9.600  -9.600
  970    H3   FUC 134           H3       FUC 134  -7.858  -9.819  -9.819
  971    H4   FUC 134           H4       FUC 134  -8.723 -10.039 -10.039
  972    H5   FUC 134           H5       FUC 134  -8.567  -7.586  -7.586
  973   1H6   FUC 134           H61      FUC 134  -8.077  -6.511  -6.511
  974   2H6   FUC 134           H62      FUC 134  -9.373  -7.749  -7.749
  975   3H6   FUC 134           H63      FUC 134  -7.742  -8.142  -8.142
  976    HO2  FUC 134           HO2      FUC 134  -5.529 -10.541 -10.541
  977    HO3  FUC 134           HO3      FUC 134  -6.074 -11.572 -11.572
  978    HO4  FUC 134           HO4      FUC 134  -6.775 -10.974 -10.974
  979    H1   MAN 135           H1       MAN 135   2.349  -5.648  -5.648
  980    H2   MAN 135           H2       MAN 135   3.846  -3.905  -3.905
  981    H3   MAN 135           H3       MAN 135   4.946  -5.463  -5.463
  982    H4   MAN 135           H4       MAN 135   4.290  -3.575  -3.575
  983    H5   MAN 135           H5       MAN 135   3.105  -6.342  -6.342
  984   1H6   MAN 135           H61      MAN 135   3.407  -5.581  -5.581
  985   2H6   MAN 135           H62      MAN 135   2.190  -4.338  -4.338
  986    HO2  MAN 135           HO2      MAN 135   3.997  -1.927  -1.927
  987    HO3  MAN 135           HO3      MAN 135   6.416  -3.950  -3.950
  988    HO4  MAN 135           HO4      MAN 135   5.862  -4.688  -4.688
  989    HO6  MAN 135           HO6      MAN 135   1.905  -7.127  -7.127
  990    H1   NAG 136           H1       NAG 136   1.559  -8.254  -8.254
  991    H2   NAG 136           H2       NAG 136  -1.398  -8.553  -8.553
  992    H3   NAG 136           H3       NAG 136   0.957 -10.428 -10.428
  993    H4   NAG 136           H4       NAG 136  -0.444  -8.606  -8.606
  994    H5   NAG 136           H5       NAG 136   2.311  -8.299  -8.299
  995   1H6   NAG 136           H61      NAG 136   1.692  -7.679  -7.679
  996   2H6   NAG 136           H62      NAG 136   0.865  -6.293  -6.293
  997   1H8   NAG 136           H81      NAG 136  -3.297  -9.349  -9.349
  998   2H8   NAG 136           H82      NAG 136  -3.598 -10.966 -10.966
  999   3H8   NAG 136           H83      NAG 136  -2.711  -9.732  -9.732
 1000    HN2  NAG 136           HN2      NAG 136   0.034  -9.662  -9.662
 1001    HO3  NAG 136           HO3      NAG 136  -0.800 -11.202 -11.202
 1002    H1   NAG 137           H1       NAG 137   2.617  -9.859  -9.859
 1003    H2   NAG 137           H2       NAG 137   1.748 -12.157 -12.157
 1004    H3   NAG 137           H3       NAG 137   4.324 -11.944 -11.944
 1005    H4   NAG 137           H4       NAG 137   3.952 -11.821 -11.821
 1006    H5   NAG 137           H5       NAG 137   4.721  -9.541  -9.541
 1007   1H6   NAG 137           H61      NAG 137   5.800  -9.262  -9.262
 1008   2H6   NAG 137           H62      NAG 137   4.404  -8.167  -8.167
 1009   1H8   NAG 137           H81      NAG 137   1.591 -15.322 -15.322
 1010   2H8   NAG 137           H82      NAG 137   1.818 -14.091 -14.091
 1011   3H8   NAG 137           H83      NAG 137   0.179 -14.719 -14.719
 1012    HN2  NAG 137           HN2      NAG 137   2.058 -11.959 -11.959
 1013    HO3  NAG 137           HO3      NAG 137   3.554 -13.794 -13.794
 1014    HO6  NAG 137           HO6      NAG 137   4.440  -9.235  -9.235
 1015    H1   FUC 138           H1       FUC 138   3.702  -7.622  -7.622
 1016    H2   FUC 138           H2       FUC 138   4.075  -5.283  -5.283
 1017    H3   FUC 138           H3       FUC 138   2.276  -4.319  -4.319
 1018    H4   FUC 138           H4       FUC 138   4.354  -2.761  -2.761
 1019    H5   FUC 138           H5       FUC 138   4.535  -4.975  -4.975
 1020   1H6   FUC 138           H61      FUC 138   7.164  -5.272  -5.272
 1021   2H6   FUC 138           H62      FUC 138   6.863  -3.581  -3.581
 1022   3H6   FUC 138           H63      FUC 138   6.552  -4.077  -4.077
 1023    HO2  FUC 138           HO2      FUC 138   2.183  -6.239  -6.239
 1024    HO3  FUC 138           HO3      FUC 138   3.434  -3.453  -3.453
 1025    HO4  FUC 138           HO4      FUC 138   5.820  -4.272  -4.272
 1026    H1   MAN 139           H1       MAN 139   5.790 -11.834 -11.834
 1027    H2   MAN 139           H2       MAN 139   8.063 -11.069 -11.069
 1028    H3   MAN 139           H3       MAN 139   8.046 -12.375 -12.375
 1029    H4   MAN 139           H4       MAN 139   8.379 -14.855 -14.855
 1030    H5   MAN 139           H5       MAN 139   5.921 -13.947 -13.947
 1031   1H6   MAN 139           H61      MAN 139   6.668 -16.361 -16.361
 1032   2H6   MAN 139           H62      MAN 139   4.986 -15.761 -15.761
 1033    HO2  MAN 139           HO2      MAN 139   8.275 -13.607 -13.607
 1034    HO3  MAN 139           HO3      MAN 139  10.125 -12.034 -12.034
 1035    HO4  MAN 139           HO4      MAN 139   7.789 -14.579 -14.579
 1036    HO6  MAN 139           HO6      MAN 139   4.973 -17.037 -17.037