*HEADER    DE NOVO PROTEIN                         03-MAR-17   5V2G              
*TITLE     DE NOVO DESIGN OF NOVEL COVALENT CONSTRAINED MESO-SIZE PEPTIDE        
*TITLE    2 SCAFFOLDS WITH UNIQUE TERTIARY STRUCTURES                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 20-MER PEPTIDE;                                            
*COMPND   3 CHAIN: A, B, C;                                                      
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT;                            
*SOURCE   4 ORGANISM_TAXID: 32630                                                
*KEYWDS    DE NOVO DESIGN, COVALENT CONSTRAINED PEPTIDE, DE NOVO PROTEIN         
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    B.DANG,H.WU,V.K.MULLIGAN,M.MRAVIC,Y.WU,T.LEMMIN,A.FORD,D.SILVA,       
*AUTHOR   2 D.BAKER,W.F.DEGRADO                                                  
*REVDAT   1   27-SEP-17 5V2G    0                                                
# Restraints file 1: assign.tbl
 assign  (segid  a  and  resid   14 and name  HD1#) (segid  d  and  resid  100 and name  HA3)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   14 and name  HD1#) (segid  d  and  resid  100 and name  HB3)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   14 and name  HD1#) (segid  d  and  resid  100 and name  HC3)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   14 and name  HD2#) (segid  d  and  resid  100 and name  HA3)  3.65  1.85  1.85 
 assign  (segid  b  and  resid   14 and name  HD2#) (segid  d  and  resid  100 and name  HB3)  3.65  1.85  1.85 
 assign  (segid  c  and  resid   14 and name  HD2#) (segid  d  and  resid  100 and name  HC3)  3.65  1.85  1.85 
 assign  (segid  a  and  resid   15 and name  HD1#) (segid  d  and  resid  100 and name  HA3)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   15 and name  HD1#) (segid  d  and  resid  100 and name  HB3)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   15 and name  HD1#) (segid  d  and  resid  100 and name  HC3)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   15 and name  HD2#) (segid  d  and  resid  100 and name  HA3)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   15 and name  HD2#) (segid  d  and  resid  100 and name  HB3)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   15 and name  HD2#) (segid  d  and  resid  100 and name  HC3)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    8 and name  HD1#) (segid  d  and  resid  100 and name  HC3)  3.65  1.85  1.85 
 assign  (segid  b  and  resid    8 and name  HD1#) (segid  d  and  resid  100 and name  HA3)  3.65  1.85  1.85 
 assign  (segid  c  and  resid    8 and name  HD1#) (segid  d  and  resid  100 and name  HB3)  3.65  1.85  1.85 
 assign  (segid  a  and  resid    8 and name  HD1#) (segid  a  and  resid    2 and name HD21)  3.65  1.85  1.85 
 assign  (segid  b  and  resid    8 and name  HD1#) (segid  b  and  resid    2 and name HD21)  3.65  1.85  1.85 
 assign  (segid  c  and  resid    8 and name  HD1#) (segid  c  and  resid    2 and name HD21)  3.65  1.85  1.85 
 assign  (segid  a  and  resid    5 and name   HB#) (segid  a  and  resid    2 and name HD21)  3.65  1.85  1.85 
 assign  (segid  b  and  resid    5 and name   HB#) (segid  b  and  resid    2 and name HD21)  3.65  1.85  1.85 
 assign  (segid  c  and  resid    5 and name   HB#) (segid  c  and  resid    2 and name HD21)  3.65  1.85  1.85 
 assign  (segid  a  and  resid    5 and name   HB#) (segid  a  and  resid    2 and name  HB#)  3.65  1.85  1.85 
 assign  (segid  b  and  resid    5 and name   HB#) (segid  b  and  resid    2 and name  HB#)  3.65  1.85  1.85 
 assign  (segid  c  and  resid    5 and name   HB#) (segid  c  and  resid    2 and name  HB#)  3.65  1.85  1.85 
 assign  (segid  a  and  resid    5 and name   HA) (segid  a  and  resid    8 and name    HB)  2.65  0.85  0.85 
 assign  (segid  b  and  resid    5 and name   HA) (segid  b  and  resid    8 and name    HB)  2.65  0.85  0.85 
 assign  (segid  c  and  resid    5 and name   HA) (segid  c  and  resid    8 and name    HB)  2.65  0.85  0.85 
 assign  (segid  a  and  resid    5 and name   HA) (segid  a  and  resid    8 and name  HD1#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    5 and name   HA) (segid  b  and  resid    8 and name  HD1#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    5 and name   HA) (segid  c  and  resid    8 and name  HD1#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    5 and name   HA) (segid  a  and  resid    8 and name  HG2#)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    5 and name   HA) (segid  b  and  resid    8 and name  HG2#)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    5 and name   HA) (segid  c  and  resid    8 and name  HG2#)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    8 and name  HD1#) (segid  d  and  resid  100 and name  HA1#)  3.65  1.85  1.85
 assign  (segid  b  and  resid    8 and name  HD1#) (segid  d  and  resid  100 and name  HB1#)  3.65  1.85  1.85
 assign  (segid  c  and  resid    8 and name  HD1#) (segid  d  and  resid  100 and name  HC1#)  3.65  1.85  1.85
 assign  (segid  a  and  resid    8 and name  HG2#) (segid  d  and  resid  100 and name  HA1#)  3.65  1.85  1.85
 assign  (segid  b  and  resid    8 and name  HG2#) (segid  d  and  resid  100 and name  HB1#)  3.65  1.85  1.85
 assign  (segid  c  and  resid    8 and name  HG2#) (segid  d  and  resid  100 and name  HC1#)  3.65  1.85  1.85
 assign  (segid  c  and  resid   14 and name  HD1#) (segid  d  and  resid  100 and name  HA1#)  3.65  1.85  1.85
 assign  (segid  a  and  resid   14 and name  HD1#) (segid  d  and  resid  100 and name  HB1#)  3.65  1.85  1.85
 assign  (segid  b  and  resid   14 and name  HD1#) (segid  d  and  resid  100 and name  HC1#)  3.65  1.85  1.85
 assign  (segid  c  and  resid   14 and name  HD2#) (segid  d  and  resid  100 and name  HA1#)  3.65  1.85  1.85
 assign  (segid  a  and  resid   14 and name  HD2#) (segid  d  and  resid  100 and name  HB1#)  3.65  1.85  1.85
 assign  (segid  b  and  resid   14 and name  HD2#) (segid  d  and  resid  100 and name  HC1#)  3.65  1.85  1.85
 assign  (segid  c  and  resid   15 and name  HD1#) (segid  d  and  resid  100 and name  HA1#)  3.40  1.60  1.60
 assign  (segid  a  and  resid   15 and name  HD1#) (segid  d  and  resid  100 and name  HB1#)  3.40  1.60  1.60
 assign  (segid  b  and  resid   15 and name  HD1#) (segid  d  and  resid  100 and name  HC1#)  3.40  1.60  1.60
 assign  (segid  c  and  resid   15 and name  HD2#) (segid  d  and  resid  100 and name  HA1#)  3.40  1.60  1.60
 assign  (segid  a  and  resid   15 and name  HD2#) (segid  d  and  resid  100 and name  HB1#)  3.40  1.60  1.60
 assign  (segid  b  and  resid   15 and name  HD2#) (segid  d  and  resid  100 and name  HC1#)  3.40  1.60  1.60
 assign  (segid  a  and  resid   11 and name    HA) (segid  d  and  resid  100 and name   HA3)  3.40  1.60  1.60
 assign  (segid  b  and  resid   11 and name    HA) (segid  d  and  resid  100 and name   HB3)  3.40  1.60  1.60
 assign  (segid  c  and  resid   11 and name    HA) (segid  d  and  resid  100 and name   HC3)  3.40  1.60  1.60
 assign  (segid  a  and  resid   18 and name    HA) (segid  a  and  resid   19 and name    HN)  2.40  0.60  0.60
 assign  (segid  b  and  resid   18 and name    HA) (segid  b  and  resid   19 and name    HN)  2.40  0.60  0.60
 assign  (segid  c  and  resid   18 and name    HA) (segid  c  and  resid   19 and name    HN)  2.40  0.60  0.60
 assign  (segid  a  and  resid   19 and name    HA) (segid  a  and  resid   20 and name    HN)  2.40  0.60  0.60
 assign  (segid  b  and  resid   19 and name    HA) (segid  b  and  resid   20 and name    HN)  2.40  0.60  0.60
 assign  (segid  c  and  resid   19 and name    HA) (segid  c  and  resid   20 and name    HN)  2.40  0.60  0.60
 assign  (segid  a  and  resid   20 and name    HA) (segid  b  and  resid    1 and name    HN)  2.40  0.60  0.60
 assign  (segid  b  and  resid   20 and name    HA) (segid  c  and  resid    1 and name    HN)  2.40  0.60  0.60
 assign  (segid  c  and  resid   20 and name    HA) (segid  a  and  resid    1 and name    HN)  2.40  0.60  0.60
 assign  (segid  a  and  resid    1 and name    HA) (segid  a  and  resid    2 and name    HN)  2.40  0.60  0.60
 assign  (segid  b  and  resid    1 and name    HA) (segid  b  and  resid    2 and name    HN)  2.40  0.60  0.60
 assign  (segid  c  and  resid    1 and name    HA) (segid  c  and  resid    2 and name    HN)  2.40  0.60  0.60
 assign  (segid  a  and  resid    2 and name    HA) (segid  a  and  resid    3 and name   HD#)  2.40  0.60  0.60
 assign  (segid  b  and  resid    2 and name    HA) (segid  b  and  resid    3 and name   HD#)  2.40  0.60  0.60
 assign  (segid  c  and  resid    2 and name    HA) (segid  c  and  resid    3 and name   HD#)  2.40  0.60  0.60
   assign  (segid  a  and  resid    8 and name   HA) (segid  c  and  resid   15 and name  HD1#)  3.65  1.85  1.85 
OR assign  (segid  a  and  resid    8 and name   HA) (segid  a  and  resid   15 and name  HD1#)
OR assign  (segid  a  and  resid    8 and name   HA) (segid  b  and  resid   15 and name  HD1#)
   assign  (segid  b  and  resid    8 and name   HA) (segid  a  and  resid   15 and name  HD1#)  3.65  1.85  1.85 
OR assign  (segid  b  and  resid    8 and name   HA) (segid  b  and  resid   15 and name  HD1#)
OR assign  (segid  b  and  resid    8 and name   HA) (segid  c  and  resid   15 and name  HD1#)
   assign  (segid  c  and  resid    8 and name   HA) (segid  b  and  resid   15 and name  HD1#)  3.65  1.85  1.85 
OR assign  (segid  c  and  resid    8 and name   HA) (segid  a  and  resid   15 and name  HD1#)
OR assign  (segid  c  and  resid    8 and name   HA) (segid  c  and  resid   15 and name  HD1#)
   assign  (segid  a  and  resid    8 and name   HA) (segid  c  and  resid   15 and name  HD2#)  3.40  1.60  1.60 
OR assign  (segid  a  and  resid    8 and name   HA) (segid  a  and  resid   15 and name  HD2#)  
OR assign  (segid  a  and  resid    8 and name   HA) (segid  b  and  resid   15 and name  HD2#)
   assign  (segid  b  and  resid    8 and name   HA) (segid  a  and  resid   15 and name  HD2#)  3.40  1.60  1.60 
OR assign  (segid  b  and  resid    8 and name   HA) (segid  b  and  resid   15 and name  HD2#) 
OR assign  (segid  b  and  resid    8 and name   HA) (segid  c  and  resid   15 and name  HD2#) 
   assign  (segid  c  and  resid    8 and name   HA) (segid  b  and  resid   15 and name  HD2#)  3.40  1.60  1.60 
OR assign  (segid  c  and  resid    8 and name   HA) (segid  c  and  resid   15 and name  HD2#)
OR assign  (segid  c  and  resid    8 and name   HA) (segid  a  and  resid   15 and name  HD2#)
   assign  (segid  c  and  resid   14 and name  HD1#) (segid  a  and  resid    7 and name  HG#)  3.65  1.85  1.85
OR assign  (segid  c  and  resid   14 and name  HD1#) (segid  b  and  resid    7 and name  HG#)
OR assign  (segid  c  and  resid   14 and name  HD1#) (segid  c  and  resid    7 and name  HG#)
   assign  (segid  a  and  resid   14 and name  HD1#) (segid  b  and  resid    7 and name  HG#)  3.65  1.85  1.85
OR assign  (segid  a  and  resid   14 and name  HD1#) (segid  c  and  resid    7 and name  HG#)  3.65  1.85  1.85
OR assign  (segid  a  and  resid   14 and name  HD1#) (segid  a  and  resid    7 and name  HG#)  3.65  1.85  1.85
   assign  (segid  b  and  resid   14 and name  HD1#) (segid  c  and  resid    7 and name  HG#)  3.65  1.85  1.85
OR assign  (segid  b  and  resid   14 and name  HD1#) (segid  a  and  resid    7 and name  HG#)
OR assign  (segid  b  and  resid   14 and name  HD1#) (segid  b  and  resid    7 and name  HG#)
   assign  (segid  c  and  resid   14 and name  HD2#) (segid  a  and  resid    7 and name  HG#)  3.65  1.85  1.85
OR assign  (segid  c  and  resid   14 and name  HD2#) (segid  b  and  resid    7 and name  HG#)
OR assign  (segid  c  and  resid   14 and name  HD2#) (segid  c  and  resid    7 and name  HG#)
   assign  (segid  a  and  resid   14 and name  HD2#) (segid  b  and  resid    7 and name  HG#)  3.65  1.85  1.85
OR assign  (segid  a  and  resid   14 and name  HD2#) (segid  c  and  resid    7 and name  HG#)  3.65  1.85  1.85
OR assign  (segid  a  and  resid   14 and name  HD2#) (segid  a  and  resid    7 and name  HG#)  3.65  1.85  1.85
   assign  (segid  b  and  resid   14 and name  HD2#) (segid  c  and  resid    7 and name  HG#)  3.65  1.85  1.85
OR assign  (segid  b  and  resid   14 and name  HD2#) (segid  a  and  resid    7 and name  HG#)  3.65  1.85  1.85
OR assign  (segid  b  and  resid   14 and name  HD2#) (segid  b  and  resid    7 and name  HG#)  3.65  1.85  1.85
assign (segid a and resid 4 and name HN)  (segid a and resid 5 and name HN)  2.40 0.60 0.60
assign (segid b and resid 4 and name HN)  (segid b and resid 5 and name HN)  2.40 0.60 0.60
assign (segid c and resid 4 and name HN)  (segid c and resid 5 and name HN)  2.40 0.60 0.60
assign (segid a and resid 5 and name HN)  (segid a and resid 6 and name HN)  2.40 0.60 0.60
assign (segid b and resid 5 and name HN)  (segid b and resid 6 and name HN)  2.40 0.60 0.60
assign (segid c and resid 5 and name HN)  (segid c and resid 6 and name HN)  2.40 0.60 0.60
assign (segid a and resid 6 and name HN)  (segid a and resid 7 and name HN)  2.40 0.60 0.60
assign (segid b and resid 6 and name HN)  (segid b and resid 7 and name HN)  2.40 0.60 0.60
assign (segid c and resid 6 and name HN)  (segid c and resid 7 and name HN)  2.40 0.60 0.60
assign (segid a and resid 7 and name HN)  (segid a and resid 8 and name HN)  2.40 0.60 0.60
assign (segid b and resid 7 and name HN)  (segid b and resid 8 and name HN)  2.40 0.60 0.60
assign (segid c and resid 7 and name HN)  (segid c and resid 8 and name HN)  2.40 0.60 0.60
assign (segid a and resid 8 and name HN)  (segid a and resid 9 and name HN)  2.40 0.60 0.60
assign (segid b and resid 8 and name HN)  (segid b and resid 9 and name HN)  2.40 0.60 0.60
assign (segid c and resid 8 and name HN)  (segid c and resid 9 and name HN)  2.40 0.60 0.60
assign (segid a and resid 9 and name HN)  (segid a and resid 10 and name HN) 2.40 0.60 0.60
assign (segid b and resid 9 and name HN)  (segid b and resid 10 and name HN) 2.40 0.60 0.60
assign (segid c and resid 9 and name HN)  (segid c and resid 10 and name HN) 2.40 0.60 0.60
assign (segid a and resid 10 and name HN) (segid a and resid 11 and name HN) 2.40 0.60 0.60
assign (segid b and resid 10 and name HN) (segid b and resid 11 and name HN) 2.40 0.60 0.60
assign (segid c and resid 10 and name HN) (segid c and resid 11 and name HN) 2.40 0.60 0.60
assign (segid a and resid 11 and name HN) (segid a and resid 12 and name HN) 2.40 0.60 0.60
assign (segid b and resid 11 and name HN) (segid b and resid 12 and name HN) 2.40 0.60 0.60
assign (segid c and resid 11 and name HN) (segid c and resid 12 and name HN) 2.40 0.60 0.60
assign (segid a and resid 12 and name HN) (segid a and resid 13 and name HN) 2.40 0.60 0.60
assign (segid b and resid 12 and name HN) (segid b and resid 13 and name HN) 2.40 0.60 0.60
assign (segid c and resid 12 and name HN) (segid c and resid 13 and name HN) 2.40 0.60 0.60
assign (segid a and resid 13 and name HN) (segid a and resid 14 and name HN) 2.40 0.60 0.60
assign (segid b and resid 13 and name HN) (segid b and resid 14 and name HN) 2.40 0.60 0.60
assign (segid c and resid 13 and name HN) (segid c and resid 14 and name HN) 2.40 0.60 0.60
assign (segid a and resid 14 and name HN) (segid a and resid 15 and name HN) 2.40 0.60 0.60
assign (segid b and resid 14 and name HN) (segid b and resid 15 and name HN) 2.40 0.60 0.60
assign (segid c and resid 14 and name HN) (segid c and resid 15 and name HN) 2.40 0.60 0.60
assign (segid a and resid 15 and name HN) (segid a and resid 16 and name HN) 2.40 0.60 0.60
assign (segid b and resid 15 and name HN) (segid b and resid 16 and name HN) 2.40 0.60 0.60
assign (segid c and resid 15 and name HN) (segid c and resid 16 and name HN) 2.40 0.60 0.60
assign (segid a and resid 16 and name HN) (segid a and resid 17 and name HN) 2.40 0.60 0.60
assign (segid b and resid 16 and name HN) (segid b and resid 17 and name HN) 2.40 0.60 0.60
assign (segid c and resid 16 and name HN) (segid c and resid 17 and name HN) 2.40 0.60 0.60
 assign  (segid  a  and  resid    2 and name   HA) (segid  a  and  resid    5 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    2 and name   HA) (segid  b  and  resid    5 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    2 and name   HA) (segid  c  and  resid    5 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    3 and name   HA) (segid  a  and  resid    6 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    3 and name   HA) (segid  b  and  resid    6 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    3 and name   HA) (segid  c  and  resid    6 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    4 and name   HA) (segid  a  and  resid    7 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    4 and name   HA) (segid  b  and  resid    7 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    4 and name   HA) (segid  c  and  resid    7 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    5 and name   HA) (segid  a  and  resid    8 and name   HB)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    5 and name   HA) (segid  b  and  resid    8 and name   HB)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    5 and name   HA) (segid  c  and  resid    8 and name   HB)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    6 and name   HA) (segid  a  and  resid    9 and name   HN)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    6 and name   HA) (segid  b  and  resid    9 and name   HN)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    6 and name   HA) (segid  c  and  resid    9 and name   HN)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    6 and name   HA) (segid  a  and  resid    9 and name   HB)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    6 and name   HA) (segid  b  and  resid    9 and name   HB)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    6 and name   HA) (segid  c  and  resid    9 and name   HB)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    6 and name   HA) (segid  a  and  resid    9 and name HG2#)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    6 and name   HA) (segid  b  and  resid    9 and name HG2#)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    6 and name   HA) (segid  c  and  resid    9 and name HG2#)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    7 and name   HA) (segid  a  and  resid   10 and name   HE)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    7 and name   HA) (segid  b  and  resid   10 and name   HE)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    7 and name   HA) (segid  c  and  resid   10 and name   HE)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    7 and name  HG#) (segid  a  and  resid   10 and name   HE)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    7 and name  HG#) (segid  b  and  resid   10 and name   HE)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    7 and name  HG#) (segid  c  and  resid   10 and name   HE)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   14 and name HD1#) (segid  a  and  resid   10 and name   HE)  3.65  1.85  1.85 
 assign  (segid  b  and  resid   14 and name HD1#) (segid  b  and  resid   10 and name   HE)  3.65  1.85  1.85 
 assign  (segid  c  and  resid   14 and name HD1#) (segid  c  and  resid   10 and name   HE)  3.65  1.85  1.85 
 assign  (segid  a  and  resid   14 and name HD2#) (segid  a  and  resid   10 and name   HE)  3.65  1.85  1.85 
 assign  (segid  b  and  resid   14 and name HD2#) (segid  b  and  resid   10 and name   HE)  3.65  1.85  1.85 
 assign  (segid  c  and  resid   14 and name HD2#) (segid  c  and  resid   10 and name   HE)  3.65  1.85  1.85 
 assign  (segid  a  and  resid    7 and name   HA) (segid  a  and  resid   10 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    7 and name   HA) (segid  b  and  resid   10 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    7 and name   HA) (segid  c  and  resid   10 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    8 and name   HA) (segid  a  and  resid   11 and name  HB#)  2.65  0.85  0.85 
 assign  (segid  b  and  resid    8 and name   HA) (segid  b  and  resid   11 and name  HB#)  2.65  0.85  0.85 
 assign  (segid  c  and  resid    8 and name   HA) (segid  c  and  resid   11 and name  HB#)  2.65  0.85  0.85 
 assign  (segid  a  and  resid   12 and name   HA) (segid  a  and  resid   15 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   12 and name   HA) (segid  b  and  resid   15 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   12 and name   HA) (segid  c  and  resid   15 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   12 and name   HA) (segid  a  and  resid   15 and name HD1#)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   12 and name   HA) (segid  b  and  resid   15 and name HD1#)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   12 and name   HA) (segid  c  and  resid   15 and name HD1#)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   12 and name   HA) (segid  a  and  resid   15 and name HD2#)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   12 and name   HA) (segid  b  and  resid   15 and name HD2#)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   12 and name   HA) (segid  c  and  resid   15 and name HD2#)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   13 and name   HA) (segid  a  and  resid   16 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   13 and name   HA) (segid  b  and  resid   16 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   13 and name   HA) (segid  c  and  resid   16 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   14 and name   HA) (segid  a  and  resid   17 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   14 and name   HA) (segid  b  and  resid   17 and name  HB#)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   14 and name   HA) (segid  c  and  resid   17 and name  HB#)  3.40  1.60  1.60 
assign (segid a and resid 7 and name OE1)  (segid a and resid 10 and name HE)  2.00 0.20 0.20
assign (segid a and resid 7 and name OE1)  (segid a and resid 10 and name NE)  3.00 0.20 0.20
assign (segid b and resid 7 and name OE1)  (segid b and resid 10 and name HE)  2.00 0.20 0.20
assign (segid b and resid 7 and name OE1)  (segid b and resid 10 and name NE)  3.00 0.20 0.20
assign (segid c and resid 7 and name OE1)  (segid c and resid 10 and name HE)  2.00 0.20 0.20
assign (segid c and resid 7 and name OE1)  (segid c and resid 10 and name NE)  3.00 0.20 0.20
 assign  (segid  a  and  resid    1 and name   HN) (segid  a  and  resid    1 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    1 and name   HN) (segid  b  and  resid    1 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    1 and name   HN) (segid  c  and  resid    1 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    1 and name   HN) (segid  a  and  resid    1 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    1 and name   HN) (segid  b  and  resid    1 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    1 and name   HN) (segid  c  and  resid    1 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    1 and name   HN) (segid  a  and  resid    1 and name  HG*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    1 and name   HN) (segid  b  and  resid    1 and name  HG*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    1 and name   HN) (segid  c  and  resid    1 and name  HG*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    1 and name   HN) (segid  a  and  resid    1 and name  HD2)  3.65  1.85  1.85 
 assign  (segid  b  and  resid    1 and name   HN) (segid  b  and  resid    1 and name  HD2)  3.65  1.85  1.85 
 assign  (segid  c  and  resid    1 and name   HN) (segid  c  and  resid    1 and name  HD2)  3.65  1.85  1.85 
 assign  (segid  a  and  resid    1 and name   HA) (segid  a  and  resid    1 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    1 and name   HA) (segid  b  and  resid    1 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    1 and name   HA) (segid  c  and  resid    1 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    1 and name   HA) (segid  a  and  resid    1 and name  HG*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    1 and name   HA) (segid  b  and  resid    1 and name  HG*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    1 and name   HA) (segid  c  and  resid    1 and name  HG*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    2 and name   HN) (segid  a  and  resid    2 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    2 and name   HN) (segid  b  and  resid    2 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    2 and name   HN) (segid  c  and  resid    2 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    2 and name   HN) (segid  a  and  resid    2 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    2 and name   HN) (segid  b  and  resid    2 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    2 and name   HN) (segid  c  and  resid    2 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    2 and name   HA) (segid  a  and  resid    2 and name  HB*)  2.40  0.60  0.60 
 assign  (segid  b  and  resid    2 and name   HA) (segid  b  and  resid    2 and name  HB*)  2.40  0.60  0.60 
 assign  (segid  c  and  resid    2 and name   HA) (segid  c  and  resid    2 and name  HB*)  2.40  0.60  0.60 
 assign  (segid  a  and  resid    3 and name   HA) (segid  a  and  resid    3 and name  HB*)  2.40  0.60  0.60 
 assign  (segid  b  and  resid    3 and name   HA) (segid  b  and  resid    3 and name  HB*)  2.40  0.60  0.60 
 assign  (segid  c  and  resid    3 and name   HA) (segid  c  and  resid    3 and name  HB*)  2.40  0.60  0.60 
 assign  (segid  a  and  resid    3 and name   HA) (segid  a  and  resid    3 and name  HG*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    3 and name   HA) (segid  b  and  resid    3 and name  HG*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    3 and name   HA) (segid  c  and  resid    3 and name  HG*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    3 and name   HA) (segid  a  and  resid    3 and name  HD*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    3 and name   HA) (segid  b  and  resid    3 and name  HD*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    3 and name   HA) (segid  c  and  resid    3 and name  HD*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    4 and name   HN) (segid  a  and  resid    4 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    4 and name   HN) (segid  b  and  resid    4 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    4 and name   HN) (segid  c  and  resid    4 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    4 and name   HN) (segid  a  and  resid    4 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    4 and name   HN) (segid  b  and  resid    4 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    4 and name   HN) (segid  c  and  resid    4 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    4 and name   HN) (segid  a  and  resid    4 and name  HG*)  2.40  0.60  0.60 
 assign  (segid  b  and  resid    4 and name   HN) (segid  b  and  resid    4 and name  HG*)  2.40  0.60  0.60 
 assign  (segid  c  and  resid    4 and name   HN) (segid  c  and  resid    4 and name  HG*)  2.40  0.60  0.60 
 assign  (segid  a  and  resid    4 and name   HA) (segid  a  and  resid    4 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    4 and name   HA) (segid  b  and  resid    4 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    4 and name   HA) (segid  c  and  resid    4 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    5 and name   HN) (segid  a  and  resid    5 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    5 and name   HN) (segid  b  and  resid    5 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    5 and name   HN) (segid  c  and  resid    5 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    5 and name   HN) (segid  a  and  resid    5 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    5 and name   HN) (segid  b  and  resid    5 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    5 and name   HN) (segid  c  and  resid    5 and name  HB#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    5 and name   HA) (segid  a  and  resid    5 and name  HB#)  2.40  0.60  0.60 
 assign  (segid  b  and  resid    5 and name   HA) (segid  b  and  resid    5 and name  HB#)  2.40  0.60  0.60 
 assign  (segid  c  and  resid    5 and name   HA) (segid  c  and  resid    5 and name  HB#)  2.40  0.60  0.60 
 assign  (segid  a  and  resid    6 and name   HN) (segid  a  and  resid    6 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    6 and name   HN) (segid  b  and  resid    6 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    6 and name   HN) (segid  c  and  resid    6 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    6 and name   HN) (segid  a  and  resid    6 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    6 and name   HN) (segid  b  and  resid    6 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    6 and name   HN) (segid  c  and  resid    6 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    6 and name   HN) (segid  a  and  resid    6 and name  HG*)  2.40  0.60  0.60 
 assign  (segid  b  and  resid    6 and name   HN) (segid  b  and  resid    6 and name  HG*)  2.40  0.60  0.60 
 assign  (segid  c  and  resid    6 and name   HN) (segid  c  and  resid    6 and name  HG*)  2.40  0.60  0.60 
 assign  (segid  a  and  resid    6 and name   HA) (segid  a  and  resid    6 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    6 and name   HA) (segid  b  and  resid    6 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    6 and name   HA) (segid  c  and  resid    6 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    7 and name   HN) (segid  a  and  resid    7 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    7 and name   HN) (segid  b  and  resid    7 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    7 and name   HN) (segid  c  and  resid    7 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    7 and name   HN) (segid  a  and  resid    7 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    7 and name   HN) (segid  b  and  resid    7 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    7 and name   HN) (segid  c  and  resid    7 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    7 and name   HN) (segid  a  and  resid    7 and name  HG*)  3.65  1.85  1.85 
 assign  (segid  b  and  resid    7 and name   HN) (segid  b  and  resid    7 and name  HG*)  3.65  1.85  1.85 
 assign  (segid  c  and  resid    7 and name   HN) (segid  c  and  resid    7 and name  HG*)  3.65  1.85  1.85 
 assign  (segid  a  and  resid    7 and name   HA) (segid  a  and  resid    7 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    7 and name   HA) (segid  b  and  resid    7 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    7 and name   HA) (segid  c  and  resid    7 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    8 and name   HN) (segid  a  and  resid    8 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    8 and name   HN) (segid  b  and  resid    8 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    8 and name   HN) (segid  c  and  resid    8 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    8 and name   HN) (segid  a  and  resid    8 and name   HB)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    8 and name   HN) (segid  b  and  resid    8 and name   HB)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    8 and name   HN) (segid  c  and  resid    8 and name   HB)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    8 and name   HN) (segid  a  and  resid    8 and name HG2#)  3.65  1.85  1.85 
 assign  (segid  b  and  resid    8 and name   HN) (segid  b  and  resid    8 and name HG2#)  3.65  1.85  1.85 
 assign  (segid  c  and  resid    8 and name   HN) (segid  c  and  resid    8 and name HG2#)  3.65  1.85  1.85 
 assign  (segid  a  and  resid    8 and name   HN) (segid  a  and  resid    8 and name HD1#)  3.40  1.60  1.60 
 assign  (segid  b  and  resid    8 and name   HN) (segid  b  and  resid    8 and name HD1#)  3.40  1.60  1.60 
 assign  (segid  c  and  resid    8 and name   HN) (segid  c  and  resid    8 and name HD1#)  3.40  1.60  1.60 
 assign  (segid  a  and  resid    8 and name   HA) (segid  a  and  resid    8 and name HG2#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    8 and name   HA) (segid  b  and  resid    8 and name HG2#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    8 and name   HA) (segid  c  and  resid    8 and name HG2#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    8 and name   HA) (segid  a  and  resid    8 and name HD1#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    8 and name   HA) (segid  b  and  resid    8 and name HD1#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    8 and name   HA) (segid  c  and  resid    8 and name HD1#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    9 and name   HN) (segid  a  and  resid    9 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    9 and name   HN) (segid  b  and  resid    9 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    9 and name   HN) (segid  c  and  resid    9 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    9 and name   HN) (segid  a  and  resid    9 and name   HB)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    9 and name   HN) (segid  b  and  resid    9 and name   HB)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    9 and name   HN) (segid  c  and  resid    9 and name   HB)  2.90  1.10  1.10 
 assign  (segid  a  and  resid    9 and name   HN) (segid  a  and  resid    9 and name HG2#)  3.65  1.85  1.85 
 assign  (segid  b  and  resid    9 and name   HN) (segid  b  and  resid    9 and name HG2#)  3.65  1.85  1.85 
 assign  (segid  c  and  resid    9 and name   HN) (segid  c  and  resid    9 and name HG2#)  3.65  1.85  1.85 
 assign  (segid  a  and  resid    9 and name   HA) (segid  a  and  resid    9 and name HG2#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid    9 and name   HA) (segid  b  and  resid    9 and name HG2#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid    9 and name   HA) (segid  c  and  resid    9 and name HG2#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   10 and name   HN) (segid  a  and  resid   10 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   10 and name   HN) (segid  b  and  resid   10 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   10 and name   HN) (segid  c  and  resid   10 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   10 and name   HN) (segid  a  and  resid   10 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   10 and name   HN) (segid  b  and  resid   10 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   10 and name   HN) (segid  c  and  resid   10 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   10 and name   HA) (segid  a  and  resid   10 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   10 and name   HA) (segid  b  and  resid   10 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   10 and name   HA) (segid  c  and  resid   10 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   10 and name   HA) (segid  a  and  resid   10 and name  HG*)  2.40  0.60  0.60 
 assign  (segid  b  and  resid   10 and name   HA) (segid  b  and  resid   10 and name  HG*)  2.40  0.60  0.60 
 assign  (segid  c  and  resid   10 and name   HA) (segid  c  and  resid   10 and name  HG*)  2.40  0.60  0.60 
 assign  (segid  a  and  resid   12 and name   HN) (segid  a  and  resid   12 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   12 and name   HN) (segid  b  and  resid   12 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   12 and name   HN) (segid  c  and  resid   12 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   12 and name   HN) (segid  a  and  resid   12 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   12 and name   HN) (segid  b  and  resid   12 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   12 and name   HN) (segid  c  and  resid   12 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   12 and name   HA) (segid  a  and  resid   12 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   12 and name   HA) (segid  b  and  resid   12 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   12 and name   HA) (segid  c  and  resid   12 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   13 and name   HN) (segid  a  and  resid   13 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   13 and name   HN) (segid  b  and  resid   13 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   13 and name   HN) (segid  c  and  resid   13 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   13 and name   HN) (segid  a  and  resid   13 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   13 and name   HN) (segid  b  and  resid   13 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   13 and name   HN) (segid  c  and  resid   13 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   13 and name   HA) (segid  a  and  resid   13 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   13 and name   HA) (segid  b  and  resid   13 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   13 and name   HA) (segid  c  and  resid   13 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   14 and name   HN) (segid  a  and  resid   14 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   14 and name   HN) (segid  b  and  resid   14 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   14 and name   HN) (segid  c  and  resid   14 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   14 and name   HN) (segid  a  and  resid   14 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   14 and name   HN) (segid  b  and  resid   14 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   14 and name   HN) (segid  c  and  resid   14 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   14 and name   HN) (segid  a  and  resid   14 and name HD1#)  3.65  1.85  1.85 
 assign  (segid  b  and  resid   14 and name   HN) (segid  b  and  resid   14 and name HD1#)  3.65  1.85  1.85 
 assign  (segid  c  and  resid   14 and name   HN) (segid  c  and  resid   14 and name HD1#)  3.65  1.85  1.85 
 assign  (segid  a  and  resid   14 and name   HN) (segid  a  and  resid   14 and name HD2#)  3.65  1.85  1.85 
 assign  (segid  b  and  resid   14 and name   HN) (segid  b  and  resid   14 and name HD2#)  3.65  1.85  1.85 
 assign  (segid  c  and  resid   14 and name   HN) (segid  c  and  resid   14 and name HD2#)  3.65  1.85  1.85 
 assign  (segid  a  and  resid   14 and name   HA) (segid  a  and  resid   14 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   14 and name   HA) (segid  b  and  resid   14 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   14 and name   HA) (segid  c  and  resid   14 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   14 and name   HA) (segid  a  and  resid   14 and name HD2#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   14 and name   HA) (segid  b  and  resid   14 and name HD2#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   14 and name   HA) (segid  c  and  resid   14 and name HD2#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   15 and name   HN) (segid  a  and  resid   15 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   15 and name   HN) (segid  b  and  resid   15 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   15 and name   HN) (segid  c  and  resid   15 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   15 and name   HN) (segid  a  and  resid   15 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   15 and name   HN) (segid  b  and  resid   15 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   15 and name   HN) (segid  c  and  resid   15 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   15 and name   HN) (segid  a  and  resid   15 and name HD1#)  3.65  1.85  1.85 
 assign  (segid  b  and  resid   15 and name   HN) (segid  b  and  resid   15 and name HD1#)  3.65  1.85  1.85 
 assign  (segid  c  and  resid   15 and name   HN) (segid  c  and  resid   15 and name HD1#)  3.65  1.85  1.85 
 assign  (segid  a  and  resid   15 and name   HN) (segid  a  and  resid   15 and name HD2#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   15 and name   HN) (segid  b  and  resid   15 and name HD2#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   15 and name   HN) (segid  c  and  resid   15 and name HD2#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   15 and name   HA) (segid  a  and  resid   15 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   15 and name   HA) (segid  b  and  resid   15 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   15 and name   HA) (segid  c  and  resid   15 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   15 and name   HA) (segid  a  and  resid   15 and name HD1#)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   15 and name   HA) (segid  b  and  resid   15 and name HD1#)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   15 and name   HA) (segid  c  and  resid   15 and name HD1#)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   15 and name   HA) (segid  a  and  resid   15 and name HD2#)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   15 and name   HA) (segid  b  and  resid   15 and name HD2#)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   15 and name   HA) (segid  c  and  resid   15 and name HD2#)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   16 and name   HN) (segid  a  and  resid   16 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   16 and name   HN) (segid  b  and  resid   16 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   16 and name   HN) (segid  c  and  resid   16 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   16 and name   HN) (segid  a  and  resid   16 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   16 and name   HN) (segid  b  and  resid   16 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   16 and name   HN) (segid  c  and  resid   16 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   17 and name   HN) (segid  a  and  resid   17 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   17 and name   HN) (segid  b  and  resid   17 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   17 and name   HN) (segid  c  and  resid   17 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   17 and name   HN) (segid  a  and  resid   17 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   17 and name   HN) (segid  b  and  resid   17 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   17 and name   HN) (segid  c  and  resid   17 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  a  and  resid   18 and name   HN) (segid  a  and  resid   18 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   18 and name   HN) (segid  b  and  resid   18 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   18 and name   HN) (segid  c  and  resid   18 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   18 and name   HN) (segid  a  and  resid   18 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   18 and name   HN) (segid  b  and  resid   18 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   18 and name   HN) (segid  c  and  resid   18 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   19 and name   HN) (segid  a  and  resid   19 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   19 and name   HN) (segid  b  and  resid   19 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   19 and name   HN) (segid  c  and  resid   19 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   19 and name   HN) (segid  a  and  resid   19 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   19 and name   HN) (segid  b  and  resid   19 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   19 and name   HN) (segid  c  and  resid   19 and name  HB*)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   20 and name   HN) (segid  a  and  resid   20 and name   HA)  2.90  1.10  1.10 
 assign  (segid  b  and  resid   20 and name   HN) (segid  b  and  resid   20 and name   HA)  2.90  1.10  1.10 
 assign  (segid  c  and  resid   20 and name   HN) (segid  c  and  resid   20 and name   HA)  2.90  1.10  1.10 
 assign  (segid  a  and  resid   20 and name   HN) (segid  a  and  resid   20 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  b  and  resid   20 and name   HN) (segid  b  and  resid   20 and name  HB*)  3.40  1.60  1.60 
 assign  (segid  c  and  resid   20 and name   HN) (segid  c  and  resid   20 and name  HB*)  3.40  1.60  1.60 
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           HN       LYS   1  -7.025   5.837  16.414
    2    HA   LYS   1           HA       LYS   1  -9.117   6.378  14.507
    3    HB2  LYS   1           HB2      LYS   1  -8.230   7.818  17.017
    4    HB3  LYS   1           HB1      LYS   1  -9.633   8.285  16.056
    5    HG2  LYS   1           HG2      LYS   1 -10.623   6.055  16.401
    6    HG3  LYS   1           HG1      LYS   1  -9.217   5.576  17.351
    7    HD2  LYS   1           HD2      LYS   1  -9.697   7.371  18.976
    8    HD3  LYS   1           HD1      LYS   1 -11.113   7.842  18.034
    9    HE2  LYS   1           HE2      LYS   1 -10.702   5.086  19.230
   10    HE3  LYS   1           HE1      LYS   1 -11.674   6.357  19.973
   11    HZ1  LYS   1           HZ1      LYS   1 -12.368   4.580  17.883
   12    HZ2  LYS   1           HZ2      LYS   1 -12.496   6.185  17.340
   13    HZ3  LYS   1           HZ3      LYS   1 -13.352   5.681  18.718
   14    H    ASN   2           HN       ASN   2  -6.018   6.842  14.153
   15    HA   ASN   2           HA       ASN   2  -5.720   9.599  13.656
   16    HB2  ASN   2           HB2      ASN   2  -3.668   8.933  12.416
   17    HB3  ASN   2           HB1      ASN   2  -3.785   8.125  13.973
   18   HD21  ASN   2          HD21      ASN   2  -2.231   7.043  11.843
   19   HD22  ASN   2          HD22      ASN   2  -2.980   5.618  11.308
   20    HA   PRO   3           HA       PRO   3  -7.771  10.111   9.775
   21    HB2  PRO   3           HB2      PRO   3  -6.176  12.040   8.596
   22    HB3  PRO   3           HB1      PRO   3  -7.334  12.379   9.898
   23    HG2  PRO   3           HG2      PRO   3  -4.379  11.952  10.063
   24    HG3  PRO   3           HG1      PRO   3  -5.390  13.151  10.889
   25    HD2  PRO   3           HD2      PRO   3  -4.531  10.937  12.138
   26    HD3  PRO   3           HD1      PRO   3  -6.116  11.637  12.493
   27    H    GLU   4           HN       GLU   4  -4.462   9.144   9.922
   28    HA   GLU   4           HA       GLU   4  -3.933   8.761   7.173
   29    HB2  GLU   4           HB2      GLU   4  -2.811   7.418   9.628
   30    HB3  GLU   4           HB1      GLU   4  -2.194   7.142   8.003
   31    HG2  GLU   4           HG2      GLU   4  -1.678   9.515   7.762
   32    HG3  GLU   4           HG1      GLU   4  -2.383   9.855   9.340
   33    H    ALA   5           HN       ALA   5  -5.958   7.100   9.367
   34    HA   ALA   5           HA       ALA   5  -5.900   4.478   8.379
   35    HB1  ALA   5           HB1      ALA   5  -7.079   5.065  10.437
   36    HB2  ALA   5           HB2      ALA   5  -8.189   4.290   9.304
   37    HB3  ALA   5           HB3      ALA   5  -8.229   6.040   9.520
   38    H    GLU   6           HN       GLU   6  -7.296   7.393   7.089
   39    HA   GLU   6           HA       GLU   6  -9.174   6.283   5.303
   40    HB2  GLU   6           HB2      GLU   6  -7.553   8.831   5.177
   41    HB3  GLU   6           HB1      GLU   6  -8.819   8.427   4.017
   42    HG2  GLU   6           HG2      GLU   6 -10.465   8.283   5.824
   43    HG3  GLU   6           HG1      GLU   6  -9.209   8.603   7.018
   44    H    GLU   7           HN       GLU   7  -5.695   6.818   5.053
   45    HA   GLU   7           HA       GLU   7  -5.418   6.296   2.301
   46    HB2  GLU   7           HB2      GLU   7  -3.608   7.303   3.601
   47    HB3  GLU   7           HB1      GLU   7  -3.458   5.834   4.566
   48    HG2  GLU   7           HG2      GLU   7  -1.744   5.923   2.785
   49    HG3  GLU   7           HG1      GLU   7  -2.825   4.555   2.550
   50    H    ILE   8           HN       ILE   8  -5.431   4.164   5.106
   51    HA   ILE   8           HA       ILE   8  -4.694   1.774   3.786
   52    HB   ILE   8           HB       ILE   8  -6.271   2.326   6.305
   53   HG12  ILE   8          HG12      ILE   8  -4.222   1.409   7.354
   54   HG13  ILE   8          HG11      ILE   8  -3.514   1.175   5.760
   55   HG21  ILE   8          HG21      ILE   8  -5.841  -0.201   6.702
   56   HG22  ILE   8          HG22      ILE   8  -5.637  -0.298   4.952
   57   HG23  ILE   8          HG23      ILE   8  -7.168   0.250   5.631
   58   HD11  ILE   8          HD11      ILE   8  -4.507   3.892   6.593
   59   HD12  ILE   8          HD12      ILE   8  -3.294   3.475   5.382
   60   HD13  ILE   8          HD13      ILE   8  -2.915   3.327   7.096
   61    H    THR   9           HN       THR   9  -7.828   3.308   4.381
   62    HA   THR   9           HA       THR   9  -9.462   1.250   3.363
   63    HB   THR   9           HB       THR   9  -9.919   4.245   3.345
   64    HG1  THR   9           HG1      THR   9 -10.288   2.178   5.202
   65   HG21  THR   9          HG21      THR   9 -11.495   3.314   1.841
   66   HG22  THR   9          HG22      THR   9 -12.359   3.419   3.375
   67   HG23  THR   9          HG23      THR   9 -11.713   1.870   2.831
   68    H    ARG  10           HN       ARG  10  -7.850   3.990   1.798
   69    HA   ARG  10           HA       ARG  10  -8.954   3.666  -0.781
   70    HB2  ARG  10           HB2      ARG  10  -7.693   5.678  -0.044
   71    HB3  ARG  10           HB1      ARG  10  -6.211   4.722  -0.051
   72    HG2  ARG  10           HG2      ARG  10  -6.485   4.269  -2.445
   73    HG3  ARG  10           HG1      ARG  10  -8.004   5.164  -2.456
   74    HD2  ARG  10           HD2      ARG  10  -6.287   6.642  -3.279
   75    HD3  ARG  10           HD1      ARG  10  -6.726   7.180  -1.662
   76    HE   ARG  10           HE       ARG  10  -4.566   5.389  -1.420
   77   HH11  ARG  10          HH11      ARG  10  -2.470   6.215  -1.167
   78   HH12  ARG  10          HH12      ARG  10  -2.120   7.844  -1.634
   79   HH21  ARG  10          HH21      ARG  10  -5.342   8.503  -2.725
   80   HH22  ARG  10          HH22      ARG  10  -3.744   9.136  -2.520
   81    H    CYS  11           HN       CYS  11  -6.070   2.289   0.760
   82    HA   CYS  11           HA       CYS  11  -4.937   0.998  -1.440
   83    HB2  CYS  11           HB2      CYS  11  -4.995   0.310   1.485
   84    HB3  CYS  11           HB1      CYS  11  -4.127  -0.677   0.313
   85    H    LYS  12           HN       LYS  12  -7.441  -0.141   0.797
   86    HA   LYS  12           HA       LYS  12  -7.743  -2.722  -0.261
   87    HB2  LYS  12           HB2      LYS  12  -8.742  -2.006   1.875
   88    HB3  LYS  12           HB1      LYS  12  -9.848  -0.946   1.001
   89    HG2  LYS  12           HG2      LYS  12 -10.824  -2.877  -0.158
   90    HG3  LYS  12           HG1      LYS  12  -9.686  -3.956   0.650
   91    HD2  LYS  12           HD2      LYS  12 -10.624  -3.299   2.836
   92    HD3  LYS  12           HD1      LYS  12 -11.766  -2.229   2.020
   93    HE2  LYS  12           HE2      LYS  12 -12.733  -4.152   0.826
   94    HE3  LYS  12           HE1      LYS  12 -11.583  -5.230   1.618
   95    HZ1  LYS  12           HZ1      LYS  12 -12.695  -3.861   3.678
   96    HZ2  LYS  12           HZ2      LYS  12 -13.131  -5.427   3.185
   97    HZ3  LYS  12           HZ3      LYS  12 -14.010  -4.082   2.630
   98    H    LYS  13           HN       LYS  13  -9.348   0.328  -1.109
   99    HA   LYS  13           HA       LYS  13 -11.089  -0.742  -3.064
  100    HB2  LYS  13           HB2      LYS  13 -11.323   1.511  -2.042
  101    HB3  LYS  13           HB1      LYS  13  -9.906   2.025  -2.959
  102    HG2  LYS  13           HG2      LYS  13 -11.010   1.656  -5.054
  103    HG3  LYS  13           HG1      LYS  13 -12.354   0.826  -4.274
  104    HD2  LYS  13           HD2      LYS  13 -13.124   3.045  -4.771
  105    HD3  LYS  13           HD1      LYS  13 -12.824   2.996  -3.035
  106    HE2  LYS  13           HE2      LYS  13 -10.714   4.131  -3.287
  107    HE3  LYS  13           HE1      LYS  13 -10.790   3.995  -5.044
  108    HZ1  LYS  13           HZ1      LYS  13 -12.978   5.327  -3.624
  109    HZ2  LYS  13           HZ2      LYS  13 -12.373   5.606  -5.186
  110    HZ3  LYS  13           HZ3      LYS  13 -11.517   6.164  -3.829
  111    H    LEU  14           HN       LEU  14  -7.782   0.485  -3.220
  112    HA   LEU  14           HA       LEU  14  -7.505   0.447  -6.026
  113    HB2  LEU  14           HB2      LEU  14  -5.525   0.189  -3.761
  114    HB3  LEU  14           HB1      LEU  14  -5.016   0.212  -5.443
  115    HG   LEU  14           HG       LEU  14  -6.771   2.373  -4.244
  116   HD11  LEU  14          HD11      LEU  14  -4.838   2.679  -2.964
  117   HD12  LEU  14          HD12      LEU  14  -4.469   3.670  -4.365
  118   HD13  LEU  14          HD13      LEU  14  -3.770   2.057  -4.218
  119   HD21  LEU  14          HD21      LEU  14  -5.243   1.986  -6.826
  120   HD22  LEU  14          HD22      LEU  14  -5.538   3.613  -6.224
  121   HD23  LEU  14          HD23      LEU  14  -6.893   2.557  -6.589
  122    H    LEU  15           HN       LEU  15  -6.895  -2.030  -3.572
  123    HA   LEU  15           HA       LEU  15  -5.770  -3.952  -5.307
  124    HB2  LEU  15           HB2      LEU  15  -7.323  -4.255  -2.724
  125    HB3  LEU  15           HB1      LEU  15  -6.472  -5.577  -3.523
  126    HG   LEU  15           HG       LEU  15  -5.146  -2.986  -2.686
  127   HD11  LEU  15          HD11      LEU  15  -5.361  -5.646  -1.271
  128   HD12  LEU  15          HD12      LEU  15  -5.826  -4.057  -0.660
  129   HD13  LEU  15          HD13      LEU  15  -4.122  -4.454  -0.884
  130   HD21  LEU  15          HD21      LEU  15  -3.110  -4.678  -2.849
  131   HD22  LEU  15          HD22      LEU  15  -3.724  -3.879  -4.287
  132   HD23  LEU  15          HD23      LEU  15  -4.191  -5.545  -3.945
  133    H    ASP  16           HN       ASP  16  -9.116  -3.346  -4.311
  134    HA   ASP  16           HA       ASP  16 -10.248  -5.546  -5.718
  135    HB2  ASP  16           HB2      ASP  16 -11.411  -2.952  -4.703
  136    HB3  ASP  16           HB1      ASP  16 -12.380  -4.192  -5.499
  137    H    ASP  17           HN       ASP  17  -9.635  -2.172  -6.550
  138    HA   ASP  17           HA       ASP  17 -10.959  -2.212  -9.064
  139    HB2  ASP  17           HB2      ASP  17  -8.827  -0.404  -7.923
  140    HB3  ASP  17           HB1      ASP  17  -9.559  -0.159  -9.505
  141    H    SER  18           HN       SER  18  -8.112  -3.651  -7.998
  142    HA   SER  18           HA       SER  18  -6.390  -3.444 -10.166
  143    HB2  SER  18           HB2      SER  18  -5.977  -4.601  -7.917
  144    HB3  SER  18           HB1      SER  18  -6.797  -5.992  -8.614
  145    HG   SER  18           HG       SER  18  -5.232  -5.752 -10.388
  146    H    SER  19           HN       SER  19  -9.281  -5.293  -9.777
  147    HA   SER  19           HA       SER  19  -8.844  -6.907 -12.150
  148    HB2  SER  19           HB2      SER  19 -11.034  -7.830 -11.723
  149    HB3  SER  19           HB1      SER  19 -10.180  -7.711 -10.186
  150    HG   SER  19           HG       SER  19 -11.327  -5.415 -10.460
  151    H    SER  20           HN       SER  20  -9.866  -3.790 -11.556
  152    HA   SER  20           HA       SER  20 -11.728  -3.542 -13.757
  153    HB2  SER  20           HB2      SER  20 -10.349  -1.312 -12.257
  154    HB3  SER  20           HB1      SER  20 -11.830  -1.212 -13.205
  155    HG   SER  20           HG       SER  20 -11.740  -1.602 -10.696
  156    H1   LYS   1           HN       LYS   1 -11.376  -2.406 -15.690
  157    HA   LYS   1           HA       LYS   1  -8.736  -2.736 -16.788
  158    HB2  LYS   1           HB2      LYS   1 -11.277  -1.563 -17.936
  159    HB3  LYS   1           HB1      LYS   1  -9.785  -1.774 -18.852
  160    HG2  LYS   1           HG2      LYS   1  -9.839  -4.197 -18.398
  161    HG3  LYS   1           HG1      LYS   1 -11.328  -3.990 -17.474
  162    HD2  LYS   1           HD2      LYS   1 -12.456  -3.109 -19.488
  163    HD3  LYS   1           HD1      LYS   1 -10.972  -3.340 -20.415
  164    HE2  LYS   1           HE2      LYS   1 -12.449  -5.562 -18.974
  165    HE3  LYS   1           HE1      LYS   1 -12.601  -5.219 -20.698
  166    HZ1  LYS   1           HZ1      LYS   1 -10.572  -6.650 -19.344
  167    HZ2  LYS   1           HZ2      LYS   1  -9.891  -5.322 -20.156
  168    HZ3  LYS   1           HZ3      LYS   1 -10.813  -6.464 -21.013
  169    H    ASN   2           HN       ASN   2  -9.671  -0.589 -14.682
  170    HA   ASN   2           HA       ASN   2  -9.148   1.906 -15.883
  171    HB2  ASN   2           HB2      ASN   2  -8.942   2.742 -13.548
  172    HB3  ASN   2           HB1      ASN   2 -10.365   1.732 -13.765
  173   HD21  ASN   2          HD21      ASN   2  -9.214   2.102 -11.195
  174   HD22  ASN   2          HD22      ASN   2  -8.523   0.635 -10.699
  175    HA   PRO   3           HA       PRO   3  -4.735   1.930 -16.153
  176    HB2  PRO   3           HB2      PRO   3  -4.207   4.608 -15.687
  177    HB3  PRO   3           HB1      PRO   3  -4.851   3.980 -17.217
  178    HG2  PRO   3           HG2      PRO   3  -6.302   5.263 -14.940
  179    HG3  PRO   3           HG1      PRO   3  -6.524   5.486 -16.686
  180    HD2  PRO   3           HD2      PRO   3  -8.180   3.940 -15.233
  181    HD3  PRO   3           HD1      PRO   3  -7.785   3.548 -16.911
  182    H    GLU   4           HN       GLU   4  -6.352   2.952 -13.285
  183    HA   GLU   4           HA       GLU   4  -4.126   3.469 -11.619
  184    HB2  GLU   4           HB2      GLU   4  -6.925   2.539 -10.989
  185    HB3  GLU   4           HB1      GLU   4  -5.742   2.961  -9.755
  186    HG2  GLU   4           HG2      GLU   4  -5.547   5.218 -10.670
  187    HG3  GLU   4           HG1      GLU   4  -6.650   4.806 -11.982
  188    H    ALA   5           HN       ALA   5  -5.385   0.576 -12.939
  189    HA   ALA   5           HA       ALA   5  -4.719  -1.321 -10.987
  190    HB1  ALA   5           HB1      ALA   5  -6.032  -1.896 -12.968
  191    HB2  ALA   5           HB2      ALA   5  -4.602  -2.923 -12.874
  192    HB3  ALA   5           HB3      ALA   5  -4.643  -1.571 -14.006
  193    H    GLU   6           HN       GLU   6  -2.738   0.509 -13.188
  194    HA   GLU   6           HA       GLU   6  -0.419  -1.094 -13.200
  195    HB2  GLU   6           HB2      GLU   6  -0.793   1.893 -13.477
  196    HB3  GLU   6           HB1      GLU   6   0.759   1.085 -13.698
  197    HG2  GLU   6           HG2      GLU   6  -0.180  -0.294 -15.488
  198    HG3  GLU   6           HG1      GLU   6  -1.769   0.429 -15.238
  199    H    GLU   7           HN       GLU   7  -1.620   1.311 -10.918
  200    HA   GLU   7           HA       GLU   7   0.710   1.566  -9.361
  201    HB2  GLU   7           HB2      GLU   7  -1.159   3.135  -9.150
  202    HB3  GLU   7           HB1      GLU   7  -2.196   1.843  -8.547
  203    HG2  GLU   7           HG2      GLU   7  -1.298   3.213  -6.695
  204    HG3  GLU   7           HG1      GLU   7  -0.722   1.555  -6.584
  205    H    ILE   8           HN       ILE   8  -1.983  -0.701  -9.209
  206    HA   ILE   8           HA       ILE   8  -1.285  -1.976  -6.782
  207    HB   ILE   8           HB       ILE   8  -2.861  -2.881  -9.197
  208   HG12  ILE   8          HG12      ILE   8  -4.739  -2.677  -7.596
  209   HG13  ILE   8          HG11      ILE   8  -3.611  -2.183  -6.338
  210   HG21  ILE   8          HG21      ILE   8  -3.595  -4.764  -7.572
  211   HG22  ILE   8          HG22      ILE   8  -2.107  -4.397  -6.696
  212   HG23  ILE   8          HG23      ILE   8  -2.033  -4.934  -8.373
  213   HD11  ILE   8          HD11      ILE   8  -3.717  -0.677  -8.943
  214   HD12  ILE   8          HD12      ILE   8  -3.181  -0.122  -7.356
  215   HD13  ILE   8          HD13      ILE   8  -4.898  -0.351  -7.676
  216    H    THR   9           HN       THR   9  -0.388  -2.599 -10.149
  217    HA   THR   9           HA       THR   9   1.062  -4.978  -9.719
  218    HB   THR   9           HB       THR   9   1.492  -2.817 -11.795
  219    HG1  THR   9           HG1      THR   9  -0.179  -5.050 -11.547
  220   HG21  THR   9          HG21      THR   9   3.454  -4.132 -11.812
  221   HG22  THR   9          HG22      THR   9   2.441  -4.856 -13.060
  222   HG23  THR   9          HG23      THR   9   2.566  -5.619 -11.475
  223    H    ARG  10           HN       ARG  10   2.003  -1.566  -9.568
  224    HA   ARG  10           HA       ARG  10   4.776  -1.952  -9.174
  225    HB2  ARG  10           HB2      ARG  10   3.746   0.234  -9.740
  226    HB3  ARG  10           HB1      ARG  10   3.033   0.296  -8.128
  227    HG2  ARG  10           HG2      ARG  10   5.264   0.239  -7.113
  228    HG3  ARG  10           HG1      ARG  10   6.005   0.109  -8.708
  229    HD2  ARG  10           HD2      ARG  10   6.135   2.419  -8.053
  230    HD3  ARG  10           HD1      ARG  10   4.895   2.296  -9.295
  231    HE   ARG  10           HE       ARG  10   3.635   2.021  -6.793
  232   HH11  ARG  10          HH11      ARG  10   2.601   3.817  -5.869
  233   HH12  ARG  10          HH12      ARG  10   3.007   5.414  -6.396
  234   HH21  ARG  10          HH21      ARG  10   5.388   4.341  -8.674
  235   HH22  ARG  10          HH22      ARG  10   4.588   5.711  -7.978
  236    H    CYS  11           HN       CYS  11   2.060  -1.738  -6.899
  237    HA   CYS  11           HA       CYS  11   3.471  -1.731  -4.491
  238    HB2  CYS  11           HB2      CYS  11   0.782  -2.815  -5.266
  239    HB3  CYS  11           HB1      CYS  11   1.384  -2.966  -3.619
  240    H    LYS  12           HN       LYS  12   2.421  -4.471  -6.487
  241    HA   LYS  12           HA       LYS  12   3.278  -6.530  -4.775
  242    HB2  LYS  12           HB2      LYS  12   1.834  -6.900  -6.742
  243    HB3  LYS  12           HB1      LYS  12   3.189  -6.514  -7.803
  244    HG2  LYS  12           HG2      LYS  12   4.466  -8.409  -6.896
  245    HG3  LYS  12           HG1      LYS  12   3.145  -8.782  -5.789
  246    HD2  LYS  12           HD2      LYS  12   1.651  -9.174  -7.713
  247    HD3  LYS  12           HD1      LYS  12   2.980  -8.810  -8.815
  248    HE2  LYS  12           HE2      LYS  12   4.276 -10.690  -7.882
  249    HE3  LYS  12           HE1      LYS  12   2.950 -11.055  -6.777
  250    HZ1  LYS  12           HZ1      LYS  12   1.734 -10.949  -9.193
  251    HZ2  LYS  12           HZ2      LYS  12   2.219 -12.371  -8.401
  252    HZ3  LYS  12           HZ3      LYS  12   3.226 -11.662  -9.571
  253    H    LYS  13           HN       LYS  13   4.975  -4.810  -7.377
  254    HA   LYS  13           HA       LYS  13   7.390  -6.277  -7.241
  255    HB2  LYS  13           HB2      LYS  13   6.746  -4.761  -9.111
  256    HB3  LYS  13           HB1      LYS  13   7.027  -3.395  -8.032
  257    HG2  LYS  13           HG2      LYS  13   9.352  -3.925  -7.808
  258    HG3  LYS  13           HG1      LYS  13   9.139  -5.487  -8.598
  259    HD2  LYS  13           HD2      LYS  13  10.097  -4.014 -10.236
  260    HD3  LYS  13           HD1      LYS  13   8.400  -4.215 -10.667
  261    HE2  LYS  13           HE2      LYS  13   7.825  -2.079  -9.703
  262    HE3  LYS  13           HE1      LYS  13   9.436  -1.901  -9.008
  263    HZ1  LYS  13           HZ1      LYS  13   9.165  -2.295 -11.899
  264    HZ2  LYS  13           HZ2      LYS  13  10.350  -1.443 -11.028
  265    HZ3  LYS  13           HZ3      LYS  13   8.807  -0.770 -11.250
  266    H    LEU  14           HN       LEU  14   6.231  -3.409  -5.532
  267    HA   LEU  14           HA       LEU  14   8.641  -2.758  -4.220
  268    HB2  LEU  14           HB2      LEU  14   5.739  -2.290  -3.529
  269    HB3  LEU  14           HB1      LEU  14   7.047  -1.666  -2.535
  270    HG   LEU  14           HG       LEU  14   6.856  -1.131  -5.511
  271   HD11  LEU  14          HD11      LEU  14   4.932  -0.022  -4.786
  272   HD12  LEU  14          HD12      LEU  14   6.135   1.235  -4.557
  273   HD13  LEU  14          HD13      LEU  14   5.576   0.288  -3.177
  274   HD21  LEU  14          HD21      LEU  14   8.557  -0.127  -3.225
  275   HD22  LEU  14          HD22      LEU  14   8.250   0.923  -4.602
  276   HD23  LEU  14          HD23      LEU  14   9.051  -0.621  -4.842
  277    H    LEU  15           HN       LEU  15   5.974  -4.889  -3.297
  278    HA   LEU  15           HA       LEU  15   6.911  -5.490  -0.702
  279    HB2  LEU  15           HB2      LEU  15   5.208  -7.086  -2.633
  280    HB3  LEU  15           HB1      LEU  15   5.467  -7.533  -0.947
  281    HG   LEU  15           HG       LEU  15   4.351  -4.857  -1.828
  282   HD11  LEU  15          HD11      LEU  15   2.962  -7.400  -0.971
  283   HD12  LEU  15          HD12      LEU  15   2.724  -6.490  -2.464
  284   HD13  LEU  15          HD13      LEU  15   2.179  -5.821  -0.925
  285   HD21  LEU  15          HD21      LEU  15   3.516  -5.050   0.676
  286   HD22  LEU  15          HD22      LEU  15   5.143  -4.491   0.326
  287   HD23  LEU  15          HD23      LEU  15   4.880  -6.160   0.833
  288    H    ASP  16           HN       ASP  16   7.481  -7.040  -3.834
  289    HA   ASP  16           HA       ASP  16   9.053  -9.185  -2.814
  290    HB2  ASP  16           HB2      ASP  16   8.839  -7.926  -5.549
  291    HB3  ASP  16           HB1      ASP  16   9.865  -9.319  -5.211
  292    H    ASP  17           HN       ASP  17   9.825  -5.964  -4.036
  293    HA   ASP  17           HA       ASP  17  12.646  -6.262  -3.988
  294    HB2  ASP  17           HB2      ASP  17  10.866  -3.823  -3.946
  295    HB3  ASP  17           HB1      ASP  17  12.623  -3.743  -4.014
  296    H    SER  18           HN       SER  18  10.372  -6.043  -1.521
  297    HA   SER  18           HA       SER  18  11.614  -4.507   0.428
  298    HB2  SER  18           HB2      SER  18   9.331  -5.683   0.527
  299    HB3  SER  18           HB1      SER  18  10.220  -7.105   1.039
  300    HG   SER  18           HG       SER  18  11.130  -5.712   2.705
  301    H    SER  19           HN       SER  19  12.350  -7.686  -0.708
  302    HA   SER  19           HA       SER  19  14.188  -8.287   1.455
  303    HB2  SER  19           HB2      SER  19  14.668 -10.329   0.254
  304    HB3  SER  19           HB1      SER  19  12.926 -10.062   0.218
  305    HG   SER  19           HG       SER  19  13.804  -8.783  -1.842
  306    H    SER  20           HN       SER  20  14.323  -6.442  -1.313
  307    HA   SER  20           HA       SER  20  17.126  -6.842  -1.931
  308    HB2  SER  20           HB2      SER  20  15.357  -4.576  -2.854
  309    HB3  SER  20           HB1      SER  20  16.848  -5.152  -3.596
  310    HG   SER  20           HG       SER  20  14.459  -5.919  -4.188
  311    H1   LYS   1           HN       LYS   1  18.792  -5.310  -1.620
  312    HA   LYS   1           HA       LYS   1  18.620  -3.902   0.884
  313    HB2  LYS   1           HB2      LYS   1  20.816  -4.102  -1.186
  314    HB3  LYS   1           HB1      LYS   1  20.986  -3.259   0.353
  315    HG2  LYS   1           HG2      LYS   1  20.468  -5.342   1.562
  316    HG3  LYS   1           HG1      LYS   1  20.278  -6.190   0.027
  317    HD2  LYS   1           HD2      LYS   1  22.629  -5.672  -0.544
  318    HD3  LYS   1           HD1      LYS   1  22.819  -4.854   1.006
  319    HE2  LYS   1           HE2      LYS   1  22.023  -7.763   0.696
  320    HE3  LYS   1           HE1      LYS   1  23.662  -7.209   1.038
  321    HZ1  LYS   1           HZ1      LYS   1  21.508  -7.559   2.825
  322    HZ2  LYS   1           HZ2      LYS   1  21.988  -5.929   2.839
  323    HZ3  LYS   1           HZ3      LYS   1  23.120  -7.153   3.169
  324    H    ASN   2           HN       ASN   2  17.275  -3.117  -1.867
  325    HA   ASN   2           HA       ASN   2  18.263  -0.550  -2.478
  326    HB2  ASN   2           HB2      ASN   2  16.129  -0.257  -3.714
  327    HB3  ASN   2           HB1      ASN   2  16.867  -1.817  -4.052
  328   HD21  ASN   2          HD21      ASN   2  14.083  -1.401  -4.424
  329   HD22  ASN   2          HD22      ASN   2  13.243  -2.299  -3.255
  330    HA   PRO   3           HA       PRO   3  16.602   1.921   0.791
  331    HB2  PRO   3           HB2      PRO   3  16.079   4.281  -0.558
  332    HB3  PRO   3           HB1      PRO   3  17.708   3.750  -0.094
  333    HG2  PRO   3           HG2      PRO   3  16.323   3.505  -2.731
  334    HG3  PRO   3           HG1      PRO   3  18.001   3.957  -2.380
  335    HD2  PRO   3           HD2      PRO   3  17.352   1.490  -3.212
  336    HD3  PRO   3           HD1      PRO   3  18.672   1.755  -2.066
  337    H    GLU   4           HN       GLU   4  14.757   1.277  -2.057
  338    HA   GLU   4           HA       GLU   4  12.326   2.542  -1.372
  339    HB2  GLU   4           HB2      GLU   4  12.910   0.133  -3.088
  340    HB3  GLU   4           HB1      GLU   4  11.311   0.856  -2.943
  341    HG2  GLU   4           HG2      GLU   4  12.162   2.986  -3.775
  342    HG3  GLU   4           HG1      GLU   4  13.801   2.341  -3.829
  343    H    ALA   5           HN       ALA   5  13.908  -0.209  -0.100
  344    HA   ALA   5           HA       ALA   5  11.766  -1.801   0.755
  345    HB1  ALA   5           HB1      ALA   5  14.100  -2.546   0.890
  346    HB2  ALA   5           HB2      ALA   5  13.334  -2.635   2.478
  347    HB3  ALA   5           HB3      ALA   5  14.435  -1.310   2.103
  348    H    GLU   6           HN       GLU   6  12.986   1.241   1.922
  349    HA   GLU   6           HA       GLU   6  11.915   1.220   4.533
  350    HB2  GLU   6           HB2      GLU   6  12.486   3.489   2.621
  351    HB3  GLU   6           HB1      GLU   6  11.976   3.732   4.292
  352    HG2  GLU   6           HG2      GLU   6  13.917   2.472   5.094
  353    HG3  GLU   6           HG1      GLU   6  14.417   2.152   3.435
  354    H    GLU   7           HN       GLU   7  10.508   2.036   1.400
  355    HA   GLU   7           HA       GLU   7   8.115   3.184   2.333
  356    HB2  GLU   7           HB2      GLU   7   8.811   3.390  -0.002
  357    HB3  GLU   7           HB1      GLU   7   8.655   1.647  -0.221
  358    HG2  GLU   7           HG2      GLU   7   6.669   2.842  -1.081
  359    HG3  GLU   7           HG1      GLU   7   6.234   1.790   0.259
  360    H    ILE   8           HN       ILE   8   9.012  -0.157   1.666
  361    HA   ILE   8           HA       ILE   8   6.457  -1.319   2.001
  362    HB   ILE   8           HB       ILE   8   9.254  -2.414   2.315
  363   HG12  ILE   8          HG12      ILE   8   8.643  -3.584   0.224
  364   HG13  ILE   8          HG11      ILE   8   7.058  -2.831   0.260
  365   HG21  ILE   8          HG21      ILE   8   8.012  -4.675   2.253
  366   HG22  ILE   8          HG22      ILE   8   6.586  -3.760   2.745
  367   HG23  ILE   8          HG23      ILE   8   8.012  -3.791   3.780
  368   HD11  ILE   8          HD11      ILE   8   9.548  -1.146   0.319
  369   HD12  ILE   8          HD12      ILE   8   7.924  -0.713  -0.223
  370   HD13  ILE   8          HD13      ILE   8   8.927  -1.776  -1.206
  371    H    THR   9           HN       THR   9   9.072  -0.624   4.275
  372    HA   THR   9           HA       THR   9   7.937  -1.852   6.542
  373    HB   THR   9           HB       THR   9   9.727   0.584   6.373
  374    HG1  THR   9           HG1      THR   9  10.112  -2.183   6.354
  375   HG21  THR   9          HG21      THR   9   8.869   0.613   8.561
  376   HG22  THR   9          HG22      THR   9  10.356  -0.319   8.727
  377   HG23  THR   9          HG23      THR   9   8.799  -1.147   8.662
  378    H    ARG  10           HN       ARG  10   7.574   1.399   5.179
  379    HA   ARG  10           HA       ARG  10   6.006   2.513   7.249
  380    HB2  ARG  10           HB2      ARG  10   7.069   3.841   5.440
  381    HB3  ARG  10           HB1      ARG  10   5.920   3.158   4.290
  382    HG2  ARG  10           HG2      ARG  10   4.050   4.115   5.552
  383    HG3  ARG  10           HG1      ARG  10   5.168   4.755   6.758
  384    HD2  ARG  10           HD2      ARG  10   4.635   6.556   5.255
  385    HD3  ARG  10           HD1      ARG  10   6.282   6.047   4.900
  386    HE   ARG  10           HE       ARG  10   4.547   4.601   3.216
  387   HH11  ARG  10          HH11      ARG  10   4.255   5.289   1.076
  388   HH12  ARG  10          HH12      ARG  10   4.643   6.916   0.631
  389   HH21  ARG  10          HH21      ARG  10   5.625   7.836   3.825
  390   HH22  ARG  10          HH22      ARG  10   5.414   8.358   2.188
  391    H    CYS  11           HN       CYS  11   5.132   0.713   4.317
  392    HA   CYS  11           HA       CYS  11   2.355   0.974   4.424
  393    HB2  CYS  11           HB2      CYS  11   4.135  -1.228   3.426
  394    HB3  CYS  11           HB1      CYS  11   2.382  -1.330   3.309
  395    H    LYS  12           HN       LYS  12   4.460  -1.394   6.021
  396    HA   LYS  12           HA       LYS  12   2.436  -2.953   7.196
  397    HB2  LYS  12           HB2      LYS  12   4.801  -3.638   7.116
  398    HB3  LYS  12           HB1      LYS  12   5.211  -2.353   8.253
  399    HG2  LYS  12           HG2      LYS  12   3.746  -3.362   9.951
  400    HG3  LYS  12           HG1      LYS  12   3.285  -4.629   8.814
  401    HD2  LYS  12           HD2      LYS  12   5.632  -5.369   8.690
  402    HD3  LYS  12           HD1      LYS  12   6.092  -4.101   9.829
  403    HE2  LYS  12           HE2      LYS  12   4.597  -5.086  11.529
  404    HE3  LYS  12           HE1      LYS  12   4.142  -6.355  10.392
  405    HZ1  LYS  12           HZ1      LYS  12   6.849  -6.423  10.353
  406    HZ2  LYS  12           HZ2      LYS  12   5.852  -7.469  11.246
  407    HZ3  LYS  12           HZ3      LYS  12   6.517  -6.090  11.983
  408    H    LYS  13           HN       LYS  13   4.149  -0.081   8.389
  409    HA   LYS  13           HA       LYS  13   2.909   0.025  10.930
  410    HB2  LYS  13           HB2      LYS  13   4.956   1.293  10.290
  411    HB3  LYS  13           HB1      LYS  13   3.939   2.325   9.284
  412    HG2  LYS  13           HG2      LYS  13   2.704   3.121  11.178
  413    HG3  LYS  13           HG1      LYS  13   3.428   1.911  12.238
  414    HD2  LYS  13           HD2      LYS  13   4.569   3.980  12.677
  415    HD3  LYS  13           HD1      LYS  13   5.676   2.981  11.740
  416    HE2  LYS  13           HE2      LYS  13   5.171   4.184   9.713
  417    HE3  LYS  13           HE1      LYS  13   3.856   5.058  10.498
  418    HZ1  LYS  13           HZ1      LYS  13   6.543   5.223  11.645
  419    HZ2  LYS  13           HZ2      LYS  13   5.298   6.378  11.632
  420    HZ3  LYS  13           HZ3      LYS  13   6.219   6.102  10.232
  421    H    LEU  14           HN       LEU  14   2.027   1.345   7.773
  422    HA   LEU  14           HA       LEU  14  -0.154   2.919   8.621
  423    HB2  LEU  14           HB2      LEU  14   0.503   1.555   6.010
  424    HB3  LEU  14           HB1      LEU  14  -0.930   2.554   6.200
  425    HG   LEU  14           HG       LEU  14   1.852   3.544   6.883
  426   HD11  LEU  14          HD11      LEU  14   2.112   3.212   4.585
  427   HD12  LEU  14          HD12      LEU  14   1.442   4.835   4.606
  428   HD13  LEU  14          HD13      LEU  14   0.402   3.457   4.239
  429   HD21  LEU  14          HD21      LEU  14  -0.897   4.775   6.609
  430   HD22  LEU  14          HD22      LEU  14   0.530   5.760   6.304
  431   HD23  LEU  14          HD23      LEU  14   0.304   5.012   7.877
  432    H    LEU  15           HN       LEU  15   0.033  -0.466   7.603
  433    HA   LEU  15           HA       LEU  15  -2.744  -0.979   7.655
  434    HB2  LEU  15           HB2      LEU  15  -0.364  -2.802   8.090
  435    HB3  LEU  15           HB1      LEU  15  -2.021  -3.372   7.898
  436    HG   LEU  15           HG       LEU  15  -0.597  -1.630   5.870
  437   HD11  LEU  15          HD11      LEU  15  -0.922  -4.632   6.017
  438   HD12  LEU  15          HD12      LEU  15   0.582  -3.715   5.907
  439   HD13  LEU  15          HD13      LEU  15  -0.517  -3.779   4.528
  440   HD21  LEU  15          HD21      LEU  15  -2.501  -2.766   4.431
  441   HD22  LEU  15          HD22      LEU  15  -2.864  -1.358   5.416
  442   HD23  LEU  15          HD23      LEU  15  -3.292  -2.968   5.997
  443    H    ASP  16           HN       ASP  16  -0.241  -1.276  10.144
  444    HA   ASP  16           HA       ASP  16  -1.942  -2.369  12.147
  445    HB2  ASP  16           HB2      ASP  16   0.678  -0.875  12.284
  446    HB3  ASP  16           HB1      ASP  16  -0.137  -1.518  13.710
  447    H    ASP  17           HN       ASP  17  -1.009   0.924  11.277
  448    HA   ASP  17           HA       ASP  17  -2.287   2.212  13.461
  449    HB2  ASP  17           HB2      ASP  17  -1.418   3.210  10.746
  450    HB3  ASP  17           HB1      ASP  17  -2.117   4.249  11.984
  451    H    SER  18           HN       SER  18  -3.511   0.620  10.766
  452    HA   SER  18           HA       SER  18  -5.717   2.132  10.020
  453    HB2  SER  18           HB2      SER  18  -4.888  -0.060   8.996
  454    HB3  SER  18           HB1      SER  18  -5.774  -0.867  10.283
  455    HG   SER  18           HG       SER  18  -7.613   0.454   9.526
  456    H    SER  19           HN       SER  19  -5.182   0.215  12.840
  457    HA   SER  19           HA       SER  19  -7.961   0.256  13.678
  458    HB2  SER  19           HB2      SER  19  -7.204  -0.875  15.671
  459    HB3  SER  19           HB1      SER  19  -6.383  -1.595  14.288
  460    HG   SER  19           HG       SER  19  -4.836   0.333  14.931
  461    H    SER  20           HN       SER  20  -5.423   2.415  13.762
  462    HA   SER  20           HA       SER  20  -6.111   3.760  16.232
  463    HB2  SER  20           HB2      SER  20  -4.386   4.814  13.988
  464    HB3  SER  20           HB1      SER  20  -4.406   5.344  15.667
  465    HG   SER  20           HG       SER  20  -2.851   3.560  14.679
  466    H2   ZBR 100           HA3      TBS 100  -2.164  -0.215  -1.254
  467    H4   ZBR 100           HC3      TBS 100   0.622  -0.020   2.081
  468    H6   ZBR 100           HB3      TBS 100   2.001  -1.313  -1.841
  469    H7   ZBR 100          HB11      TBS 100  -1.288  -0.439  -3.442
  470    H7A  ZBR 100          HB12      TBS 100  -0.750  -2.105  -3.248
  471    H8   ZBR 100          HA11      TBS 100  -1.505   0.978   2.262
  472    H8A  ZBR 100          HA12      TBS 100  -2.458  -0.453   1.877
  473    H9   ZBR 100          HC11      TBS 100   3.563  -0.827  -0.134
  474    H9A  ZBR 100          HC12      TBS 100   2.932  -1.878   1.132
  Start of MODEL    2
    1    H1   LYS   1           HN       LYS   1  -7.580   5.066  16.795
    2    HA   LYS   1           HA       LYS   1  -9.645   5.395  14.824
    3    HB2  LYS   1           HB2      LYS   1  -9.133   6.693  17.502
    4    HB3  LYS   1           HB1      LYS   1 -10.509   7.117  16.482
    5    HG2  LYS   1           HG2      LYS   1 -11.251   4.765  16.498
    6    HG3  LYS   1           HG1      LYS   1  -9.873   4.336  17.512
    7    HD2  LYS   1           HD2      LYS   1 -10.681   5.857  19.272
    8    HD3  LYS   1           HD1      LYS   1 -12.058   6.301  18.262
    9    HE2  LYS   1           HE2      LYS   1 -11.454   3.477  19.189
   10    HE3  LYS   1           HE1      LYS   1 -12.625   4.552  19.956
   11    HZ1  LYS   1           HZ1      LYS   1 -12.691   3.505  17.181
   12    HZ2  LYS   1           HZ2      LYS   1 -13.718   4.737  17.743
   13    HZ3  LYS   1           HZ3      LYS   1 -13.794   3.186  18.429
   14    H    ASN   2           HN       ASN   2  -6.683   6.407  14.631
   15    HA   ASN   2           HA       ASN   2  -6.771   9.195  14.399
   16    HB2  ASN   2           HB2      ASN   2  -4.723   8.941  13.008
   17    HB3  ASN   2           HB1      ASN   2  -4.651   7.974  14.479
   18   HD21  ASN   2          HD21      ASN   2  -3.094   7.335  12.156
   19   HD22  ASN   2          HD22      ASN   2  -3.668   5.863  11.534
   20    HA   PRO   3           HA       PRO   3  -9.068   9.880  10.679
   21    HB2  PRO   3           HB2      PRO   3  -7.812  12.151   9.715
   22    HB3  PRO   3           HB1      PRO   3  -8.945  12.155  11.082
   23    HG2  PRO   3           HG2      PRO   3  -5.956  12.139  11.107
   24    HG3  PRO   3           HG1      PRO   3  -7.083  13.074  12.106
   25    HD2  PRO   3           HD2      PRO   3  -5.868  10.861  13.045
   26    HD3  PRO   3           HD1      PRO   3  -7.522  11.281  13.524
   27    H    GLU   4           HN       GLU   4  -5.654   9.389  10.602
   28    HA   GLU   4           HA       GLU   4  -5.213   9.424   7.811
   29    HB2  GLU   4           HB2      GLU   4  -3.777   7.889   9.989
   30    HB3  GLU   4           HB1      GLU   4  -3.193   8.086   8.337
   31    HG2  GLU   4           HG2      GLU   4  -3.818  10.388  10.207
   32    HG3  GLU   4           HG1      GLU   4  -2.201   9.740   9.938
   33    H    ALA   5           HN       ALA   5  -6.970   7.305   9.766
   34    HA   ALA   5           HA       ALA   5  -6.566   4.817   8.548
   35    HB1  ALA   5           HB1      ALA   5  -8.560   4.126   9.597
   36    HB2  ALA   5           HB2      ALA   5  -9.259   5.745   9.535
   37    HB3  ALA   5           HB3      ALA   5  -7.939   5.395  10.653
   38    H    GLU   6           HN       GLU   6  -8.265   7.647   7.463
   39    HA   GLU   6           HA       GLU   6 -10.007   6.497   5.581
   40    HB2  GLU   6           HB2      GLU   6  -8.609   9.180   5.639
   41    HB3  GLU   6           HB1      GLU   6  -9.829   8.749   4.439
   42    HG2  GLU   6           HG2      GLU   6 -11.470   8.351   6.209
   43    HG3  GLU   6           HG1      GLU   6 -10.255   8.689   7.441
   44    H    GLU   7           HN       GLU   7  -6.594   7.410   5.360
   45    HA   GLU   7           HA       GLU   7  -6.299   7.026   2.574
   46    HB2  GLU   7           HB2      GLU   7  -4.643   8.187   4.051
   47    HB3  GLU   7           HB1      GLU   7  -4.200   6.617   4.720
   48    HG2  GLU   7           HG2      GLU   7  -2.625   7.170   2.957
   49    HG3  GLU   7           HG1      GLU   7  -3.644   5.848   2.391
   50    H    ILE   8           HN       ILE   8  -5.975   4.838   5.332
   51    HA   ILE   8           HA       ILE   8  -4.999   2.592   3.910
   52    HB   ILE   8           HB       ILE   8  -6.480   2.917   6.526
   53   HG12  ILE   8          HG12      ILE   8  -4.306   2.125   7.423
   54   HG13  ILE   8          HG11      ILE   8  -3.688   1.977   5.779
   55   HG21  ILE   8          HG21      ILE   8  -7.266   0.787   5.864
   56   HG22  ILE   8          HG22      ILE   8  -5.831   0.411   6.814
   57   HG23  ILE   8          HG23      ILE   8  -5.757   0.379   5.054
   58   HD11  ILE   8          HD11      ILE   8  -3.133   4.144   7.089
   59   HD12  ILE   8          HD12      ILE   8  -4.810   4.594   6.778
   60   HD13  ILE   8          HD13      ILE   8  -3.707   4.308   5.431
   61    H    THR   9           HN       THR   9  -8.274   3.734   4.625
   62    HA   THR   9           HA       THR   9  -9.696   1.493   3.729
   63    HB   THR   9           HB       THR   9 -10.472   4.420   3.607
   64    HG1  THR   9           HG1      THR   9 -10.134   3.897   5.693
   65   HG21  THR   9          HG21      THR   9 -11.979   3.244   2.198
   66   HG22  THR   9          HG22      THR   9 -12.808   3.377   3.749
   67   HG23  THR   9          HG23      THR   9 -12.035   1.858   3.289
   68    H    ARG  10           HN       ARG  10  -8.514   4.345   1.982
   69    HA   ARG  10           HA       ARG  10  -9.610   3.630  -0.542
   70    HB2  ARG  10           HB2      ARG  10  -7.288   5.400   0.224
   71    HB3  ARG  10           HB1      ARG  10  -7.836   5.201  -1.440
   72    HG2  ARG  10           HG2      ARG  10 -10.160   5.873  -0.622
   73    HG3  ARG  10           HG1      ARG  10  -9.390   6.328   0.900
   74    HD2  ARG  10           HD2      ARG  10  -8.630   7.405  -1.824
   75    HD3  ARG  10           HD1      ARG  10  -9.620   8.256  -0.643
   76    HE   ARG  10           HE       ARG  10  -6.734   7.826  -0.516
   77   HH11  ARG  10          HH11      ARG  10  -5.693   8.990   1.135
   78   HH12  ARG  10          HH12      ARG  10  -6.627   9.748   2.380
   79   HH21  ARG  10          HH21      ARG  10  -9.674   8.707   1.097
   80   HH22  ARG  10          HH22      ARG  10  -8.881   9.589   2.359
   81    H    CYS  11           HN       CYS  11  -6.568   2.900   1.086
   82    HA   CYS  11           HA       CYS  11  -5.113   1.795  -1.012
   83    HB2  CYS  11           HB2      CYS  11  -4.389   2.172   1.410
   84    HB3  CYS  11           HB1      CYS  11  -5.163   0.629   1.769
   85    H    LYS  12           HN       LYS  12  -7.468   0.220   1.136
   86    HA   LYS  12           HA       LYS  12  -7.303  -2.348  -0.040
   87    HB2  LYS  12           HB2      LYS  12  -8.344  -1.908   2.166
   88    HB3  LYS  12           HB1      LYS  12  -9.669  -1.074   1.355
   89    HG2  LYS  12           HG2      LYS  12 -10.267  -3.116   0.150
   90    HG3  LYS  12           HG1      LYS  12  -8.891  -3.963   0.858
   91    HD2  LYS  12           HD2      LYS  12  -9.843  -3.604   3.116
   92    HD3  LYS  12           HD1      LYS  12 -11.232  -2.793   2.390
   93    HE2  LYS  12           HE2      LYS  12 -10.405  -5.640   1.757
   94    HE3  LYS  12           HE1      LYS  12 -11.658  -5.210   2.921
   95    HZ1  LYS  12           HZ1      LYS  12 -11.837  -5.380   0.108
   96    HZ2  LYS  12           HZ2      LYS  12 -12.207  -3.797   0.603
   97    HZ3  LYS  12           HZ3      LYS  12 -13.072  -5.112   1.239
   98    H    LYS  13           HN       LYS  13  -9.420   0.428  -0.669
   99    HA   LYS  13           HA       LYS  13 -11.061  -0.806  -2.606
  100    HB2  LYS  13           HB2      LYS  13 -11.591   1.349  -1.479
  101    HB3  LYS  13           HB1      LYS  13 -10.314   2.122  -2.420
  102    HG2  LYS  13           HG2      LYS  13 -11.449   1.515  -4.507
  103    HG3  LYS  13           HG1      LYS  13 -12.704   0.670  -3.599
  104    HD2  LYS  13           HD2      LYS  13 -13.294   2.803  -2.470
  105    HD3  LYS  13           HD1      LYS  13 -12.084   3.635  -3.447
  106    HE2  LYS  13           HE2      LYS  13 -14.456   2.101  -4.552
  107    HE3  LYS  13           HE1      LYS  13 -14.359   3.856  -4.415
  108    HZ1  LYS  13           HZ1      LYS  13 -12.075   3.266  -5.694
  109    HZ2  LYS  13           HZ2      LYS  13 -13.517   3.729  -6.466
  110    HZ3  LYS  13           HZ3      LYS  13 -13.116   2.084  -6.324
  111    H    LEU  14           HN       LEU  14  -7.991   0.934  -2.855
  112    HA   LEU  14           HA       LEU  14  -7.855   1.079  -5.665
  113    HB2  LEU  14           HB2      LEU  14  -5.759   1.003  -3.499
  114    HB3  LEU  14           HB1      LEU  14  -5.337   1.188  -5.200
  115    HG   LEU  14           HG       LEU  14  -7.376   3.003  -3.888
  116   HD11  LEU  14          HD11      LEU  14  -4.362   3.151  -3.776
  117   HD12  LEU  14          HD12      LEU  14  -5.538   3.462  -2.503
  118   HD13  LEU  14          HD13      LEU  14  -5.321   4.633  -3.796
  119   HD21  LEU  14          HD21      LEU  14  -6.373   4.557  -5.702
  120   HD22  LEU  14          HD22      LEU  14  -7.385   3.228  -6.268
  121   HD23  LEU  14          HD23      LEU  14  -5.626   3.102  -6.363
  122    H    LEU  15           HN       LEU  15  -6.756  -1.393  -3.387
  123    HA   LEU  15           HA       LEU  15  -5.516  -3.060  -5.319
  124    HB2  LEU  15           HB2      LEU  15  -6.685  -3.663  -2.597
  125    HB3  LEU  15           HB1      LEU  15  -5.759  -4.824  -3.553
  126    HG   LEU  15           HG       LEU  15  -4.731  -2.090  -2.744
  127   HD11  LEU  15          HD11      LEU  15  -3.393  -3.255  -1.059
  128   HD12  LEU  15          HD12      LEU  15  -4.118  -4.793  -1.524
  129   HD13  LEU  15          HD13      LEU  15  -5.111  -3.541  -0.776
  130   HD21  LEU  15          HD21      LEU  15  -2.499  -3.477  -3.254
  131   HD22  LEU  15          HD22      LEU  15  -3.384  -2.675  -4.546
  132   HD23  LEU  15          HD23      LEU  15  -3.590  -4.408  -4.287
  133    H    ASP  16           HN       ASP  16  -8.783  -2.927  -3.990
  134    HA   ASP  16           HA       ASP  16  -9.773  -5.276  -5.201
  135    HB2  ASP  16           HB2      ASP  16 -11.142  -2.751  -4.268
  136    HB3  ASP  16           HB1      ASP  16 -12.020  -4.147  -4.891
  137    H    ASP  17           HN       ASP  17  -9.560  -1.948  -6.322
  138    HA   ASP  17           HA       ASP  17 -11.113  -2.252  -8.669
  139    HB2  ASP  17           HB2      ASP  17  -8.944  -0.289  -7.917
  140    HB3  ASP  17           HB1      ASP  17  -9.850  -0.195  -9.427
  141    H    SER  18           HN       SER  18  -8.119  -3.538  -7.833
  142    HA   SER  18           HA       SER  18  -6.679  -3.410 -10.221
  143    HB2  SER  18           HB2      SER  18  -5.356  -5.198  -9.350
  144    HB3  SER  18           HB1      SER  18  -5.879  -4.239  -7.969
  145    HG   SER  18           HG       SER  18  -7.168  -5.808  -7.342
  146    H    SER  19           HN       SER  19  -9.481  -5.150  -9.421
  147    HA   SER  19           HA       SER  19  -9.177  -7.197 -11.438
  148    HB2  SER  19           HB2      SER  19 -11.402  -7.901 -10.816
  149    HB3  SER  19           HB1      SER  19 -10.510  -7.532  -9.342
  150    HG   SER  19           HG       SER  19 -12.088  -6.201  -8.960
  151    H    SER  20           HN       SER  20 -10.120  -3.984 -11.419
  152    HA   SER  20           HA       SER  20 -11.940  -4.118 -13.674
  153    HB2  SER  20           HB2      SER  20 -12.139  -2.361 -11.916
  154    HB3  SER  20           HB1      SER  20 -10.605  -1.688 -12.459
  155    HG   SER  20           HG       SER  20 -13.018  -1.251 -13.439
  156    H1   LYS   1           HN       LYS   1 -11.536  -3.305 -15.755
  157    HA   LYS   1           HA       LYS   1  -8.856  -3.773 -16.711
  158    HB2  LYS   1           HB2      LYS   1 -11.420  -2.950 -18.074
  159    HB3  LYS   1           HB1      LYS   1  -9.890  -3.110 -18.937
  160    HG2  LYS   1           HG2      LYS   1  -9.708  -5.453 -18.194
  161    HG3  LYS   1           HG1      LYS   1 -11.232  -5.296 -17.320
  162    HD2  LYS   1           HD2      LYS   1 -12.403  -4.800 -19.429
  163    HD3  LYS   1           HD1      LYS   1 -10.882  -4.943 -20.312
  164    HE2  LYS   1           HE2      LYS   1 -12.147  -7.158 -18.670
  165    HE3  LYS   1           HE1      LYS   1 -12.231  -7.031 -20.427
  166    HZ1  LYS   1           HZ1      LYS   1  -9.811  -7.404 -18.754
  167    HZ2  LYS   1           HZ2      LYS   1  -9.747  -6.995 -20.403
  168    HZ3  LYS   1           HZ3      LYS   1 -10.440  -8.467 -19.917
  169    H    ASN   2           HN       ASN   2  -9.874  -1.333 -15.016
  170    HA   ASN   2           HA       ASN   2  -9.440   0.970 -16.552
  171    HB2  ASN   2           HB2      ASN   2  -9.082   2.108 -14.366
  172    HB3  ASN   2           HB1      ASN   2 -10.509   1.074 -14.354
  173   HD21  ASN   2          HD21      ASN   2  -9.149   1.798 -11.943
  174   HD22  ASN   2          HD22      ASN   2  -8.446   0.396 -11.297
  175    HA   PRO   3           HA       PRO   3  -5.055   1.028 -17.149
  176    HB2  PRO   3           HB2      PRO   3  -4.570   3.753 -17.106
  177    HB3  PRO   3           HB1      PRO   3  -5.310   2.904 -18.479
  178    HG2  PRO   3           HG2      PRO   3  -6.624   4.465 -16.295
  179    HG3  PRO   3           HG1      PRO   3  -6.972   4.451 -18.031
  180    HD2  PRO   3           HD2      PRO   3  -8.492   3.085 -16.277
  181    HD3  PRO   3           HD1      PRO   3  -8.186   2.470 -17.910
  182    H    GLU   4           HN       GLU   4  -6.491   2.431 -14.344
  183    HA   GLU   4           HA       GLU   4  -4.169   3.222 -12.941
  184    HB2  GLU   4           HB2      GLU   4  -6.856   2.297 -11.899
  185    HB3  GLU   4           HB1      GLU   4  -5.607   3.075 -10.926
  186    HG2  GLU   4           HG2      GLU   4  -6.843   4.311 -13.401
  187    HG3  GLU   4           HG1      GLU   4  -7.360   4.669 -11.755
  188    H    ALA   5           HN       ALA   5  -5.314   0.167 -13.816
  189    HA   ALA   5           HA       ALA   5  -4.557  -1.445 -11.654
  190    HB1  ALA   5           HB1      ALA   5  -4.686  -3.271 -13.142
  191    HB2  ALA   5           HB2      ALA   5  -4.230  -2.285 -14.532
  192    HB3  ALA   5           HB3      ALA   5  -5.825  -2.097 -13.802
  193    H    GLU   6           HN       GLU   6  -2.663   0.206 -14.057
  194    HA   GLU   6           HA       GLU   6  -0.295  -1.305 -13.959
  195    HB2  GLU   6           HB2      GLU   6  -0.766   1.646 -14.438
  196    HB3  GLU   6           HB1      GLU   6   0.804   0.868 -14.638
  197    HG2  GLU   6           HG2      GLU   6  -0.135  -0.655 -16.311
  198    HG3  GLU   6           HG1      GLU   6  -1.734   0.049 -16.079
  199    H    GLU   7           HN       GLU   7  -1.507   1.293 -11.881
  200    HA   GLU   7           HA       GLU   7   0.845   1.667 -10.361
  201    HB2  GLU   7           HB2      GLU   7  -1.126   3.215 -10.374
  202    HB3  GLU   7           HB1      GLU   7  -2.014   2.018  -9.431
  203    HG2  GLU   7           HG2      GLU   7  -1.064   3.665  -7.912
  204    HG3  GLU   7           HG1      GLU   7  -0.223   2.135  -7.682
  205    H    ILE   8           HN       ILE   8  -1.920  -0.498  -9.972
  206    HA   ILE   8           HA       ILE   8  -1.200  -1.565  -7.451
  207    HB   ILE   8           HB       ILE   8  -2.909  -2.583  -9.728
  208   HG12  ILE   8          HG12      ILE   8  -4.695  -2.244  -8.036
  209   HG13  ILE   8          HG11      ILE   8  -3.481  -1.717  -6.871
  210   HG21  ILE   8          HG21      ILE   8  -2.100  -4.627  -8.835
  211   HG22  ILE   8          HG22      ILE   8  -3.611  -4.361  -7.970
  212   HG23  ILE   8          HG23      ILE   8  -2.073  -4.000  -7.190
  213   HD11  ILE   8          HD11      ILE   8  -4.763   0.105  -8.196
  214   HD12  ILE   8          HD12      ILE   8  -3.739  -0.361  -9.554
  215   HD13  ILE   8          HD13      ILE   8  -3.011   0.256  -8.069
  216    H    THR   9           HN       THR   9  -0.370  -2.491 -10.765
  217    HA   THR   9           HA       THR   9   0.896  -4.925 -10.210
  218    HB   THR   9           HB       THR   9   1.531  -2.888 -12.361
  219    HG1  THR   9           HG1      THR   9  -0.521  -3.543 -12.648
  220   HG21  THR   9          HG21      THR   9   3.373  -4.369 -12.292
  221   HG22  THR   9          HG22      THR   9   2.324  -5.033 -13.543
  222   HG23  THR   9          HG23      THR   9   2.350  -5.761 -11.938
  223    H    ARG  10           HN       ARG  10   2.148  -1.608 -10.247
  224    HA   ARG  10           HA       ARG  10   4.844  -2.294  -9.665
  225    HB2  ARG  10           HB2      ARG  10   3.267   0.248  -9.253
  226    HB3  ARG  10           HB1      ARG  10   4.986   0.116  -8.882
  227    HG2  ARG  10           HG2      ARG  10   5.312  -0.704 -11.277
  228    HG3  ARG  10           HG1      ARG  10   3.642  -0.220 -11.573
  229    HD2  ARG  10           HD2      ARG  10   5.825   1.601 -10.536
  230    HD3  ARG  10           HD1      ARG  10   5.252   1.557 -12.201
  231    HE   ARG  10           HE       ARG  10   3.853   2.693  -9.904
  232   HH11  ARG  10          HH11      ARG  10   1.995   3.884 -10.444
  233   HH12  ARG  10          HH12      ARG  10   1.328   3.771 -12.038
  234   HH21  ARG  10          HH21      ARG  10   3.740   1.557 -13.177
  235   HH22  ARG  10          HH22      ARG  10   2.318   2.456 -13.587
  236    H    CYS  11           HN       CYS  11   2.021  -1.611  -7.664
  237    HA   CYS  11           HA       CYS  11   3.204  -1.354  -5.159
  238    HB2  CYS  11           HB2      CYS  11   0.735  -1.144  -5.813
  239    HB3  CYS  11           HB1      CYS  11   0.657  -2.894  -5.619
  240    H    LYS  12           HN       LYS  12   2.182  -4.316  -6.838
  241    HA   LYS  12           HA       LYS  12   2.991  -6.119  -4.813
  242    HB2  LYS  12           HB2      LYS  12   1.478  -6.737  -6.671
  243    HB3  LYS  12           HB1      LYS  12   2.824  -6.589  -7.801
  244    HG2  LYS  12           HG2      LYS  12   4.043  -8.362  -6.627
  245    HG3  LYS  12           HG1      LYS  12   2.755  -8.476  -5.426
  246    HD2  LYS  12           HD2      LYS  12   1.161  -9.115  -7.206
  247    HD3  LYS  12           HD1      LYS  12   2.465  -9.031  -8.392
  248    HE2  LYS  12           HE2      LYS  12   2.498 -10.835  -5.957
  249    HE3  LYS  12           HE1      LYS  12   2.020 -11.361  -7.571
  250    HZ1  LYS  12           HZ1      LYS  12   4.621 -11.024  -6.506
  251    HZ2  LYS  12           HZ2      LYS  12   4.423 -10.034  -7.872
  252    HZ3  LYS  12           HZ3      LYS  12   4.153 -11.707  -7.985
  253    H    LYS  13           HN       LYS  13   4.657  -4.829  -7.664
  254    HA   LYS  13           HA       LYS  13   7.021  -6.353  -7.416
  255    HB2  LYS  13           HB2      LYS  13   6.384  -5.067  -9.450
  256    HB3  LYS  13           HB1      LYS  13   6.734  -3.573  -8.578
  257    HG2  LYS  13           HG2      LYS  13   9.058  -4.270  -8.253
  258    HG3  LYS  13           HG1      LYS  13   8.727  -5.812  -9.046
  259    HD2  LYS  13           HD2      LYS  13   8.102  -4.584 -11.117
  260    HD3  LYS  13           HD1      LYS  13   8.528  -3.068 -10.321
  261    HE2  LYS  13           HE2      LYS  13  10.426  -5.393 -10.756
  262    HE3  LYS  13           HE1      LYS  13  10.382  -3.927 -11.735
  263    HZ1  LYS  13           HZ1      LYS  13  10.520  -2.958  -9.224
  264    HZ2  LYS  13           HZ2      LYS  13  11.850  -3.161 -10.262
  265    HZ3  LYS  13           HZ3      LYS  13  11.479  -4.351  -9.107
  266    H    LEU  14           HN       LEU  14   6.047  -3.242  -6.052
  267    HA   LEU  14           HA       LEU  14   8.527  -2.518  -4.929
  268    HB2  LEU  14           HB2      LEU  14   5.670  -1.876  -4.198
  269    HB3  LEU  14           HB1      LEU  14   7.038  -1.172  -3.339
  270    HG   LEU  14           HG       LEU  14   6.835  -1.017  -6.357
  271   HD11  LEU  14          HD11      LEU  14   5.476   0.694  -4.273
  272   HD12  LEU  14          HD12      LEU  14   4.842   0.088  -5.801
  273   HD13  LEU  14          HD13      LEU  14   6.000   1.411  -5.799
  274   HD21  LEU  14          HD21      LEU  14   8.161   1.136  -5.809
  275   HD22  LEU  14          HD22      LEU  14   9.008  -0.392  -5.576
  276   HD23  LEU  14          HD23      LEU  14   8.343   0.471  -4.187
  277    H    LEU  15           HN       LEU  15   5.833  -4.412  -3.642
  278    HA   LEU  15           HA       LEU  15   6.926  -4.768  -1.048
  279    HB2  LEU  15           HB2      LEU  15   4.934  -6.405  -2.629
  280    HB3  LEU  15           HB1      LEU  15   5.316  -6.686  -0.928
  281    HG   LEU  15           HG       LEU  15   4.323  -4.044  -2.034
  282   HD11  LEU  15          HD11      LEU  15   2.161  -4.615  -1.059
  283   HD12  LEU  15          HD12      LEU  15   2.793  -6.167  -0.511
  284   HD13  LEU  15          HD13      LEU  15   2.627  -5.842  -2.237
  285   HD21  LEU  15          HD21      LEU  15   3.749  -3.882   0.571
  286   HD22  LEU  15          HD22      LEU  15   5.346  -3.454  -0.029
  287   HD23  LEU  15          HD23      LEU  15   5.081  -5.036   0.704
  288    H    ASP  16           HN       ASP  16   7.138  -6.636  -4.032
  289    HA   ASP  16           HA       ASP  16   8.496  -8.873  -2.973
  290    HB2  ASP  16           HB2      ASP  16   8.410  -7.687  -5.747
  291    HB3  ASP  16           HB1      ASP  16   9.261  -9.184  -5.370
  292    H    ASP  17           HN       ASP  17   9.637  -5.795  -4.236
  293    HA   ASP  17           HA       ASP  17  12.398  -6.420  -4.285
  294    HB2  ASP  17           HB2      ASP  17  10.919  -3.792  -4.100
  295    HB3  ASP  17           HB1      ASP  17  12.674  -3.904  -4.220
  296    H    SER  18           HN       SER  18  10.271  -6.053  -1.704
  297    HA   SER  18           HA       SER  18  11.813  -4.724   0.208
  298    HB2  SER  18           HB2      SER  18  10.340  -5.662   1.836
  299    HB3  SER  18           HB1      SER  18   9.384  -5.409   0.380
  300    HG   SER  18           HG       SER  18   9.325  -7.523   0.024
  301    H    SER  19           HN       SER  19  12.174  -7.804  -1.174
  302    HA   SER  19           HA       SER  19  13.716  -8.950   0.982
  303    HB2  SER  19           HB2      SER  19  14.075 -10.825  -0.503
  304    HB3  SER  19           HB1      SER  19  12.387 -10.337  -0.621
  305    HG   SER  19           HG       SER  19  12.794 -10.132  -2.670
  306    H    SER  20           HN       SER  20  14.333  -6.813  -1.528
  307    HA   SER  20           HA       SER  20  17.140  -7.456  -1.872
  308    HB2  SER  20           HB2      SER  20  15.772  -6.466  -3.709
  309    HB3  SER  20           HB1      SER  20  15.641  -4.984  -2.766
  310    HG   SER  20           HG       SER  20  17.603  -5.737  -4.369
  311    H1   LYS   1           HN       LYS   1  18.889  -6.195  -1.192
  312    HA   LYS   1           HA       LYS   1  18.539  -4.938   1.375
  313    HB2  LYS   1           HB2      LYS   1  20.948  -5.364  -0.393
  314    HB3  LYS   1           HB1      LYS   1  21.030  -4.525   1.156
  315    HG2  LYS   1           HG2      LYS   1  20.098  -6.515   2.284
  316    HG3  LYS   1           HG1      LYS   1  20.023  -7.354   0.733
  317    HD2  LYS   1           HD2      LYS   1  22.461  -7.156   0.488
  318    HD3  LYS   1           HD1      LYS   1  22.554  -6.292   2.023
  319    HE2  LYS   1           HE2      LYS   1  21.461  -9.103   1.706
  320    HE3  LYS   1           HE1      LYS   1  23.098  -8.723   2.244
  321    HZ1  LYS   1           HZ1      LYS   1  20.548  -8.024   3.585
  322    HZ2  LYS   1           HZ2      LYS   1  22.044  -7.353   4.028
  323    HZ3  LYS   1           HZ3      LYS   1  21.785  -9.025   4.171
  324    H    ASN   2           HN       ASN   2  17.640  -3.822  -1.415
  325    HA   ASN   2           HA       ASN   2  18.999  -1.406  -1.820
  326    HB2  ASN   2           HB2      ASN   2  16.954  -0.704  -3.059
  327    HB3  ASN   2           HB1      ASN   2  17.488  -2.322  -3.507
  328   HD21  ASN   2          HD21      ASN   2  14.779  -1.458  -3.867
  329   HD22  ASN   2          HD22      ASN   2  13.799  -2.359  -2.814
  330    HA   PRO   3           HA       PRO   3  17.665   1.141   1.542
  331    HB2  PRO   3           HB2      PRO   3  17.621   3.623   0.319
  332    HB3  PRO   3           HB1      PRO   3  19.113   2.787   0.803
  333    HG2  PRO   3           HG2      PRO   3  17.816   2.933  -1.886
  334    HG3  PRO   3           HG1      PRO   3  19.530   3.063  -1.457
  335    HD2  PRO   3           HD2      PRO   3  18.493   0.785  -2.456
  336    HD3  PRO   3           HD1      PRO   3  19.793   0.760  -1.252
  337    H    GLU   4           HN       GLU   4  15.855   0.969  -1.388
  338    HA   GLU   4           HA       GLU   4  13.655   2.607  -0.708
  339    HB2  GLU   4           HB2      GLU   4  13.798   0.191  -2.525
  340    HB3  GLU   4           HB1      GLU   4  12.442   1.315  -2.446
  341    HG2  GLU   4           HG2      GLU   4  15.289   2.130  -3.090
  342    HG3  GLU   4           HG1      GLU   4  14.046   1.829  -4.304
  343    H    ALA   5           HN       ALA   5  14.714  -0.341   0.552
  344    HA   ALA   5           HA       ALA   5  12.330  -1.667   1.178
  345    HB1  ALA   5           HB1      ALA   5  13.595  -2.944   2.699
  346    HB2  ALA   5           HB2      ALA   5  14.710  -1.618   3.027
  347    HB3  ALA   5           HB3      ALA   5  14.770  -2.458   1.477
  348    H    GLU   6           HN       GLU   6  13.795   1.175   2.546
  349    HA   GLU   6           HA       GLU   6  12.579   1.199   5.079
  350    HB2  GLU   6           HB2      GLU   6  13.424   3.452   3.244
  351    HB3  GLU   6           HB1      GLU   6  12.875   3.703   4.902
  352    HG2  GLU   6           HG2      GLU   6  14.675   2.281   5.746
  353    HG3  GLU   6           HG1      GLU   6  15.198   1.930   4.101
  354    H    GLU   7           HN       GLU   7  11.414   2.275   1.911
  355    HA   GLU   7           HA       GLU   7   9.059   3.555   2.811
  356    HB2  GLU   7           HB2      GLU   7  10.026   3.770   0.510
  357    HB3  GLU   7           HB1      GLU   7   9.484   2.124   0.175
  358    HG2  GLU   7           HG2      GLU   7   7.813   3.674  -0.667
  359    HG3  GLU   7           HG1      GLU   7   7.142   2.839   0.732
  360    H    ILE   8           HN       ILE   8   9.759   0.214   1.895
  361    HA   ILE   8           HA       ILE   8   7.108  -0.771   2.032
  362    HB   ILE   8           HB       ILE   8   9.827  -2.070   2.275
  363   HG12  ILE   8          HG12      ILE   8   9.109  -3.102   0.136
  364   HG13  ILE   8          HG11      ILE   8   7.563  -2.261   0.255
  365   HG21  ILE   8          HG21      ILE   8   8.551  -3.487   3.680
  366   HG22  ILE   8          HG22      ILE   8   8.429  -4.258   2.102
  367   HG23  ILE   8          HG23      ILE   8   7.093  -3.286   2.715
  368   HD11  ILE   8          HD11      ILE   8   9.422  -1.185  -1.199
  369   HD12  ILE   8          HD12      ILE   8  10.162  -0.730   0.336
  370   HD13  ILE   8          HD13      ILE   8   8.548  -0.147  -0.075
  371    H    THR   9           HN       THR   9   9.660  -0.423   4.461
  372    HA   THR   9           HA       THR   9   8.441  -1.840   6.545
  373    HB   THR   9           HB       THR   9  10.240   0.593   6.693
  374    HG1  THR   9           HG1      THR   9  11.306  -1.017   5.662
  375   HG21  THR   9          HG21      THR   9   9.287   0.347   8.842
  376   HG22  THR   9          HG22      THR   9  10.817  -0.524   8.943
  377   HG23  THR   9          HG23      THR   9   9.307  -1.414   8.743
  378    H    ARG  10           HN       ARG  10   8.170   1.559   5.576
  379    HA   ARG  10           HA       ARG  10   6.441   2.343   7.692
  380    HB2  ARG  10           HB2      ARG  10   6.911   3.491   4.936
  381    HB3  ARG  10           HB1      ARG  10   5.846   4.243   6.124
  382    HG2  ARG  10           HG2      ARG  10   7.823   4.198   7.740
  383    HG3  ARG  10           HG1      ARG  10   8.822   3.751   6.355
  384    HD2  ARG  10           HD2      ARG  10   7.088   6.225   6.518
  385    HD3  ARG  10           HD1      ARG  10   8.831   6.198   6.769
  386    HE   ARG  10           HE       ARG  10   7.430   5.936   4.219
  387   HH11  ARG  10          HH11      ARG  10   8.789   6.020   2.400
  388   HH12  ARG  10          HH12      ARG  10  10.504   5.882   2.594
  389   HH21  ARG  10          HH21      ARG  10  10.355   5.581   6.045
  390   HH22  ARG  10          HH22      ARG  10  11.391   5.636   4.658
  391    H    CYS  11           HN       CYS  11   5.895   0.987   4.481
  392    HA   CYS  11           HA       CYS  11   3.152   1.352   4.215
  393    HB2  CYS  11           HB2      CYS  11   4.812   0.300   2.568
  394    HB3  CYS  11           HB1      CYS  11   4.550  -1.205   3.447
  395    H    LYS  12           HN       LYS  12   4.893  -1.299   5.826
  396    HA   LYS  12           HA       LYS  12   2.597  -2.726   6.659
  397    HB2  LYS  12           HB2      LYS  12   4.883  -3.682   6.646
  398    HB3  LYS  12           HB1      LYS  12   5.320  -2.614   7.979
  399    HG2  LYS  12           HG2      LYS  12   3.617  -3.639   9.405
  400    HG3  LYS  12           HG1      LYS  12   3.081  -4.658   8.069
  401    HD2  LYS  12           HD2      LYS  12   5.326  -5.699   7.974
  402    HD3  LYS  12           HD1      LYS  12   5.835  -4.701   9.336
  403    HE2  LYS  12           HE2      LYS  12   3.501  -6.630   9.427
  404    HE3  LYS  12           HE1      LYS  12   5.120  -7.010  10.010
  405    HZ1  LYS  12           HZ1      LYS  12   3.068  -5.556  11.296
  406    HZ2  LYS  12           HZ2      LYS  12   4.438  -4.567  11.114
  407    HZ3  LYS  12           HZ3      LYS  12   4.565  -6.060  11.915
  408    H    LYS  13           HN       LYS  13   4.541  -0.217   8.237
  409    HA   LYS  13           HA       LYS  13   3.192  -0.225  10.717
  410    HB2  LYS  13           HB2      LYS  13   5.389   0.874  10.314
  411    HB3  LYS  13           HB1      LYS  13   4.563   2.116   9.372
  412    HG2  LYS  13           HG2      LYS  13   3.218   2.739  11.325
  413    HG3  LYS  13           HG1      LYS  13   3.973   1.458  12.274
  414    HD2  LYS  13           HD2      LYS  13   6.186   2.533  11.927
  415    HD3  LYS  13           HD1      LYS  13   5.392   3.842  11.050
  416    HE2  LYS  13           HE2      LYS  13   4.798   3.072  13.921
  417    HE3  LYS  13           HE1      LYS  13   5.804   4.433  13.430
  418    HZ1  LYS  13           HZ1      LYS  13   3.574   4.828  11.988
  419    HZ2  LYS  13           HZ2      LYS  13   3.892   5.559  13.488
  420    HZ3  LYS  13           HZ3      LYS  13   2.932   4.160  13.409
  421    H    LEU  14           HN       LEU  14   2.608   1.525   7.701
  422    HA   LEU  14           HA       LEU  14   0.584   3.245   8.639
  423    HB2  LEU  14           HB2      LEU  14   1.200   2.082   5.924
  424    HB3  LEU  14           HB1      LEU  14  -0.109   3.236   6.175
  425    HG   LEU  14           HG       LEU  14   2.708   3.828   7.119
  426   HD11  LEU  14          HD11      LEU  14   1.546   4.070   4.344
  427   HD12  LEU  14          HD12      LEU  14   3.160   3.562   4.838
  428   HD13  LEU  14          HD13      LEU  14   2.720   5.263   4.904
  429   HD21  LEU  14          HD21      LEU  14   1.808   6.205   6.644
  430   HD22  LEU  14          HD22      LEU  14   1.118   5.367   8.033
  431   HD23  LEU  14          HD23      LEU  14   0.219   5.453   6.516
  432    H    LEU  15           HN       LEU  15   0.448  -0.011   7.273
  433    HA   LEU  15           HA       LEU  15  -2.383  -0.210   7.252
  434    HB2  LEU  15           HB2      LEU  15  -0.221  -2.322   7.356
  435    HB3  LEU  15           HB1      LEU  15  -1.937  -2.676   7.135
  436    HG   LEU  15           HG       LEU  15  -0.336  -0.830   5.338
  437   HD11  LEU  15          HD11      LEU  15  -0.317  -2.652   3.719
  438   HD12  LEU  15          HD12      LEU  15  -1.194  -3.691   4.842
  439   HD13  LEU  15          HD13      LEU  15   0.454  -3.180   5.216
  440   HD21  LEU  15          HD21      LEU  15  -2.423  -1.522   3.819
  441   HD22  LEU  15          HD22      LEU  15  -2.543  -0.192   4.964
  442   HD23  LEU  15          HD23      LEU  15  -3.194  -1.776   5.388
  443    H    ASP  16           HN       ASP  16   0.078  -1.042   9.636
  444    HA   ASP  16           HA       ASP  16  -1.619  -2.340  11.482
  445    HB2  ASP  16           HB2      ASP  16   0.999  -0.877  11.823
  446    HB3  ASP  16           HB1      ASP  16   0.187  -1.712  13.146
  447    H    ASP  17           HN       ASP  17  -0.745   1.040  11.042
  448    HA   ASP  17           HA       ASP  17  -1.930   2.039  13.409
  449    HB2  ASP  17           HB2      ASP  17  -1.285   3.350  10.765
  450    HB3  ASP  17           HB1      ASP  17  -1.925   4.232  12.151
  451    H    SER  18           HN       SER  18  -3.318   0.679  10.667
  452    HA   SER  18           HA       SER  18  -5.609   2.229  10.276
  453    HB2  SER  18           HB2      SER  18  -6.508   0.347   9.115
  454    HB3  SER  18           HB1      SER  18  -4.770   0.324   8.839
  455    HG   SER  18           HG       SER  18  -4.570  -1.382  10.116
  456    H    SER  19           HN       SER  19  -4.733   0.182  12.837
  457    HA   SER  19           HA       SER  19  -7.418  -0.350  13.761
  458    HB2  SER  19           HB2      SER  19  -6.365  -1.400  15.670
  459    HB3  SER  19           HB1      SER  19  -5.504  -1.891  14.213
  460    HG   SER  19           HG       SER  19  -3.815  -1.108  15.181
  461    H    SER  20           HN       SER  20  -5.300   2.238  13.956
  462    HA   SER  20           HA       SER  20  -6.234   3.288  16.495
  463    HB2  SER  20           HB2      SER  20  -3.932   3.733  15.603
  464    HB3  SER  20           HB1      SER  20  -4.665   4.719  14.341
  465    HG   SER  20           HG       SER  20  -4.054   5.421  16.811
  466    H2   ZBR 100           HA3      TBS 100  -1.508   0.905  -2.237
  467    H4   ZBR 100           HC3      TBS 100   0.252   1.578   1.653
  468    H6   ZBR 100           HB3      TBS 100   2.682   0.064  -1.593
  469    H7   ZBR 100          HB11      TBS 100   1.561   0.485  -3.969
  470    H7A  ZBR 100          HB12      TBS 100  -0.187   0.214  -4.044
  471    H8   ZBR 100          HA11      TBS 100  -2.527   2.476  -0.388
  472    H8A  ZBR 100          HA12      TBS 100  -1.977   2.203   1.271
  473    H9   ZBR 100          HC11      TBS 100   2.891   1.724   1.553
  474    H9A  ZBR 100          HC12      TBS 100   3.696   0.594   0.455
  Start of MODEL    3
    1    H1   LYS   1           HN       LYS   1  -7.426   5.316  16.322
    2    HA   LYS   1           HA       LYS   1  -9.321   5.851  14.237
    3    HB2  LYS   1           HB2      LYS   1  -8.757   7.239  16.866
    4    HB3  LYS   1           HB1      LYS   1 -10.074   7.688  15.780
    5    HG2  LYS   1           HG2      LYS   1 -10.984   5.401  15.933
    6    HG3  LYS   1           HG1      LYS   1  -9.674   4.954  17.025
    7    HD2  LYS   1           HD2      LYS   1 -10.429   6.660  18.638
    8    HD3  LYS   1           HD1      LYS   1 -11.740   7.111  17.547
    9    HE2  LYS   1           HE2      LYS   1 -12.658   4.828  17.697
   10    HE3  LYS   1           HE1      LYS   1 -11.347   4.370  18.785
   11    HZ1  LYS   1           HZ1      LYS   1 -12.146   5.733  20.458
   12    HZ2  LYS   1           HZ2      LYS   1 -13.570   5.087  19.794
   13    HZ3  LYS   1           HZ3      LYS   1 -13.089   6.668  19.402
   14    H    ASN   2           HN       ASN   2  -6.264   6.425  14.101
   15    HA   ASN   2           HA       ASN   2  -5.904   9.160  13.879
   16    HB2  ASN   2           HB2      ASN   2  -3.975   8.603  12.385
   17    HB3  ASN   2           HB1      ASN   2  -3.985   7.728  13.915
   18   HD21  ASN   2          HD21      ASN   2  -2.733   6.829  11.350
   19   HD22  ASN   2          HD22      ASN   2  -3.497   5.367  10.956
   20    HA   PRO   3           HA       PRO   3  -8.058  10.439  10.185
   21    HB2  PRO   3           HB2      PRO   3  -5.573  11.931   9.415
   22    HB3  PRO   3           HB1      PRO   3  -7.234  12.528   9.609
   23    HG2  PRO   3           HG2      PRO   3  -5.383  13.061  11.425
   24    HG3  PRO   3           HG1      PRO   3  -7.049  12.682  11.910
   25    HD2  PRO   3           HD2      PRO   3  -4.605  10.929  12.020
   26    HD3  PRO   3           HD1      PRO   3  -5.947  11.097  13.174
   27    H    GLU   4           HN       GLU   4  -4.800   9.172   9.906
   28    HA   GLU   4           HA       GLU   4  -4.671   8.833   7.114
   29    HB2  GLU   4           HB2      GLU   4  -3.339   7.237   9.309
   30    HB3  GLU   4           HB1      GLU   4  -2.905   7.163   7.606
   31    HG2  GLU   4           HG2      GLU   4  -2.893   9.722   9.223
   32    HG3  GLU   4           HG1      GLU   4  -1.467   8.716   8.981
   33    H    ALA   5           HN       ALA   5  -6.614   7.302   9.413
   34    HA   ALA   5           HA       ALA   5  -6.814   4.678   8.459
   35    HB1  ALA   5           HB1      ALA   5  -9.055   6.377   9.586
   36    HB2  ALA   5           HB2      ALA   5  -7.853   5.540  10.567
   37    HB3  ALA   5           HB3      ALA   5  -8.974   4.616   9.569
   38    H    GLU   6           HN       GLU   6  -8.252   7.682   7.303
   39    HA   GLU   6           HA       GLU   6 -10.160   6.575   5.542
   40    HB2  GLU   6           HB2      GLU   6  -8.621   9.179   5.465
   41    HB3  GLU   6           HB1      GLU   6  -9.921   8.785   4.340
   42    HG2  GLU   6           HG2      GLU   6 -11.495   8.532   6.190
   43    HG3  GLU   6           HG1      GLU   6 -10.204   8.809   7.358
   44    H    GLU   7           HN       GLU   7  -6.729   7.346   5.153
   45    HA   GLU   7           HA       GLU   7  -6.579   6.844   2.376
   46    HB2  GLU   7           HB2      GLU   7  -4.846   8.040   3.822
   47    HB3  GLU   7           HB1      GLU   7  -4.313   6.434   4.321
   48    HG2  GLU   7           HG2      GLU   7  -2.938   7.107   2.451
   49    HG3  GLU   7           HG1      GLU   7  -4.038   5.853   1.880
   50    H    ILE   8           HN       ILE   8  -6.297   4.798   5.213
   51    HA   ILE   8           HA       ILE   8  -5.286   2.470   3.937
   52    HB   ILE   8           HB       ILE   8  -7.151   2.624   6.327
   53   HG12  ILE   8          HG12      ILE   8  -5.227   4.062   6.678
   54   HG13  ILE   8          HG11      ILE   8  -5.032   2.622   7.657
   55   HG21  ILE   8          HG21      ILE   8  -6.066   0.368   4.933
   56   HG22  ILE   8          HG22      ILE   8  -6.912   0.362   6.474
   57   HG23  ILE   8          HG23      ILE   8  -5.162   0.503   6.435
   58   HD11  ILE   8          HD11      ILE   8  -3.690   1.735   5.572
   59   HD12  ILE   8          HD12      ILE   8  -2.918   2.840   6.706
   60   HD13  ILE   8          HD13      ILE   8  -3.555   3.449   5.179
   61    H    THR   9           HN       THR   9  -8.598   3.638   4.488
   62    HA   THR   9           HA       THR   9  -9.959   1.382   3.488
   63    HB   THR   9           HB       THR   9 -10.779   4.299   3.433
   64    HG1  THR   9           HG1      THR   9 -10.633   3.792   5.507
   65   HG21  THR   9          HG21      THR   9 -13.101   3.207   3.426
   66   HG22  THR   9          HG22      THR   9 -12.279   1.724   2.941
   67   HG23  THR   9          HG23      THR   9 -12.200   3.154   1.911
   68    H    ARG  10           HN       ARG  10  -8.717   4.292   1.893
   69    HA   ARG  10           HA       ARG  10  -9.734   3.763  -0.691
   70    HB2  ARG  10           HB2      ARG  10  -7.330   5.323   0.272
   71    HB3  ARG  10           HB1      ARG  10  -7.811   5.255  -1.422
   72    HG2  ARG  10           HG2      ARG  10  -9.957   6.241  -0.932
   73    HG3  ARG  10           HG1      ARG  10  -9.671   6.120   0.805
   74    HD2  ARG  10           HD2      ARG  10  -9.269   8.418  -0.063
   75    HD3  ARG  10           HD1      ARG  10  -7.831   7.709   0.653
   76    HE   ARG  10           HE       ARG  10  -6.837   7.658  -1.453
   77   HH11  ARG  10          HH11      ARG  10  -6.774   8.242  -3.648
   78   HH12  ARG  10          HH12      ARG  10  -8.224   8.746  -4.452
   79   HH21  ARG  10          HH21      ARG  10 -10.223   8.374  -1.642
   80   HH22  ARG  10          HH22      ARG  10 -10.177   8.822  -3.315
   81    H    CYS  11           HN       CYS  11  -6.750   2.799   0.934
   82    HA   CYS  11           HA       CYS  11  -5.401   1.660  -1.237
   83    HB2  CYS  11           HB2      CYS  11  -4.560   2.061   1.145
   84    HB3  CYS  11           HB1      CYS  11  -5.338   0.535   1.556
   85    H    LYS  12           HN       LYS  12  -7.757   0.228   1.011
   86    HA   LYS  12           HA       LYS  12  -7.641  -2.398  -0.014
   87    HB2  LYS  12           HB2      LYS  12  -9.848  -0.893   1.404
   88    HB3  LYS  12           HB1      LYS  12  -9.946  -2.609   1.006
   89    HG2  LYS  12           HG2      LYS  12  -7.875  -3.019   2.296
   90    HG3  LYS  12           HG1      LYS  12  -7.801  -1.306   2.710
   91    HD2  LYS  12           HD2      LYS  12  -9.981  -1.473   3.842
   92    HD3  LYS  12           HD1      LYS  12 -10.075  -3.183   3.420
   93    HE2  LYS  12           HE2      LYS  12  -8.016  -3.616   4.711
   94    HE3  LYS  12           HE1      LYS  12  -7.927  -1.908   5.139
   95    HZ1  LYS  12           HZ1      LYS  12 -10.291  -3.586   5.742
   96    HZ2  LYS  12           HZ2      LYS  12  -9.907  -2.054   6.371
   97    HZ3  LYS  12           HZ3      LYS  12  -8.995  -3.415   6.823
   98    H    LYS  13           HN       LYS  13  -9.663   0.389  -0.874
   99    HA   LYS  13           HA       LYS  13 -11.274  -0.966  -2.763
  100    HB2  LYS  13           HB2      LYS  13 -10.546   1.950  -2.465
  101    HB3  LYS  13           HB1      LYS  13 -11.682   1.358  -3.678
  102    HG2  LYS  13           HG2      LYS  13 -13.058   0.348  -1.887
  103    HG3  LYS  13           HG1      LYS  13 -11.932   0.969  -0.680
  104    HD2  LYS  13           HD2      LYS  13 -12.400   3.277  -1.441
  105    HD3  LYS  13           HD1      LYS  13 -13.547   2.647  -2.624
  106    HE2  LYS  13           HE2      LYS  13 -13.754   2.272   0.380
  107    HE3  LYS  13           HE1      LYS  13 -14.697   3.419  -0.572
  108    HZ1  LYS  13           HZ1      LYS  13 -16.036   1.523  -0.333
  109    HZ2  LYS  13           HZ2      LYS  13 -14.760   0.462  -0.697
  110    HZ3  LYS  13           HZ3      LYS  13 -15.430   1.439  -1.915
  111    H    LEU  14           HN       LEU  14  -8.197   0.743  -3.038
  112    HA   LEU  14           HA       LEU  14  -7.988   0.682  -5.848
  113    HB2  LEU  14           HB2      LEU  14  -5.992   0.829  -3.591
  114    HB3  LEU  14           HB1      LEU  14  -5.458   0.796  -5.267
  115    HG   LEU  14           HG       LEU  14  -7.563   2.781  -4.375
  116   HD11  LEU  14          HD11      LEU  14  -5.808   3.291  -2.846
  117   HD12  LEU  14          HD12      LEU  14  -5.563   4.405  -4.186
  118   HD13  LEU  14          HD13      LEU  14  -4.559   2.961  -4.044
  119   HD21  LEU  14          HD21      LEU  14  -7.229   2.626  -6.777
  120   HD22  LEU  14          HD22      LEU  14  -5.476   2.681  -6.580
  121   HD23  LEU  14          HD23      LEU  14  -6.450   4.104  -6.226
  122    H    LEU  15           HN       LEU  15  -6.912  -1.607  -3.353
  123    HA   LEU  15           HA       LEU  15  -5.612  -3.389  -5.119
  124    HB2  LEU  15           HB2      LEU  15  -6.895  -3.781  -2.410
  125    HB3  LEU  15           HB1      LEU  15  -5.976  -5.041  -3.231
  126    HG   LEU  15           HG       LEU  15  -4.884  -2.275  -2.628
  127   HD11  LEU  15          HD11      LEU  15  -3.606  -3.419  -0.810
  128   HD12  LEU  15          HD12      LEU  15  -4.574  -4.868  -1.088
  129   HD13  LEU  15          HD13      LEU  15  -5.345  -3.384  -0.523
  130   HD21  LEU  15          HD21      LEU  15  -3.477  -3.090  -4.293
  131   HD22  LEU  15          HD22      LEU  15  -3.761  -4.776  -3.867
  132   HD23  LEU  15          HD23      LEU  15  -2.689  -3.788  -2.883
  133    H    ASP  16           HN       ASP  16  -8.938  -3.253  -3.894
  134    HA   ASP  16           HA       ASP  16  -9.811  -5.632  -5.180
  135    HB2  ASP  16           HB2      ASP  16 -11.282  -3.225  -4.104
  136    HB3  ASP  16           HB1      ASP  16 -12.111  -4.611  -4.813
  137    H    ASP  17           HN       ASP  17  -9.817  -2.230  -6.095
  138    HA   ASP  17           HA       ASP  17 -11.262  -2.576  -8.525
  139    HB2  ASP  17           HB2      ASP  17  -9.463  -0.362  -7.523
  140    HB3  ASP  17           HB1      ASP  17 -10.318  -0.293  -9.063
  141    H    SER  18           HN       SER  18  -8.148  -3.419  -7.593
  142    HA   SER  18           HA       SER  18  -6.633  -2.910  -9.880
  143    HB2  SER  18           HB2      SER  18  -5.098  -4.539  -9.052
  144    HB3  SER  18           HB1      SER  18  -5.828  -3.780  -7.638
  145    HG   SER  18           HG       SER  18  -5.774  -6.319  -8.196
  146    H    SER  19           HN       SER  19  -9.190  -5.101  -9.355
  147    HA   SER  19           HA       SER  19  -8.469  -6.919 -11.488
  148    HB2  SER  19           HB2      SER  19 -10.591  -7.990 -11.054
  149    HB3  SER  19           HB1      SER  19  -9.832  -7.615  -9.510
  150    HG   SER  19           HG       SER  19 -11.188  -5.488 -10.165
  151    H    SER  20           HN       SER  20  -9.879  -3.891 -11.283
  152    HA   SER  20           HA       SER  20 -11.535  -4.077 -13.653
  153    HB2  SER  20           HB2      SER  20 -10.672  -1.653 -12.062
  154    HB3  SER  20           HB1      SER  20 -11.873  -1.663 -13.351
  155    HG   SER  20           HG       SER  20 -12.566  -1.906 -11.027
  156    H1   LYS   1           HN       LYS   1 -11.151  -2.970 -15.613
  157    HA   LYS   1           HA       LYS   1  -8.424  -3.080 -16.487
  158    HB2  LYS   1           HB2      LYS   1 -10.950  -2.132 -17.855
  159    HB3  LYS   1           HB1      LYS   1  -9.375  -2.225 -18.648
  160    HG2  LYS   1           HG2      LYS   1  -9.256  -4.633 -18.137
  161    HG3  LYS   1           HG1      LYS   1 -10.830  -4.545 -17.346
  162    HD2  LYS   1           HD2      LYS   1 -11.858  -3.815 -19.466
  163    HD3  LYS   1           HD1      LYS   1 -10.284  -3.906 -20.260
  164    HE2  LYS   1           HE2      LYS   1 -10.159  -6.315 -19.749
  165    HE3  LYS   1           HE1      LYS   1 -11.729  -6.229 -18.950
  166    HZ1  LYS   1           HZ1      LYS   1 -12.815  -5.839 -20.936
  167    HZ2  LYS   1           HZ2      LYS   1 -11.626  -6.964 -21.392
  168    HZ3  LYS   1           HZ3      LYS   1 -11.413  -5.314 -21.734
  169    H    ASN   2           HN       ASN   2  -9.592  -1.008 -14.471
  170    HA   ASN   2           HA       ASN   2  -9.377   1.509 -15.606
  171    HB2  ASN   2           HB2      ASN   2  -8.924   2.326 -13.289
  172    HB3  ASN   2           HB1      ASN   2 -10.337   1.281 -13.420
  173   HD21  ASN   2          HD21      ASN   2  -8.622   1.693 -10.996
  174   HD22  ASN   2          HD22      ASN   2  -8.015   0.160 -10.603
  175    HA   PRO   3           HA       PRO   3  -5.042   2.168 -16.433
  176    HB2  PRO   3           HB2      PRO   3  -5.327   4.847 -15.117
  177    HB3  PRO   3           HB1      PRO   3  -4.749   4.445 -16.746
  178    HG2  PRO   3           HG2      PRO   3  -7.149   5.506 -16.382
  179    HG3  PRO   3           HG1      PRO   3  -6.891   4.235 -17.597
  180    HD2  PRO   3           HD2      PRO   3  -8.153   4.014 -14.873
  181    HD3  PRO   3           HD1      PRO   3  -8.603   3.244 -16.411
  182    H    GLU   4           HN       GLU   4  -6.279   2.864 -13.226
  183    HA   GLU   4           HA       GLU   4  -3.847   3.182 -11.842
  184    HB2  GLU   4           HB2      GLU   4  -6.500   2.117 -10.860
  185    HB3  GLU   4           HB1      GLU   4  -5.164   2.598  -9.824
  186    HG2  GLU   4           HG2      GLU   4  -6.502   4.430 -11.830
  187    HG3  GLU   4           HG1      GLU   4  -6.895   4.390 -10.112
  188    H    ALA   5           HN       ALA   5  -5.170   0.463 -13.346
  189    HA   ALA   5           HA       ALA   5  -4.396  -1.650 -11.680
  190    HB1  ALA   5           HB1      ALA   5  -4.309  -1.622 -14.709
  191    HB2  ALA   5           HB2      ALA   5  -5.783  -1.847 -13.766
  192    HB3  ALA   5           HB3      ALA   5  -4.482  -3.033 -13.666
  193    H    GLU   6           HN       GLU   6  -2.540   0.330 -13.934
  194    HA   GLU   6           HA       GLU   6  -0.203  -1.250 -14.037
  195    HB2  GLU   6           HB2      GLU   6  -0.629   1.733 -14.302
  196    HB3  GLU   6           HB1      GLU   6   0.920   0.943 -14.598
  197    HG2  GLU   6           HG2      GLU   6  -0.077  -0.435 -16.349
  198    HG3  GLU   6           HG1      GLU   6  -1.668   0.247 -16.015
  199    H    GLU   7           HN       GLU   7  -1.285   1.251 -11.781
  200    HA   GLU   7           HA       GLU   7   1.115   1.436 -10.299
  201    HB2  GLU   7           HB2      GLU   7  -0.863   3.051 -10.242
  202    HB3  GLU   7           HB1      GLU   7  -1.641   1.891  -9.164
  203    HG2  GLU   7           HG2      GLU   7  -0.512   3.522  -7.785
  204    HG3  GLU   7           HG1      GLU   7   0.403   2.018  -7.686
  205    H    ILE   8           HN       ILE   8  -1.685  -0.666 -10.090
  206    HA   ILE   8           HA       ILE   8  -1.119  -1.846  -7.571
  207    HB   ILE   8           HB       ILE   8  -2.460  -3.130  -9.971
  208   HG12  ILE   8          HG12      ILE   8  -3.507  -0.998  -9.462
  209   HG13  ILE   8          HG11      ILE   8  -4.566  -2.279  -8.922
  210   HG21  ILE   8          HG21      ILE   8  -1.808  -4.187  -7.385
  211   HG22  ILE   8          HG22      ILE   8  -2.818  -4.929  -8.616
  212   HG23  ILE   8          HG23      ILE   8  -3.542  -3.906  -7.386
  213   HD11  ILE   8          HD11      ILE   8  -3.316  -1.947  -6.623
  214   HD12  ILE   8          HD12      ILE   8  -4.607  -0.847  -7.093
  215   HD13  ILE   8          HD13      ILE   8  -2.924  -0.369  -7.302
  216    H    THR   9           HN       THR   9  -0.114  -2.683 -10.874
  217    HA   THR   9           HA       THR   9   1.224  -5.084 -10.261
  218    HB   THR   9           HB       THR   9   1.824  -3.055 -12.433
  219    HG1  THR   9           HG1      THR   9  -0.137  -3.779 -12.880
  220   HG21  THR   9          HG21      THR   9   2.750  -5.163 -13.561
  221   HG22  THR   9          HG22      THR   9   2.726  -5.898 -11.959
  222   HG23  THR   9          HG23      THR   9   3.724  -4.476 -12.261
  223    H    ARG  10           HN       ARG  10   2.313  -1.711 -10.287
  224    HA   ARG  10           HA       ARG  10   5.041  -2.194  -9.723
  225    HB2  ARG  10           HB2      ARG  10   3.231   0.166  -9.180
  226    HB3  ARG  10           HB1      ARG  10   4.957   0.180  -8.816
  227    HG2  ARG  10           HG2      ARG  10   5.528  -0.184 -11.128
  228    HG3  ARG  10           HG1      ARG  10   3.841  -0.477 -11.553
  229    HD2  ARG  10           HD2      ARG  10   4.582   1.819 -12.161
  230    HD3  ARG  10           HD1      ARG  10   3.264   1.827 -11.001
  231    HE   ARG  10           HE       ARG  10   4.710   2.706  -9.401
  232   HH11  ARG  10          HH11      ARG  10   6.683   3.660  -8.801
  233   HH12  ARG  10          HH12      ARG  10   8.071   3.494  -9.824
  234   HH21  ARG  10          HH21      ARG  10   6.409   1.602 -12.211
  235   HH22  ARG  10          HH22      ARG  10   7.915   2.327 -11.757
  236    H    CYS  11           HN       CYS  11   2.224  -1.757  -7.629
  237    HA   CYS  11           HA       CYS  11   3.520  -1.606  -5.155
  238    HB2  CYS  11           HB2      CYS  11   1.027  -1.314  -5.729
  239    HB3  CYS  11           HB1      CYS  11   0.918  -3.063  -5.555
  240    H    LYS  12           HN       LYS  12   2.426  -4.445  -6.996
  241    HA   LYS  12           HA       LYS  12   3.132  -6.386  -5.075
  242    HB2  LYS  12           HB2      LYS  12   2.905  -6.522  -8.086
  243    HB3  LYS  12           HB1      LYS  12   3.210  -7.936  -7.077
  244    HG2  LYS  12           HG2      LYS  12   1.126  -7.482  -5.822
  245    HG3  LYS  12           HG1      LYS  12   0.819  -6.081  -6.850
  246    HD2  LYS  12           HD2      LYS  12   0.732  -7.533  -8.832
  247    HD3  LYS  12           HD1      LYS  12   1.068  -8.943  -7.826
  248    HE2  LYS  12           HE2      LYS  12  -1.009  -8.528  -6.554
  249    HE3  LYS  12           HE1      LYS  12  -1.348  -7.126  -7.568
  250    HZ1  LYS  12           HZ1      LYS  12  -0.956  -9.850  -8.666
  251    HZ2  LYS  12           HZ2      LYS  12  -1.588  -8.487  -9.460
  252    HZ3  LYS  12           HZ3      LYS  12  -2.481  -9.246  -8.229
  253    H    LYS  13           HN       LYS  13   4.960  -4.940  -7.751
  254    HA   LYS  13           HA       LYS  13   7.270  -6.546  -7.454
  255    HB2  LYS  13           HB2      LYS  13   6.869  -3.792  -8.628
  256    HB3  LYS  13           HB1      LYS  13   8.416  -4.642  -8.666
  257    HG2  LYS  13           HG2      LYS  13   7.340  -6.536  -9.836
  258    HG3  LYS  13           HG1      LYS  13   5.802  -5.671  -9.815
  259    HD2  LYS  13           HD2      LYS  13   6.818  -3.840 -11.127
  260    HD3  LYS  13           HD1      LYS  13   8.347  -4.717 -11.162
  261    HE2  LYS  13           HE2      LYS  13   5.722  -5.732 -12.294
  262    HE3  LYS  13           HE1      LYS  13   7.055  -5.075 -13.242
  263    HZ1  LYS  13           HZ1      LYS  13   7.318  -7.394 -13.280
  264    HZ2  LYS  13           HZ2      LYS  13   7.024  -7.547 -11.613
  265    HZ3  LYS  13           HZ3      LYS  13   8.466  -6.838 -12.163
  266    H    LEU  14           HN       LEU  14   6.293  -3.476  -6.010
  267    HA   LEU  14           HA       LEU  14   8.724  -2.884  -4.715
  268    HB2  LEU  14           HB2      LEU  14   5.841  -2.157  -4.208
  269    HB3  LEU  14           HB1      LEU  14   7.119  -1.586  -3.141
  270    HG   LEU  14           HG       LEU  14   7.340  -1.200  -6.136
  271   HD11  LEU  14          HD11      LEU  14   5.245  -0.149  -5.719
  272   HD12  LEU  14          HD12      LEU  14   6.417   1.160  -5.622
  273   HD13  LEU  14          HD13      LEU  14   5.765   0.449  -4.145
  274   HD21  LEU  14          HD21      LEU  14   9.355  -0.695  -4.884
  275   HD22  LEU  14          HD22      LEU  14   8.439   0.212  -3.680
  276   HD23  LEU  14          HD23      LEU  14   8.611   0.839  -5.316
  277    H    LEU  15           HN       LEU  15   5.870  -4.712  -3.651
  278    HA   LEU  15           HA       LEU  15   6.781  -5.188  -1.019
  279    HB2  LEU  15           HB2      LEU  15   4.881  -6.705  -2.815
  280    HB3  LEU  15           HB1      LEU  15   5.134  -7.106  -1.119
  281    HG   LEU  15           HG       LEU  15   4.290  -4.362  -2.101
  282   HD11  LEU  15          HD11      LEU  15   2.033  -4.995  -1.242
  283   HD12  LEU  15          HD12      LEU  15   2.615  -6.645  -1.020
  284   HD13  LEU  15          HD13      LEU  15   2.534  -5.947  -2.639
  285   HD21  LEU  15          HD21      LEU  15   5.134  -3.974   0.035
  286   HD22  LEU  15          HD22      LEU  15   4.743  -5.595   0.608
  287   HD23  LEU  15          HD23      LEU  15   3.473  -4.388   0.438
  288    H    ASP  16           HN       ASP  16   7.131  -7.026  -4.033
  289    HA   ASP  16           HA       ASP  16   8.514  -9.219  -2.867
  290    HB2  ASP  16           HB2      ASP  16   8.343  -8.174  -5.695
  291    HB3  ASP  16           HB1      ASP  16   9.251  -9.625  -5.265
  292    H    ASP  17           HN       ASP  17   9.554  -6.209  -4.373
  293    HA   ASP  17           HA       ASP  17  12.345  -6.776  -4.283
  294    HB2  ASP  17           HB2      ASP  17  10.797  -4.198  -4.581
  295    HB3  ASP  17           HB1      ASP  17  12.558  -4.276  -4.624
  296    H    SER  18           HN       SER  18  10.096  -6.038  -1.896
  297    HA   SER  18           HA       SER  18  11.537  -4.394  -0.160
  298    HB2  SER  18           HB2      SER  18  10.020  -5.100   1.543
  299    HB3  SER  18           HB1      SER  18   9.110  -5.105   0.034
  300    HG   SER  18           HG       SER  18   9.365  -7.086   1.672
  301    H    SER  19           HN       SER  19  12.022  -7.649  -1.049
  302    HA   SER  19           HA       SER  19  13.501  -8.390   1.327
  303    HB2  SER  19           HB2      SER  19  13.946 -10.471   0.195
  304    HB3  SER  19           HB1      SER  19  12.265 -10.041  -0.103
  305    HG   SER  19           HG       SER  19  13.604  -8.865  -1.988
  306    H    SER  20           HN       SER  20  14.137  -6.651  -1.465
  307    HA   SER  20           HA       SER  20  16.973  -7.221  -1.628
  308    HB2  SER  20           HB2      SER  20  15.349  -5.053  -2.975
  309    HB3  SER  20           HB1      SER  20  17.017  -5.477  -3.348
  310    HG   SER  20           HG       SER  20  15.316  -6.468  -4.683
  311    H1   LYS   1           HN       LYS   1  18.642  -5.744  -1.167
  312    HA   LYS   1           HA       LYS   1  18.225  -4.200   1.216
  313    HB2  LYS   1           HB2      LYS   1  20.628  -4.516  -0.598
  314    HB3  LYS   1           HB1      LYS   1  20.642  -3.583   0.900
  315    HG2  LYS   1           HG2      LYS   1  19.962  -5.589   2.161
  316    HG3  LYS   1           HG1      LYS   1  19.953  -6.526   0.666
  317    HD2  LYS   1           HD2      LYS   1  22.354  -6.055   0.352
  318    HD3  LYS   1           HD1      LYS   1  22.366  -5.120   1.849
  319    HE2  LYS   1           HE2      LYS   1  21.686  -7.126   3.113
  320    HE3  LYS   1           HE1      LYS   1  21.671  -8.063   1.619
  321    HZ1  LYS   1           HZ1      LYS   1  23.954  -7.925   1.408
  322    HZ2  LYS   1           HZ2      LYS   1  23.758  -8.117   3.084
  323    HZ3  LYS   1           HZ3      LYS   1  24.084  -6.582   2.435
  324    H    ASN   2           HN       ASN   2  17.080  -3.533  -1.600
  325    HA   ASN   2           HA       ASN   2  18.184  -1.144  -2.447
  326    HB2  ASN   2           HB2      ASN   2  15.958  -0.683  -3.487
  327    HB3  ASN   2           HB1      ASN   2  16.613  -2.277  -3.859
  328   HD21  ASN   2          HD21      ASN   2  13.725  -1.519  -3.818
  329   HD22  ASN   2          HD22      ASN   2  13.005  -2.507  -2.644
  330    HA   PRO   3           HA       PRO   3  17.110   1.927   0.605
  331    HB2  PRO   3           HB2      PRO   3  16.225   3.686  -1.656
  332    HB3  PRO   3           HB1      PRO   3  17.420   4.001  -0.382
  333    HG2  PRO   3           HG2      PRO   3  18.189   3.478  -2.862
  334    HG3  PRO   3           HG1      PRO   3  19.090   2.833  -1.476
  335    HD2  PRO   3           HD2      PRO   3  17.164   1.414  -3.302
  336    HD3  PRO   3           HD1      PRO   3  18.691   0.850  -2.586
  337    H    GLU   4           HN       GLU   4  14.803   1.162  -1.923
  338    HA   GLU   4           HA       GLU   4  12.531   2.474  -0.897
  339    HB2  GLU   4           HB2      GLU   4  12.716  -0.042  -2.562
  340    HB3  GLU   4           HB1      GLU   4  11.241   0.875  -2.284
  341    HG2  GLU   4           HG2      GLU   4  13.752   2.021  -3.538
  342    HG3  GLU   4           HG1      GLU   4  12.364   1.436  -4.453
  343    H    ALA   5           HN       ALA   5  14.272  -0.161   0.308
  344    HA   ALA   5           HA       ALA   5  12.297  -1.786   1.443
  345    HB1  ALA   5           HB1      ALA   5  14.986  -1.110   2.663
  346    HB2  ALA   5           HB2      ALA   5  14.759  -2.284   1.367
  347    HB3  ALA   5           HB3      ALA   5  14.027  -2.563   2.947
  348    H    GLU   6           HN       GLU   6  13.652   1.294   2.493
  349    HA   GLU   6           HA       GLU   6  12.632   1.315   5.126
  350    HB2  GLU   6           HB2      GLU   6  13.261   3.552   3.188
  351    HB3  GLU   6           HB1      GLU   6  12.803   3.827   4.871
  352    HG2  GLU   6           HG2      GLU   6  14.712   2.515   5.642
  353    HG3  GLU   6           HG1      GLU   6  15.144   2.117   3.981
  354    H    GLU   7           HN       GLU   7  11.237   2.299   2.027
  355    HA   GLU   7           HA       GLU   7   8.881   3.461   3.068
  356    HB2  GLU   7           HB2      GLU   7   9.791   3.687   0.692
  357    HB3  GLU   7           HB1      GLU   7   9.084   2.101   0.384
  358    HG2  GLU   7           HG2      GLU   7   7.461   3.764  -0.283
  359    HG3  GLU   7           HG1      GLU   7   6.877   3.013   1.202
  360    H    ILE   8           HN       ILE   8   9.762   0.179   2.198
  361    HA   ILE   8           HA       ILE   8   7.172  -0.980   2.306
  362    HB   ILE   8           HB       ILE   8   9.825  -2.268   3.028
  363   HG12  ILE   8          HG12      ILE   8   9.976  -1.223   0.845
  364   HG13  ILE   8          HG11      ILE   8   9.850  -2.954   0.621
  365   HG21  ILE   8          HG21      ILE   8   7.158  -3.301   3.116
  366   HG22  ILE   8          HG22      ILE   8   8.655  -4.210   3.265
  367   HG23  ILE   8          HG23      ILE   8   7.907  -4.005   1.688
  368   HD11  ILE   8          HD11      ILE   8   7.272  -2.450   0.421
  369   HD12  ILE   8          HD12      ILE   8   8.331  -2.165  -0.957
  370   HD13  ILE   8          HD13      ILE   8   7.824  -0.816   0.058
  371    H    THR   9           HN       THR   9   9.648  -0.443   4.798
  372    HA   THR   9           HA       THR   9   8.349  -1.784   6.909
  373    HB   THR   9           HB       THR   9  10.189   0.623   7.001
  374    HG1  THR   9           HG1      THR   9  11.418  -0.935   6.245
  375   HG21  THR   9          HG21      THR   9  10.636  -0.339   9.337
  376   HG22  THR   9          HG22      THR   9   9.142  -1.249   9.126
  377   HG23  THR   9          HG23      THR   9   9.109   0.514   9.112
  378    H    ARG  10           HN       ARG  10   8.141   1.561   5.749
  379    HA   ARG  10           HA       ARG  10   6.423   2.546   7.769
  380    HB2  ARG  10           HB2      ARG  10   6.871   3.367   4.895
  381    HB3  ARG  10           HB1      ARG  10   5.807   4.251   5.990
  382    HG2  ARG  10           HG2      ARG  10   7.621   4.725   7.499
  383    HG3  ARG  10           HG1      ARG  10   8.705   3.643   6.621
  384    HD2  ARG  10           HD2      ARG  10   9.098   6.035   6.058
  385    HD3  ARG  10           HD1      ARG  10   8.617   5.089   4.660
  386    HE   ARG  10           HE       ARG  10   6.618   6.281   4.570
  387   HH11  ARG  10          HH11      ARG  10   5.300   8.020   5.203
  388   HH12  ARG  10          HH12      ARG  10   5.617   8.850   6.690
  389   HH21  ARG  10          HH21      ARG  10   8.346   6.873   7.514
  390   HH22  ARG  10          HH22      ARG  10   7.343   8.199   7.999
  391    H    CYS  11           HN       CYS  11   5.779   0.940   4.683
  392    HA   CYS  11           HA       CYS  11   3.003   1.284   4.573
  393    HB2  CYS  11           HB2      CYS  11   4.609   0.272   2.830
  394    HB3  CYS  11           HB1      CYS  11   4.379  -1.245   3.694
  395    H    LYS  12           HN       LYS  12   4.941  -1.255   6.139
  396    HA   LYS  12           HA       LYS  12   2.777  -2.833   7.024
  397    HB2  LYS  12           HB2      LYS  12   5.574  -2.466   8.110
  398    HB3  LYS  12           HB1      LYS  12   4.438  -3.655   8.749
  399    HG2  LYS  12           HG2      LYS  12   4.241  -4.669   6.502
  400    HG3  LYS  12           HG1      LYS  12   5.393  -3.489   5.875
  401    HD2  LYS  12           HD2      LYS  12   7.116  -4.323   7.416
  402    HD3  LYS  12           HD1      LYS  12   5.971  -5.490   8.079
  403    HE2  LYS  12           HE2      LYS  12   5.751  -6.540   5.856
  404    HE3  LYS  12           HE1      LYS  12   6.898  -5.376   5.193
  405    HZ1  LYS  12           HZ1      LYS  12   7.544  -7.162   7.468
  406    HZ2  LYS  12           HZ2      LYS  12   8.618  -6.231   6.537
  407    HZ3  LYS  12           HZ3      LYS  12   7.850  -7.583   5.853
  408    H    LYS  13           HN       LYS  13   4.497  -0.125   8.535
  409    HA   LYS  13           HA       LYS  13   3.124  -0.220  11.007
  410    HB2  LYS  13           HB2      LYS  13   4.544   2.031   9.581
  411    HB3  LYS  13           HB1      LYS  13   3.853   2.196  11.197
  412    HG2  LYS  13           HG2      LYS  13   5.239   0.303  11.977
  413    HG3  LYS  13           HG1      LYS  13   5.944   0.160  10.365
  414    HD2  LYS  13           HD2      LYS  13   6.807   2.470  10.542
  415    HD3  LYS  13           HD1      LYS  13   6.122   2.596  12.163
  416    HE2  LYS  13           HE2      LYS  13   8.203   0.566  11.298
  417    HE3  LYS  13           HE1      LYS  13   8.528   2.019  12.242
  418    HZ1  LYS  13           HZ1      LYS  13   8.297   0.265  13.776
  419    HZ2  LYS  13           HZ2      LYS  13   6.893  -0.324  13.023
  420    HZ3  LYS  13           HZ3      LYS  13   6.852   1.147  13.870
  421    H    LEU  14           HN       LEU  14   2.463   1.452   7.969
  422    HA   LEU  14           HA       LEU  14   0.294   3.010   8.871
  423    HB2  LEU  14           HB2      LEU  14   1.127   1.924   6.182
  424    HB3  LEU  14           HB1      LEU  14  -0.342   2.877   6.357
  425    HG   LEU  14           HG       LEU  14   2.291   3.901   7.447
  426   HD11  LEU  14          HD11      LEU  14   2.883   3.536   5.174
  427   HD12  LEU  14          HD12      LEU  14   2.370   5.220   5.218
  428   HD13  LEU  14          HD13      LEU  14   1.278   3.982   4.597
  429   HD21  LEU  14          HD21      LEU  14   0.335   5.167   8.135
  430   HD22  LEU  14          HD22      LEU  14  -0.297   5.177   6.490
  431   HD23  LEU  14          HD23      LEU  14   1.149   6.098   6.885
  432    H    LEU  15           HN       LEU  15   0.432  -0.249   7.465
  433    HA   LEU  15           HA       LEU  15  -2.362  -0.655   7.374
  434    HB2  LEU  15           HB2      LEU  15  -0.036  -2.574   7.582
  435    HB3  LEU  15           HB1      LEU  15  -1.702  -3.096   7.340
  436    HG   LEU  15           HG       LEU  15  -0.264  -1.132   5.527
  437   HD11  LEU  15          HD11      LEU  15  -0.105  -3.054   3.941
  438   HD12  LEU  15          HD12      LEU  15  -0.669  -4.121   5.227
  439   HD13  LEU  15          HD13      LEU  15   0.869  -3.273   5.394
  440   HD21  LEU  15          HD21      LEU  15  -2.528  -0.788   5.084
  441   HD22  LEU  15          HD22      LEU  15  -2.978  -2.438   5.510
  442   HD23  LEU  15          HD23      LEU  15  -2.195  -2.106   3.969
  443    H    ASP  16           HN       ASP  16   0.072  -1.366   9.853
  444    HA   ASP  16           HA       ASP  16  -1.723  -2.625  11.660
  445    HB2  ASP  16           HB2      ASP  16   0.966  -1.304  12.034
  446    HB3  ASP  16           HB1      ASP  16   0.091  -2.081  13.353
  447    H    ASP  17           HN       ASP  17  -0.609   0.692  11.254
  448    HA   ASP  17           HA       ASP  17  -1.925   1.737  13.556
  449    HB2  ASP  17           HB2      ASP  17  -0.829   3.051  11.064
  450    HB3  ASP  17           HB1      ASP  17  -1.536   3.952  12.404
  451    H    SER  18           HN       SER  18  -3.052   0.639  10.583
  452    HA   SER  18           HA       SER  18  -5.125   2.420  10.000
  453    HB2  SER  18           HB2      SER  18  -6.041   0.689   8.640
  454    HB3  SER  18           HB1      SER  18  -4.292   0.479   8.589
  455    HG   SER  18           HG       SER  18  -6.079  -1.285   9.315
  456    H    SER  19           HN       SER  19  -4.752   0.205  12.560
  457    HA   SER  19           HA       SER  19  -7.577  -0.080  13.128
  458    HB2  SER  19           HB2      SER  19  -6.883  -1.297  15.090
  459    HB3  SER  19           HB1      SER  19  -5.867  -1.807  13.746
  460    HG   SER  19           HG       SER  19  -4.692   0.283  14.780
  461    H    SER  20           HN       SER  20  -5.232   2.257  13.672
  462    HA   SER  20           HA       SER  20  -6.337   3.341  16.117
  463    HB2  SER  20           HB2      SER  20  -4.313   4.504  14.191
  464    HB3  SER  20           HB1      SER  20  -4.736   5.183  15.760
  465    HG   SER  20           HG       SER  20  -2.842   3.664  15.555
  466    H2   ZBR 100           HA3      TBS 100  -1.655   0.526  -2.073
  467    H4   ZBR 100           HC3      TBS 100   0.203   1.190   1.770
  468    H6   ZBR 100           HB3      TBS 100   2.539  -0.361  -1.520
  469    H7   ZBR 100          HB11      TBS 100   1.097   0.301  -3.959
  470    H7A  ZBR 100          HB12      TBS 100  -0.457  -0.526  -3.798
  471    H8   ZBR 100          HA11      TBS 100  -2.445   2.337  -0.015
  472    H8A  ZBR 100          HA12      TBS 100  -2.106   1.541   1.527
  473    H9   ZBR 100          HC11      TBS 100   3.012   1.378   1.369
  474    H9A  ZBR 100          HC12      TBS 100   3.543  -0.111   0.581
  Start of MODEL    4
    1    H1   LYS   1           HN       LYS   1  -6.441   4.122  16.558
    2    HA   LYS   1           HA       LYS   1  -8.777   4.458  14.786
    3    HB2  LYS   1           HB2      LYS   1  -8.303   5.223  17.676
    4    HB3  LYS   1           HB1      LYS   1  -9.770   5.606  16.773
    5    HG2  LYS   1           HG2      LYS   1 -10.139   3.205  16.345
    6    HG3  LYS   1           HG1      LYS   1  -8.676   2.819  17.251
    7    HD2  LYS   1           HD2      LYS   1  -9.651   3.852  19.269
    8    HD3  LYS   1           HD1      LYS   1 -11.119   4.228  18.365
    9    HE2  LYS   1           HE2      LYS   1 -11.482   1.825  17.945
   10    HE3  LYS   1           HE1      LYS   1 -10.014   1.444  18.845
   11    HZ1  LYS   1           HZ1      LYS   1 -11.000   1.856  20.809
   12    HZ2  LYS   1           HZ2      LYS   1 -12.426   1.520  19.948
   13    HZ3  LYS   1           HZ3      LYS   1 -11.947   3.129  20.208
   14    H    ASN   2           HN       ASN   2  -5.889   5.709  14.859
   15    HA   ASN   2           HA       ASN   2  -6.246   8.466  15.238
   16    HB2  ASN   2           HB2      ASN   2  -4.171   8.596  13.669
   17    HB3  ASN   2           HB1      ASN   2  -4.010   7.823  15.238
   18   HD21  ASN   2          HD21      ASN   2  -5.278   6.690  12.038
   19   HD22  ASN   2          HD22      ASN   2  -4.327   5.288  12.014
   20    HA   PRO   3           HA       PRO   3  -8.418   9.981  11.676
   21    HB2  PRO   3           HB2      PRO   3  -6.106  11.840  11.194
   22    HB3  PRO   3           HB1      PRO   3  -7.835  12.210  11.349
   23    HG2  PRO   3           HG2      PRO   3  -6.149  12.746  13.321
   24    HG3  PRO   3           HG1      PRO   3  -7.779  12.128  13.659
   25    HD2  PRO   3           HD2      PRO   3  -5.151  10.682  13.797
   26    HD3  PRO   3           HD1      PRO   3  -6.606  10.506  14.802
   27    H    GLU   4           HN       GLU   4  -5.069   9.026  11.377
   28    HA   GLU   4           HA       GLU   4  -4.785   9.099   8.569
   29    HB2  GLU   4           HB2      GLU   4  -3.460   7.367  10.663
   30    HB3  GLU   4           HB1      GLU   4  -2.981   7.389   8.965
   31    HG2  GLU   4           HG2      GLU   4  -2.499   9.785   9.102
   32    HG3  GLU   4           HG1      GLU   4  -3.050   9.820  10.776
   33    H    ALA   5           HN       ALA   5  -6.730   7.168  10.543
   34    HA   ALA   5           HA       ALA   5  -6.734   4.690   9.240
   35    HB1  ALA   5           HB1      ALA   5  -9.070   6.126  10.532
   36    HB2  ALA   5           HB2      ALA   5  -7.901   5.112  11.378
   37    HB3  ALA   5           HB3      ALA   5  -8.984   4.400  10.183
   38    H    GLU   6           HN       GLU   6  -8.191   7.761   8.365
   39    HA   GLU   6           HA       GLU   6 -10.032   6.831   6.438
   40    HB2  GLU   6           HB2      GLU   6  -8.509   9.436   6.671
   41    HB3  GLU   6           HB1      GLU   6  -9.769   9.151   5.469
   42    HG2  GLU   6           HG2      GLU   6 -11.392   8.686   7.245
   43    HG3  GLU   6           HG1      GLU   6 -10.139   8.895   8.467
   44    H    GLU   7           HN       GLU   7  -6.598   7.669   6.233
   45    HA   GLU   7           HA       GLU   7  -6.362   7.382   3.424
   46    HB2  GLU   7           HB2      GLU   7  -4.659   8.560   4.740
   47    HB3  GLU   7           HB1      GLU   7  -4.249   7.061   5.573
   48    HG2  GLU   7           HG2      GLU   7  -2.654   7.504   3.751
   49    HG3  GLU   7           HG1      GLU   7  -3.575   6.048   3.410
   50    H    ILE   8           HN       ILE   8  -6.070   5.149   6.121
   51    HA   ILE   8           HA       ILE   8  -5.023   2.930   4.705
   52    HB   ILE   8           HB       ILE   8  -6.901   2.903   7.086
   53   HG12  ILE   8          HG12      ILE   8  -4.991   4.345   7.543
   54   HG13  ILE   8          HG11      ILE   8  -4.804   2.839   8.424
   55   HG21  ILE   8          HG21      ILE   8  -5.807   0.755   7.580
   56   HG22  ILE   8          HG22      ILE   8  -4.846   0.899   6.111
   57   HG23  ILE   8          HG23      ILE   8  -6.596   0.709   6.006
   58   HD11  ILE   8          HD11      ILE   8  -3.298   3.823   6.020
   59   HD12  ILE   8          HD12      ILE   8  -3.423   2.091   6.314
   60   HD13  ILE   8          HD13      ILE   8  -2.678   3.136   7.517
   61    H    THR   9           HN       THR   9  -8.351   4.006   5.303
   62    HA   THR   9           HA       THR   9  -9.669   1.798   4.159
   63    HB   THR   9           HB       THR   9 -10.532   4.699   4.266
   64    HG1  THR   9           HG1      THR   9 -10.720   4.252   6.293
   65   HG21  THR   9          HG21      THR   9 -12.833   3.590   4.185
   66   HG22  THR   9          HG22      THR   9 -11.998   2.129   3.658
   67   HG23  THR   9          HG23      THR   9 -11.920   3.592   2.676
   68    H    ARG  10           HN       ARG  10  -8.466   4.822   2.736
   69    HA   ARG  10           HA       ARG  10  -9.495   4.433   0.137
   70    HB2  ARG  10           HB2      ARG  10  -8.573   6.587   0.959
   71    HB3  ARG  10           HB1      ARG  10  -6.957   5.880   0.941
   72    HG2  ARG  10           HG2      ARG  10  -7.068   5.535  -1.454
   73    HG3  ARG  10           HG1      ARG  10  -8.756   6.045  -1.492
   74    HD2  ARG  10           HD2      ARG  10  -7.405   7.912  -2.216
   75    HD3  ARG  10           HD1      ARG  10  -8.032   8.281  -0.613
   76    HE   ARG  10           HE       ARG  10  -5.476   7.053  -0.395
   77   HH11  ARG  10          HH11      ARG  10  -3.689   8.391   0.049
   78   HH12  ARG  10          HH12      ARG  10  -3.810  10.099  -0.196
   79   HH21  ARG  10          HH21      ARG  10  -7.079   9.974  -1.340
   80   HH22  ARG  10          HH22      ARG  10  -5.725  10.995  -0.987
   81    H    CYS  11           HN       CYS  11  -6.433   3.470   1.631
   82    HA   CYS  11           HA       CYS  11  -5.203   2.410  -0.666
   83    HB2  CYS  11           HB2      CYS  11  -4.113   2.850   1.567
   84    HB3  CYS  11           HB1      CYS  11  -4.885   1.380   2.154
   85    H    LYS  12           HN       LYS  12  -7.458   1.034   1.662
   86    HA   LYS  12           HA       LYS  12  -7.296  -1.637   0.818
   87    HB2  LYS  12           HB2      LYS  12  -8.418  -0.911   2.908
   88    HB3  LYS  12           HB1      LYS  12  -9.695  -0.176   1.945
   89    HG2  LYS  12           HG2      LYS  12 -10.494  -2.331   2.664
   90    HG3  LYS  12           HG1      LYS  12 -10.138  -2.469   0.949
   91    HD2  LYS  12           HD2      LYS  12  -8.077  -3.628   1.380
   92    HD3  LYS  12           HD1      LYS  12  -8.147  -3.234   3.097
   93    HE2  LYS  12           HE2      LYS  12 -10.089  -5.009   1.592
   94    HE3  LYS  12           HE1      LYS  12  -8.836  -5.559   2.705
   95    HZ1  LYS  12           HZ1      LYS  12  -9.951  -4.029   4.374
   96    HZ2  LYS  12           HZ2      LYS  12 -10.764  -5.468   3.980
   97    HZ3  LYS  12           HZ3      LYS  12 -11.267  -3.993   3.305
   98    H    LYS  13           HN       LYS  13  -9.388   1.027  -0.235
   99    HA   LYS  13           HA       LYS  13 -10.960  -0.458  -2.037
  100    HB2  LYS  13           HB2      LYS  13 -10.198   2.468  -1.985
  101    HB3  LYS  13           HB1      LYS  13 -11.353   1.790  -3.132
  102    HG2  LYS  13           HG2      LYS  13 -12.736   0.969  -1.255
  103    HG3  LYS  13           HG1      LYS  13 -11.584   1.659  -0.110
  104    HD2  LYS  13           HD2      LYS  13 -12.001   3.909  -1.059
  105    HD3  LYS  13           HD1      LYS  13 -13.183   3.211  -2.168
  106    HE2  LYS  13           HE2      LYS  13 -13.347   3.094   0.859
  107    HE3  LYS  13           HE1      LYS  13 -14.277   4.185  -0.169
  108    HZ1  LYS  13           HZ1      LYS  13 -15.725   2.581  -0.592
  109    HZ2  LYS  13           HZ2      LYS  13 -14.936   1.604   0.551
  110    HZ3  LYS  13           HZ3      LYS  13 -14.502   1.516  -1.089
  111    H    LEU  14           HN       LEU  14  -7.879   1.228  -2.432
  112    HA   LEU  14           HA       LEU  14  -7.655   0.908  -5.231
  113    HB2  LEU  14           HB2      LEU  14  -5.581   1.221  -3.056
  114    HB3  LEU  14           HB1      LEU  14  -5.178   1.200  -4.770
  115    HG   LEU  14           HG       LEU  14  -7.181   3.110  -3.524
  116   HD11  LEU  14          HD11      LEU  14  -5.323   4.810  -3.909
  117   HD12  LEU  14          HD12      LEU  14  -4.232   3.440  -4.121
  118   HD13  LEU  14          HD13      LEU  14  -5.060   3.679  -2.586
  119   HD21  LEU  14          HD21      LEU  14  -7.714   3.151  -5.781
  120   HD22  LEU  14          HD22      LEU  14  -6.091   2.687  -6.290
  121   HD23  LEU  14          HD23      LEU  14  -6.416   4.339  -5.781
  122    H    LEU  15           HN       LEU  15  -6.661  -1.130  -2.513
  123    HA   LEU  15           HA       LEU  15  -5.294  -3.073  -4.051
  124    HB2  LEU  15           HB2      LEU  15  -6.650  -3.203  -1.354
  125    HB3  LEU  15           HB1      LEU  15  -5.705  -4.532  -2.023
  126    HG   LEU  15           HG       LEU  15  -4.628  -1.715  -1.678
  127   HD11  LEU  15          HD11      LEU  15  -4.491  -4.116   0.160
  128   HD12  LEU  15          HD12      LEU  15  -5.093  -2.498   0.531
  129   HD13  LEU  15          HD13      LEU  15  -3.368  -2.758   0.270
  130   HD21  LEU  15          HD21      LEU  15  -2.426  -3.184  -1.704
  131   HD22  LEU  15          HD22      LEU  15  -3.202  -2.760  -3.221
  132   HD23  LEU  15          HD23      LEU  15  -3.450  -4.360  -2.524
  133    H    ASP  16           HN       ASP  16  -8.655  -2.768  -3.020
  134    HA   ASP  16           HA       ASP  16  -9.530  -5.284  -4.002
  135    HB2  ASP  16           HB2      ASP  16 -10.989  -2.717  -3.378
  136    HB3  ASP  16           HB1      ASP  16 -11.811  -4.186  -3.902
  137    H    ASP  17           HN       ASP  17  -9.046  -2.169  -5.468
  138    HA   ASP  17           HA       ASP  17 -10.600  -2.514  -7.802
  139    HB2  ASP  17           HB2      ASP  17  -8.168  -0.807  -7.250
  140    HB3  ASP  17           HB1      ASP  17  -9.048  -0.765  -8.770
  141    H    SER  18           HN       SER  18  -7.905  -4.182  -6.761
  142    HA   SER  18           HA       SER  18  -6.362  -4.536  -9.042
  143    HB2  SER  18           HB2      SER  18  -7.003  -6.526  -6.862
  144    HB3  SER  18           HB1      SER  18  -5.702  -6.708  -8.036
  145    HG   SER  18           HG       SER  18  -4.553  -5.407  -6.866
  146    H    SER  19           HN       SER  19  -9.410  -5.929  -8.149
  147    HA   SER  19           HA       SER  19  -9.406  -7.868 -10.298
  148    HB2  SER  19           HB2      SER  19 -11.631  -8.439  -9.560
  149    HB3  SER  19           HB1      SER  19 -10.605  -8.256  -8.141
  150    HG   SER  19           HG       SER  19 -11.843  -6.679  -7.532
  151    H    SER  20           HN       SER  20  -9.957  -4.600 -10.076
  152    HA   SER  20           HA       SER  20 -12.031  -4.373 -12.076
  153    HB2  SER  20           HB2      SER  20 -11.850  -2.044 -11.798
  154    HB3  SER  20           HB1      SER  20 -11.523  -2.695 -10.195
  155    HG   SER  20           HG       SER  20  -9.426  -2.287 -12.025
  156    H1   LYS   1           HN       LYS   1 -11.776  -3.532 -14.182
  157    HA   LYS   1           HA       LYS   1  -9.158  -4.144 -15.393
  158    HB2  LYS   1           HB2      LYS   1 -11.920  -3.843 -16.594
  159    HB3  LYS   1           HB1      LYS   1 -10.453  -4.125 -17.535
  160    HG2  LYS   1           HG2      LYS   1 -10.045  -6.209 -16.284
  161    HG3  LYS   1           HG1      LYS   1 -11.512  -5.933 -15.344
  162    HD2  LYS   1           HD2      LYS   1 -12.855  -6.012 -17.412
  163    HD3  LYS   1           HD1      LYS   1 -11.389  -6.294 -18.352
  164    HE2  LYS   1           HE2      LYS   1 -10.981  -8.381 -17.102
  165    HE3  LYS   1           HE1      LYS   1 -12.445  -8.102 -16.158
  166    HZ1  LYS   1           HZ1      LYS   1 -13.771  -8.669 -17.869
  167    HZ2  LYS   1           HZ2      LYS   1 -12.406  -9.544 -18.377
  168    HZ3  LYS   1           HZ3      LYS   1 -12.741  -8.020 -19.048
  169    H    ASN   2           HN       ASN   2 -10.367  -1.589 -14.022
  170    HA   ASN   2           HA       ASN   2 -10.388   0.409 -15.996
  171    HB2  ASN   2           HB2      ASN   2  -9.870   1.942 -13.963
  172    HB3  ASN   2           HB1      ASN   2 -11.393   1.067 -14.003
  173   HD21  ASN   2          HD21      ASN   2  -8.023   0.133 -13.052
  174   HD22  ASN   2          HD22      ASN   2  -8.485  -0.500 -11.550
  175    HA   PRO   3           HA       PRO   3  -6.151   1.194 -17.056
  176    HB2  PRO   3           HB2      PRO   3  -6.588   4.057 -16.261
  177    HB3  PRO   3           HB1      PRO   3  -5.970   3.393 -17.787
  178    HG2  PRO   3           HG2      PRO   3  -8.439   4.350 -17.617
  179    HG3  PRO   3           HG1      PRO   3  -8.083   2.906 -18.586
  180    HD2  PRO   3           HD2      PRO   3  -9.423   3.096 -15.910
  181    HD3  PRO   3           HD1      PRO   3  -9.712   1.972 -17.253
  182    H    GLU   4           HN       GLU   4  -7.384   2.271 -13.970
  183    HA   GLU   4           HA       GLU   4  -4.972   3.040 -12.721
  184    HB2  GLU   4           HB2      GLU   4  -7.539   1.923 -11.578
  185    HB3  GLU   4           HB1      GLU   4  -6.211   2.533 -10.590
  186    HG2  GLU   4           HG2      GLU   4  -6.383   4.727 -11.672
  187    HG3  GLU   4           HG1      GLU   4  -7.670   4.128 -12.717
  188    H    ALA   5           HN       ALA   5  -6.035   0.023 -13.795
  189    HA   ALA   5           HA       ALA   5  -5.022  -1.753 -11.881
  190    HB1  ALA   5           HB1      ALA   5  -5.095  -2.079 -14.894
  191    HB2  ALA   5           HB2      ALA   5  -6.415  -2.466 -13.790
  192    HB3  ALA   5           HB3      ALA   5  -4.910  -3.383 -13.722
  193    H    GLU   6           HN       GLU   6  -3.407   0.153 -14.347
  194    HA   GLU   6           HA       GLU   6  -0.940  -1.215 -14.401
  195    HB2  GLU   6           HB2      GLU   6  -1.637   1.694 -14.868
  196    HB3  GLU   6           HB1      GLU   6  -0.032   1.021 -15.158
  197    HG2  GLU   6           HG2      GLU   6  -0.964  -0.580 -16.761
  198    HG3  GLU   6           HG1      GLU   6  -2.591   0.017 -16.438
  199    H    GLU   7           HN       GLU   7  -2.193   1.350 -12.311
  200    HA   GLU   7           HA       GLU   7   0.210   1.804 -10.881
  201    HB2  GLU   7           HB2      GLU   7  -1.636   3.420 -10.826
  202    HB3  GLU   7           HB1      GLU   7  -2.659   2.243 -10.004
  203    HG2  GLU   7           HG2      GLU   7  -1.683   3.826  -8.389
  204    HG3  GLU   7           HG1      GLU   7  -1.080   2.202  -8.095
  205    H    ILE   8           HN       ILE   8  -2.483  -0.413 -10.456
  206    HA   ILE   8           HA       ILE   8  -1.803  -1.393  -7.886
  207    HB   ILE   8           HB       ILE   8  -3.137  -2.896 -10.159
  208   HG12  ILE   8          HG12      ILE   8  -4.281  -0.779  -9.772
  209   HG13  ILE   8          HG11      ILE   8  -5.251  -2.088  -9.117
  210   HG21  ILE   8          HG21      ILE   8  -4.179  -4.177  -8.341
  211   HG22  ILE   8          HG22      ILE   8  -3.288  -3.239  -7.150
  212   HG23  ILE   8          HG23      ILE   8  -2.428  -4.307  -8.257
  213   HD11  ILE   8          HD11      ILE   8  -3.673   0.012  -7.663
  214   HD12  ILE   8          HD12      ILE   8  -3.982  -1.534  -6.876
  215   HD13  ILE   8          HD13      ILE   8  -5.328  -0.524  -7.391
  216    H    THR   9           HN       THR   9  -0.835  -2.408 -11.145
  217    HA   THR   9           HA       THR   9   0.624  -4.698 -10.409
  218    HB   THR   9           HB       THR   9   1.081  -2.795 -12.720
  219    HG1  THR   9           HG1      THR   9  -0.683  -3.673 -13.396
  220   HG21  THR   9          HG21      THR   9   2.080  -4.926 -13.731
  221   HG22  THR   9          HG22      THR   9   2.114  -5.562 -12.086
  222   HG23  THR   9          HG23      THR   9   3.046  -4.121 -12.494
  223    H    ARG  10           HN       ARG  10   1.582  -1.290 -10.692
  224    HA   ARG  10           HA       ARG  10   4.339  -1.649 -10.213
  225    HB2  ARG  10           HB2      ARG  10   3.340   0.452 -11.080
  226    HB3  ARG  10           HB1      ARG  10   2.617   0.738  -9.497
  227    HG2  ARG  10           HG2      ARG  10   4.801   0.868  -8.454
  228    HG3  ARG  10           HG1      ARG  10   5.591   0.393  -9.958
  229    HD2  ARG  10           HD2      ARG  10   5.779   2.794  -9.746
  230    HD3  ARG  10           HD1      ARG  10   4.634   2.445 -11.037
  231    HE   ARG  10           HE       ARG  10   3.250   2.754  -8.571
  232   HH11  ARG  10          HH11      ARG  10   2.156   4.713  -8.209
  233   HH12  ARG  10          HH12      ARG  10   2.539   6.104  -9.165
  234   HH21  ARG  10          HH21      ARG  10   4.982   4.489 -11.018
  235   HH22  ARG  10          HH22      ARG  10   4.139   5.979 -10.751
  236    H    CYS  11           HN       CYS  11   1.613  -1.101  -8.022
  237    HA   CYS  11           HA       CYS  11   3.082  -0.864  -5.635
  238    HB2  CYS  11           HB2      CYS  11   0.635  -0.355  -5.957
  239    HB3  CYS  11           HB1      CYS  11   0.339  -2.090  -5.920
  240    H    LYS  12           HN       LYS  12   1.879  -3.660  -7.402
  241    HA   LYS  12           HA       LYS  12   2.391  -5.598  -5.435
  242    HB2  LYS  12           HB2      LYS  12   1.039  -6.018  -7.474
  243    HB3  LYS  12           HB1      LYS  12   2.504  -5.917  -8.443
  244    HG2  LYS  12           HG2      LYS  12   2.061  -8.253  -8.072
  245    HG3  LYS  12           HG1      LYS  12   3.438  -7.834  -7.065
  246    HD2  LYS  12           HD2      LYS  12   2.081  -7.762  -5.084
  247    HD3  LYS  12           HD1      LYS  12   0.593  -7.814  -6.030
  248    HE2  LYS  12           HE2      LYS  12   2.667 -10.018  -5.839
  249    HE3  LYS  12           HE1      LYS  12   1.088 -10.015  -5.052
  250    HZ1  LYS  12           HZ1      LYS  12   0.155  -9.702  -7.366
  251    HZ2  LYS  12           HZ2      LYS  12   0.798 -11.234  -7.006
  252    HZ3  LYS  12           HZ3      LYS  12   1.691 -10.133  -7.944
  253    H    LYS  13           HN       LYS  13   4.414  -4.323  -8.054
  254    HA   LYS  13           HA       LYS  13   6.618  -6.029  -7.651
  255    HB2  LYS  13           HB2      LYS  13   6.429  -3.231  -8.783
  256    HB3  LYS  13           HB1      LYS  13   7.917  -4.180  -8.789
  257    HG2  LYS  13           HG2      LYS  13   6.772  -5.968 -10.053
  258    HG3  LYS  13           HG1      LYS  13   5.287  -5.016 -10.052
  259    HD2  LYS  13           HD2      LYS  13   6.459  -3.204 -11.269
  260    HD3  LYS  13           HD1      LYS  13   7.923  -4.187 -11.303
  261    HE2  LYS  13           HE2      LYS  13   5.262  -4.982 -12.522
  262    HE3  LYS  13           HE1      LYS  13   6.651  -4.376 -13.422
  263    HZ1  LYS  13           HZ1      LYS  13   7.580  -6.372 -13.389
  264    HZ2  LYS  13           HZ2      LYS  13   6.139  -6.990 -12.734
  265    HZ3  LYS  13           HZ3      LYS  13   7.404  -6.507 -11.707
  266    H    LEU  14           HN       LEU  14   5.752  -2.918  -6.218
  267    HA   LEU  14           HA       LEU  14   8.153  -2.505  -4.786
  268    HB2  LEU  14           HB2      LEU  14   5.320  -1.572  -4.298
  269    HB3  LEU  14           HB1      LEU  14   6.690  -1.030  -3.333
  270    HG   LEU  14           HG       LEU  14   6.537  -0.787  -6.354
  271   HD11  LEU  14          HD11      LEU  14   6.198   1.679  -5.831
  272   HD12  LEU  14          HD12      LEU  14   5.851   1.193  -4.171
  273   HD13  LEU  14          HD13      LEU  14   4.824   0.634  -5.486
  274   HD21  LEU  14          HD21      LEU  14   8.803  -0.589  -5.918
  275   HD22  LEU  14          HD22      LEU  14   8.552  -0.021  -4.267
  276   HD23  LEU  14          HD23      LEU  14   8.326   1.079  -5.622
  277    H    LEU  15           HN       LEU  15   5.144  -4.181  -3.962
  278    HA   LEU  15           HA       LEU  15   5.809  -4.745  -1.270
  279    HB2  LEU  15           HB2      LEU  15   3.963  -6.106  -3.237
  280    HB3  LEU  15           HB1      LEU  15   4.069  -6.566  -1.541
  281    HG   LEU  15           HG       LEU  15   3.480  -3.739  -2.476
  282   HD11  LEU  15          HD11      LEU  15   1.613  -6.017  -1.786
  283   HD12  LEU  15          HD12      LEU  15   1.640  -5.033  -3.252
  284   HD13  LEU  15          HD13      LEU  15   1.108  -4.327  -1.726
  285   HD21  LEU  15          HD21      LEU  15   2.440  -3.787  -0.037
  286   HD22  LEU  15          HD22      LEU  15   4.167  -3.539  -0.243
  287   HD23  LEU  15          HD23      LEU  15   3.553  -5.130   0.199
  288    H    ASP  16           HN       ASP  16   6.348  -6.492  -4.289
  289    HA   ASP  16           HA       ASP  16   7.450  -8.836  -3.127
  290    HB2  ASP  16           HB2      ASP  16   7.682  -7.620  -5.880
  291    HB3  ASP  16           HB1      ASP  16   8.417  -9.162  -5.446
  292    H    ASP  17           HN       ASP  17   8.762  -5.727  -3.967
  293    HA   ASP  17           HA       ASP  17  11.508  -6.385  -3.989
  294    HB2  ASP  17           HB2      ASP  17  10.078  -3.788  -3.410
  295    HB3  ASP  17           HB1      ASP  17  11.828  -3.927  -3.479
  296    H    SER  18           HN       SER  18   9.296  -6.517  -1.497
  297    HA   SER  18           HA       SER  18  10.650  -5.531   0.717
  298    HB2  SER  18           HB2      SER  18   8.842  -7.943   0.515
  299    HB3  SER  18           HB1      SER  18   9.325  -7.177   2.027
  300    HG   SER  18           HG       SER  18   7.890  -5.689   1.674
  301    H    SER  19           HN       SER  19  11.087  -8.478  -1.058
  302    HA   SER  19           HA       SER  19  12.891  -9.648   0.877
  303    HB2  SER  19           HB2      SER  19  13.161 -11.447  -0.717
  304    HB3  SER  19           HB1      SER  19  11.452 -11.037  -0.615
  305    HG   SER  19           HG       SER  19  11.529 -10.535  -2.647
  306    H    SER  20           HN       SER  20  13.142  -7.300  -1.463
  307    HA   SER  20           HA       SER  20  15.862  -7.817  -2.298
  308    HB2  SER  20           HB2      SER  20  15.689  -5.855  -3.594
  309    HB3  SER  20           HB1      SER  20  14.073  -6.553  -3.640
  310    HG   SER  20           HG       SER  20  14.825  -4.696  -1.653
  311    H1   LYS   1           HN       LYS   1  17.689  -6.549  -1.752
  312    HA   LYS   1           HA       LYS   1  17.567  -5.415   0.969
  313    HB2  LYS   1           HB2      LYS   1  19.883  -6.383  -0.721
  314    HB3  LYS   1           HB1      LYS   1  20.063  -5.631   0.867
  315    HG2  LYS   1           HG2      LYS   1  18.644  -7.384   1.864
  316    HG3  LYS   1           HG1      LYS   1  18.460  -8.139   0.280
  317    HD2  LYS   1           HD2      LYS   1  20.900  -8.486   0.160
  318    HD3  LYS   1           HD1      LYS   1  21.083  -7.738   1.748
  319    HE2  LYS   1           HE2      LYS   1  19.665  -9.492   2.745
  320    HE3  LYS   1           HE1      LYS   1  19.474 -10.242   1.160
  321    HZ1  LYS   1           HZ1      LYS   1  21.548 -11.073   1.200
  322    HZ2  LYS   1           HZ2      LYS   1  21.374 -10.926   2.883
  323    HZ3  LYS   1           HZ3      LYS   1  22.205  -9.732   2.004
  324    H    ASN   2           HN       ASN   2  17.038  -4.239  -1.896
  325    HA   ASN   2           HA       ASN   2  18.926  -2.197  -2.266
  326    HB2  ASN   2           HB2      ASN   2  16.951  -1.076  -3.540
  327    HB3  ASN   2           HB1      ASN   2  17.616  -2.584  -4.148
  328   HD21  ASN   2          HD21      ASN   2  15.235  -1.816  -1.526
  329   HD22  ASN   2          HD22      ASN   2  14.062  -2.893  -2.101
  330    HA   PRO   3           HA       PRO   3  18.076   0.913   0.783
  331    HB2  PRO   3           HB2      PRO   3  17.703   2.868  -1.466
  332    HB3  PRO   3           HB1      PRO   3  18.768   2.970  -0.049
  333    HG2  PRO   3           HG2      PRO   3  19.741   2.415  -2.456
  334    HG3  PRO   3           HG1      PRO   3  20.383   1.621  -1.004
  335    HD2  PRO   3           HD2      PRO   3  18.578   0.501  -3.120
  336    HD3  PRO   3           HD1      PRO   3  19.850  -0.292  -2.167
  337    H    GLU   4           HN       GLU   4  15.899   0.507  -1.918
  338    HA   GLU   4           HA       GLU   4  13.771   2.164  -1.089
  339    HB2  GLU   4           HB2      GLU   4  13.794  -0.360  -2.754
  340    HB3  GLU   4           HB1      GLU   4  12.366   0.651  -2.525
  341    HG2  GLU   4           HG2      GLU   4  13.548   2.576  -3.480
  342    HG3  GLU   4           HG1      GLU   4  15.008   1.605  -3.665
  343    H    ALA   5           HN       ALA   5  15.026  -0.658   0.276
  344    HA   ALA   5           HA       ALA   5  12.763  -1.967   1.280
  345    HB1  ALA   5           HB1      ALA   5  15.486  -1.651   2.574
  346    HB2  ALA   5           HB2      ALA   5  15.037  -2.906   1.421
  347    HB3  ALA   5           HB3      ALA   5  14.275  -2.856   3.011
  348    H    GLU   6           HN       GLU   6  14.390   0.966   2.322
  349    HA   GLU   6           HA       GLU   6  13.288   1.173   4.912
  350    HB2  GLU   6           HB2      GLU   6  14.173   3.285   2.931
  351    HB3  GLU   6           HB1      GLU   6  13.702   3.646   4.593
  352    HG2  GLU   6           HG2      GLU   6  15.460   2.156   5.436
  353    HG3  GLU   6           HG1      GLU   6  15.908   1.727   3.786
  354    H    GLU   7           HN       GLU   7  12.100   2.182   1.734
  355    HA   GLU   7           HA       GLU   7   9.794   3.542   2.665
  356    HB2  GLU   7           HB2      GLU   7  10.645   3.872   0.387
  357    HB3  GLU   7           HB1      GLU   7  10.280   2.192  -0.005
  358    HG2  GLU   7           HG2      GLU   7   8.497   3.679  -0.824
  359    HG3  GLU   7           HG1      GLU   7   7.874   2.617   0.431
  360    H    ILE   8           HN       ILE   8  10.457   0.200   1.800
  361    HA   ILE   8           HA       ILE   8   7.796  -0.772   1.855
  362    HB   ILE   8           HB       ILE   8  10.335  -2.246   2.618
  363   HG12  ILE   8          HG12      ILE   8  10.599  -1.198   0.435
  364   HG13  ILE   8          HG11      ILE   8  10.364  -2.925   0.223
  365   HG21  ILE   8          HG21      ILE   8   9.084  -4.230   1.873
  366   HG22  ILE   8          HG22      ILE   8   7.670  -3.228   1.557
  367   HG23  ILE   8          HG23      ILE   8   8.258  -3.433   3.207
  368   HD11  ILE   8          HD11      ILE   8   8.479  -0.668  -0.388
  369   HD12  ILE   8          HD12      ILE   8   7.828  -2.267  -0.039
  370   HD13  ILE   8          HD13      ILE   8   8.931  -2.043  -1.390
  371    H    THR   9           HN       THR   9  10.245  -0.420   4.400
  372    HA   THR   9           HA       THR   9   8.814  -1.679   6.470
  373    HB   THR   9           HB       THR   9  10.800   0.602   6.623
  374    HG1  THR   9           HG1      THR   9  12.135  -0.913   6.121
  375   HG21  THR   9          HG21      THR   9  11.149  -0.413   8.948
  376   HG22  THR   9          HG22      THR   9   9.617  -1.250   8.694
  377   HG23  THR   9          HG23      THR   9   9.666   0.512   8.713
  378    H    ARG  10           HN       ARG  10   8.849   1.687   5.341
  379    HA   ARG  10           HA       ARG  10   7.198   2.764   7.359
  380    HB2  ARG  10           HB2      ARG  10   8.534   4.132   5.774
  381    HB3  ARG  10           HB1      ARG  10   7.439   3.660   4.475
  382    HG2  ARG  10           HG2      ARG  10   5.564   4.717   5.589
  383    HG3  ARG  10           HG1      ARG  10   6.548   5.055   7.013
  384    HD2  ARG  10           HD2      ARG  10   6.415   7.084   5.705
  385    HD3  ARG  10           HD1      ARG  10   8.050   6.449   5.566
  386    HE   ARG  10           HE       ARG  10   6.453   5.462   3.433
  387   HH11  ARG  10          HH11      ARG  10   6.698   6.423   1.387
  388   HH12  ARG  10          HH12      ARG  10   7.461   7.970   1.246
  389   HH21  ARG  10          HH21      ARG  10   7.981   8.321   4.654
  390   HH22  ARG  10          HH22      ARG  10   8.183   9.046   3.095
  391    H    CYS  11           HN       CYS  11   6.447   1.312   4.219
  392    HA   CYS  11           HA       CYS  11   3.677   1.800   4.221
  393    HB2  CYS  11           HB2      CYS  11   5.077   0.966   2.289
  394    HB3  CYS  11           HB1      CYS  11   5.040  -0.621   3.045
  395    H    LYS  12           HN       LYS  12   5.622  -0.782   5.618
  396    HA   LYS  12           HA       LYS  12   3.517  -2.496   6.334
  397    HB2  LYS  12           HB2      LYS  12   5.911  -3.149   6.382
  398    HB3  LYS  12           HB1      LYS  12   6.156  -2.082   7.761
  399    HG2  LYS  12           HG2      LYS  12   5.877  -4.305   8.634
  400    HG3  LYS  12           HG1      LYS  12   4.396  -3.435   8.998
  401    HD2  LYS  12           HD2      LYS  12   3.217  -4.513   7.200
  402    HD3  LYS  12           HD1      LYS  12   4.713  -5.162   6.532
  403    HE2  LYS  12           HE2      LYS  12   3.493  -5.883   9.212
  404    HE3  LYS  12           HE1      LYS  12   3.485  -6.895   7.768
  405    HZ1  LYS  12           HZ1      LYS  12   5.993  -6.645   7.833
  406    HZ2  LYS  12           HZ2      LYS  12   5.288  -7.644   9.014
  407    HZ3  LYS  12           HZ3      LYS  12   5.794  -6.073   9.417
  408    H    LYS  13           HN       LYS  13   5.075   0.161   8.093
  409    HA   LYS  13           HA       LYS  13   3.660  -0.143  10.507
  410    HB2  LYS  13           HB2      LYS  13   4.917   2.285   9.214
  411    HB3  LYS  13           HB1      LYS  13   4.226   2.301  10.837
  412    HG2  LYS  13           HG2      LYS  13   5.760   0.485  11.509
  413    HG3  LYS  13           HG1      LYS  13   6.456   0.475   9.888
  414    HD2  LYS  13           HD2      LYS  13   7.145   2.836  10.176
  415    HD3  LYS  13           HD1      LYS  13   6.480   2.821  11.811
  416    HE2  LYS  13           HE2      LYS  13   8.689   0.999  10.810
  417    HE3  LYS  13           HE1      LYS  13   8.927   2.424  11.820
  418    HZ1  LYS  13           HZ1      LYS  13   8.382   1.276  13.617
  419    HZ2  LYS  13           HZ2      LYS  13   8.375  -0.136  12.671
  420    HZ3  LYS  13           HZ3      LYS  13   6.936   0.732  12.918
  421    H    LEU  14           HN       LEU  14   2.925   1.657   7.557
  422    HA   LEU  14           HA       LEU  14   0.618   2.979   8.516
  423    HB2  LEU  14           HB2      LEU  14   1.461   2.139   5.737
  424    HB3  LEU  14           HB1      LEU  14   0.035   3.122   6.055
  425    HG   LEU  14           HG       LEU  14   2.834   3.850   6.977
  426   HD11  LEU  14          HD11      LEU  14   2.639   5.591   5.120
  427   HD12  LEU  14          HD12      LEU  14   1.292   4.638   4.496
  428   HD13  LEU  14          HD13      LEU  14   2.902   3.934   4.597
  429   HD21  LEU  14          HD21      LEU  14   1.440   5.123   8.336
  430   HD22  LEU  14          HD22      LEU  14   0.133   5.159   7.152
  431   HD23  LEU  14          HD23      LEU  14   1.542   6.190   6.941
  432    H    LEU  15           HN       LEU  15   1.092  -0.166   6.964
  433    HA   LEU  15           HA       LEU  15  -1.649  -0.825   6.728
  434    HB2  LEU  15           HB2      LEU  15   0.841  -2.528   6.912
  435    HB3  LEU  15           HB1      LEU  15  -0.759  -3.192   6.593
  436    HG   LEU  15           HG       LEU  15   0.505  -0.994   4.926
  437   HD11  LEU  15          HD11      LEU  15   0.539  -3.998   4.583
  438   HD12  LEU  15          HD12      LEU  15   1.912  -2.889   4.615
  439   HD13  LEU  15          HD13      LEU  15   0.809  -2.885   3.239
  440   HD21  LEU  15          HD21      LEU  15  -1.245  -2.055   3.253
  441   HD22  LEU  15          HD22      LEU  15  -1.798  -0.914   4.466
  442   HD23  LEU  15          HD23      LEU  15  -2.013  -2.644   4.724
  443    H    ASP  16           HN       ASP  16   0.731  -1.358   9.278
  444    HA   ASP  16           HA       ASP  16  -0.928  -2.935  10.957
  445    HB2  ASP  16           HB2      ASP  16   1.513  -1.246  11.500
  446    HB3  ASP  16           HB1      ASP  16   0.714  -2.201  12.747
  447    H    ASP  17           HN       ASP  17  -0.571   0.490  10.472
  448    HA   ASP  17           HA       ASP  17  -1.786   1.416  12.845
  449    HB2  ASP  17           HB2      ASP  17  -1.541   2.665  10.106
  450    HB3  ASP  17           HB1      ASP  17  -2.247   3.497  11.484
  451    H    SER  18           HN       SER  18  -3.074  -0.381  10.343
  452    HA   SER  18           HA       SER  18  -5.597   0.698   9.913
  453    HB2  SER  18           HB2      SER  18  -4.767  -2.204  10.038
  454    HB3  SER  18           HB1      SER  18  -6.293  -1.627   9.371
  455    HG   SER  18           HG       SER  18  -5.267  -1.121   7.618
  456    H    SER  19           HN       SER  19  -4.356  -1.133  12.587
  457    HA   SER  19           HA       SER  19  -6.949  -1.528  13.810
  458    HB2  SER  19           HB2      SER  19  -5.741  -2.541  15.643
  459    HB3  SER  19           HB1      SER  19  -5.059  -3.130  14.130
  460    HG   SER  19           HG       SER  19  -3.244  -2.224  14.659
  461    H    SER  20           HN       SER  20  -4.815   1.007  13.567
  462    HA   SER  20           HA       SER  20  -5.264   2.203  16.160
  463    HB2  SER  20           HB2      SER  20  -3.894   3.968  15.432
  464    HB3  SER  20           HB1      SER  20  -3.213   2.549  14.644
  465    HG   SER  20           HG       SER  20  -5.231   4.058  13.387
  466    H2   ZBR 100           HA3      TBS 100  -1.658   1.295  -1.893
  467    H4   ZBR 100           HC3      TBS 100   0.700   1.755   1.696
  468    H6   ZBR 100           HB3      TBS 100   2.541   0.293  -1.926
  469    H7   ZBR 100          HB11      TBS 100   0.886   1.072  -4.118
  470    H7A  ZBR 100          HB12      TBS 100  -0.713   0.372  -3.827
  471    H8   ZBR 100          HA11      TBS 100  -2.150   3.016   0.286
  472    H8A  ZBR 100          HA12      TBS 100  -1.597   2.214   1.762
  473    H9   ZBR 100          HC11      TBS 100   3.449   1.898   0.904
  474    H9A  ZBR 100          HC12      TBS 100   3.800   0.391   0.049
  Start of MODEL    5
    1    H1   LYS   1           HN       LYS   1  -6.814   4.325  17.710
    2    HA   LYS   1           HA       LYS   1  -9.118   4.683  16.035
    3    HB2  LYS   1           HB2      LYS   1  -8.295   5.974  18.645
    4    HB3  LYS   1           HB1      LYS   1  -9.841   6.266  17.846
    5    HG2  LYS   1           HG2      LYS   1 -10.348   3.848  17.951
    6    HG3  LYS   1           HG1      LYS   1  -8.811   3.567  18.770
    7    HD2  LYS   1           HD2      LYS   1  -9.515   5.011  20.629
    8    HD3  LYS   1           HD1      LYS   1 -11.039   5.345  19.806
    9    HE2  LYS   1           HE2      LYS   1 -11.383   3.591  21.476
   10    HE3  LYS   1           HE1      LYS   1 -11.568   2.913  19.859
   11    HZ1  LYS   1           HZ1      LYS   1  -9.426   1.970  19.954
   12    HZ2  LYS   1           HZ2      LYS   1 -10.161   1.595  21.440
   13    HZ3  LYS   1           HZ3      LYS   1  -9.009   2.841  21.347
   14    H    ASN   2           HN       ASN   2  -6.228   5.791  15.507
   15    HA   ASN   2           HA       ASN   2  -6.453   8.600  15.364
   16    HB2  ASN   2           HB2      ASN   2  -4.484   8.440  13.861
   17    HB3  ASN   2           HB1      ASN   2  -4.293   7.474  15.317
   18   HD21  ASN   2          HD21      ASN   2  -2.857   6.931  12.861
   19   HD22  ASN   2          HD22      ASN   2  -3.382   5.424  12.284
   20    HA   PRO   3           HA       PRO   3  -9.025   9.170  11.797
   21    HB2  PRO   3           HB2      PRO   3  -7.993  11.513  10.765
   22    HB3  PRO   3           HB1      PRO   3  -9.025  11.444  12.208
   23    HG2  PRO   3           HG2      PRO   3  -6.045  11.615  12.026
   24    HG3  PRO   3           HG1      PRO   3  -7.158  12.486  13.099
   25    HD2  PRO   3           HD2      PRO   3  -5.753  10.347  13.967
   26    HD3  PRO   3           HD1      PRO   3  -7.402  10.672  14.545
   27    H    GLU   4           HN       GLU   4  -5.590   8.898  11.499
   28    HA   GLU   4           HA       GLU   4  -5.315   8.957   8.683
   29    HB2  GLU   4           HB2      GLU   4  -3.680   7.520  10.789
   30    HB3  GLU   4           HB1      GLU   4  -3.195   7.714   9.103
   31    HG2  GLU   4           HG2      GLU   4  -3.833  10.014  10.972
   32    HG3  GLU   4           HG1      GLU   4  -2.203   9.445  10.623
   33    H    ALA   5           HN       ALA   5  -6.722   6.660  10.785
   34    HA   ALA   5           HA       ALA   5  -6.266   4.243   9.439
   35    HB1  ALA   5           HB1      ALA   5  -7.392   4.595  11.699
   36    HB2  ALA   5           HB2      ALA   5  -8.139   3.392  10.646
   37    HB3  ALA   5           HB3      ALA   5  -8.856   4.995  10.800
   38    H    GLU   6           HN       GLU   6  -8.482   6.886   8.789
   39    HA   GLU   6           HA       GLU   6 -10.174   5.585   6.945
   40    HB2  GLU   6           HB2      GLU   6  -9.342   8.482   7.196
   41    HB3  GLU   6           HB1      GLU   6 -10.587   7.915   6.082
   42    HG2  GLU   6           HG2      GLU   6 -11.882   7.004   7.952
   43    HG3  GLU   6           HG1      GLU   6 -10.624   7.497   9.084
   44    H    GLU   7           HN       GLU   7  -7.032   7.175   6.576
   45    HA   GLU   7           HA       GLU   7  -6.951   7.218   3.755
   46    HB2  GLU   7           HB2      GLU   7  -5.370   8.459   5.238
   47    HB3  GLU   7           HB1      GLU   7  -4.620   6.923   5.669
   48    HG2  GLU   7           HG2      GLU   7  -3.320   7.959   3.890
   49    HG3  GLU   7           HG1      GLU   7  -4.126   6.534   3.242
   50    H    ILE   8           HN       ILE   8  -5.985   4.776   6.129
   51    HA   ILE   8           HA       ILE   8  -4.815   2.935   4.300
   52    HB   ILE   8           HB       ILE   8  -6.011   2.644   7.055
   53   HG12  ILE   8          HG12      ILE   8  -3.719   2.234   7.686
   54   HG13  ILE   8          HG11      ILE   8  -3.227   2.068   6.005
   55   HG21  ILE   8          HG21      ILE   8  -5.162   0.477   5.129
   56   HG22  ILE   8          HG22      ILE   8  -6.570   0.522   6.190
   57   HG23  ILE   8          HG23      ILE   8  -4.968   0.244   6.862
   58   HD11  ILE   8          HD11      ILE   8  -3.505   4.386   5.585
   59   HD12  ILE   8          HD12      ILE   8  -2.704   4.302   7.153
   60   HD13  ILE   8          HD13      ILE   8  -4.432   4.613   7.065
   61    H    THR   9           HN       THR   9  -8.145   3.389   5.408
   62    HA   THR   9           HA       THR   9  -9.263   1.083   4.248
   63    HB   THR   9           HB       THR   9 -10.497   3.822   4.659
   64    HG1  THR   9           HG1      THR   9 -11.283   1.962   6.377
   65   HG21  THR   9          HG21      THR   9 -11.699   1.096   4.116
   66   HG22  THR   9          HG22      THR   9 -11.877   2.558   3.145
   67   HG23  THR   9          HG23      THR   9 -12.627   2.460   4.739
   68    H    ARG  10           HN       ARG  10  -8.698   4.334   2.931
   69    HA   ARG  10           HA       ARG  10  -9.924   3.915   0.417
   70    HB2  ARG  10           HB2      ARG  10  -9.224   6.145   1.340
   71    HB3  ARG  10           HB1      ARG  10  -7.550   5.700   1.006
   72    HG2  ARG  10           HG2      ARG  10  -8.158   5.355  -1.390
   73    HG3  ARG  10           HG1      ARG  10  -9.790   5.916  -1.028
   74    HD2  ARG  10           HD2      ARG  10  -8.563   7.798  -1.891
   75    HD3  ARG  10           HD1      ARG  10  -8.772   8.053  -0.161
   76    HE   ARG  10           HE       ARG  10  -6.463   7.796   0.117
   77   HH11  ARG  10          HH11      ARG  10  -4.354   7.622  -0.719
   78   HH12  ARG  10          HH12      ARG  10  -4.120   7.150  -2.368
   79   HH21  ARG  10          HH21      ARG  10  -7.508   6.845  -3.040
   80   HH22  ARG  10          HH22      ARG  10  -5.905   6.709  -3.684
   81    H    CYS  11           HN       CYS  11  -6.636   3.341   1.613
   82    HA   CYS  11           HA       CYS  11  -5.375   2.686  -0.785
   83    HB2  CYS  11           HB2      CYS  11  -4.197   2.940   1.371
   84    HB3  CYS  11           HB1      CYS  11  -4.914   1.431   1.926
   85    H    LYS  12           HN       LYS  12  -7.281   0.638   1.398
   86    HA   LYS  12           HA       LYS  12  -6.878  -1.796   0.026
   87    HB2  LYS  12           HB2      LYS  12  -9.164  -0.823   1.748
   88    HB3  LYS  12           HB1      LYS  12  -9.050  -2.470   1.124
   89    HG2  LYS  12           HG2      LYS  12  -6.867  -2.747   2.232
   90    HG3  LYS  12           HG1      LYS  12  -6.971  -1.099   2.855
   91    HD2  LYS  12           HD2      LYS  12  -9.021  -1.685   4.086
   92    HD3  LYS  12           HD1      LYS  12  -8.934  -3.330   3.458
   93    HE2  LYS  12           HE2      LYS  12  -6.750  -3.643   4.559
   94    HE3  LYS  12           HE1      LYS  12  -6.828  -1.995   5.185
   95    HZ1  LYS  12           HZ1      LYS  12  -9.184  -3.532   5.748
   96    HZ2  LYS  12           HZ2      LYS  12  -8.219  -2.603   6.794
   97    HZ3  LYS  12           HZ3      LYS  12  -7.785  -4.206   6.432
   98    H    LYS  13           HN       LYS  13  -9.227   0.807  -0.375
   99    HA   LYS  13           HA       LYS  13 -10.902  -0.452  -2.256
  100    HB2  LYS  13           HB2      LYS  13 -11.447   1.682  -1.109
  101    HB3  LYS  13           HB1      LYS  13 -10.225   2.491  -2.088
  102    HG2  LYS  13           HG2      LYS  13 -11.417   1.868  -4.140
  103    HG3  LYS  13           HG1      LYS  13 -12.625   1.004  -3.189
  104    HD2  LYS  13           HD2      LYS  13 -13.250   3.105  -2.063
  105    HD3  LYS  13           HD1      LYS  13 -12.033   3.973  -2.998
  106    HE2  LYS  13           HE2      LYS  13 -14.234   4.255  -4.037
  107    HE3  LYS  13           HE1      LYS  13 -13.193   3.299  -5.092
  108    HZ1  LYS  13           HZ1      LYS  13 -14.262   1.327  -4.462
  109    HZ2  LYS  13           HZ2      LYS  13 -15.519   2.440  -4.725
  110    HZ3  LYS  13           HZ3      LYS  13 -15.038   2.055  -3.141
  111    H    LEU  14           HN       LEU  14  -7.872   1.348  -2.660
  112    HA   LEU  14           HA       LEU  14  -7.893   1.569  -5.473
  113    HB2  LEU  14           HB2      LEU  14  -5.618   1.328  -3.493
  114    HB3  LEU  14           HB1      LEU  14  -5.376   1.702  -5.191
  115    HG   LEU  14           HG       LEU  14  -7.182   3.345  -3.388
  116   HD11  LEU  14          HD11      LEU  14  -5.437   4.739  -2.779
  117   HD12  LEU  14          HD12      LEU  14  -4.480   4.367  -4.213
  118   HD13  LEU  14          HD13      LEU  14  -4.537   3.231  -2.874
  119   HD21  LEU  14          HD21      LEU  14  -6.535   5.063  -5.255
  120   HD22  LEU  14          HD22      LEU  14  -7.733   3.833  -5.630
  121   HD23  LEU  14          HD23      LEU  14  -6.066   3.638  -6.179
  122    H    LEU  15           HN       LEU  15  -6.566  -0.958  -3.341
  123    HA   LEU  15           HA       LEU  15  -5.588  -2.578  -5.489
  124    HB2  LEU  15           HB2      LEU  15  -6.065  -3.043  -2.559
  125    HB3  LEU  15           HB1      LEU  15  -5.671  -4.399  -3.617
  126    HG   LEU  15           HG       LEU  15  -3.609  -3.305  -4.331
  127   HD11  LEU  15          HD11      LEU  15  -2.949  -1.157  -3.134
  128   HD12  LEU  15          HD12      LEU  15  -4.626  -1.036  -2.619
  129   HD13  LEU  15          HD13      LEU  15  -4.231  -0.988  -4.329
  130   HD21  LEU  15          HD21      LEU  15  -2.482  -3.079  -2.043
  131   HD22  LEU  15          HD22      LEU  15  -3.310  -4.607  -2.354
  132   HD23  LEU  15          HD23      LEU  15  -4.075  -3.380  -1.344
  133    H    ASP  16           HN       ASP  16  -8.627  -2.446  -3.727
  134    HA   ASP  16           HA       ASP  16  -9.769  -4.842  -4.659
  135    HB2  ASP  16           HB2      ASP  16 -10.994  -2.222  -3.789
  136    HB3  ASP  16           HB1      ASP  16 -11.955  -3.644  -4.188
  137    H    ASP  17           HN       ASP  17  -9.657  -1.602  -6.060
  138    HA   ASP  17           HA       ASP  17 -11.462  -2.099  -8.195
  139    HB2  ASP  17           HB2      ASP  17  -9.261  -0.069  -7.821
  140    HB3  ASP  17           HB1      ASP  17 -10.296  -0.106  -9.247
  141    H    SER  18           HN       SER  18  -8.377  -3.289  -7.577
  142    HA   SER  18           HA       SER  18  -7.195  -3.364 -10.112
  143    HB2  SER  18           HB2      SER  18  -5.792  -5.114  -9.229
  144    HB3  SER  18           HB1      SER  18  -6.093  -3.951  -7.946
  145    HG   SER  18           HG       SER  18  -7.401  -6.427  -8.377
  146    H    SER  19           HN       SER  19  -9.860  -5.049  -8.853
  147    HA   SER  19           HA       SER  19  -9.721  -7.275 -10.693
  148    HB2  SER  19           HB2      SER  19 -11.924  -6.327  -8.855
  149    HB3  SER  19           HB1      SER  19 -11.994  -7.805  -9.811
  150    HG   SER  19           HG       SER  19 -10.889  -7.443  -7.442
  151    H    SER  20           HN       SER  20 -10.757  -4.088 -10.819
  152    HA   SER  20           HA       SER  20 -12.807  -4.439 -12.835
  153    HB2  SER  20           HB2      SER  20 -11.409  -1.901 -11.966
  154    HB3  SER  20           HB1      SER  20 -12.897  -2.015 -12.900
  155    HG   SER  20           HG       SER  20 -13.777  -3.166 -11.071
  156    H1   LYS   1           HN       LYS   1 -12.651  -3.771 -15.011
  157    HA   LYS   1           HA       LYS   1 -10.125  -4.361 -16.238
  158    HB2  LYS   1           HB2      LYS   1 -12.751  -3.380 -17.377
  159    HB3  LYS   1           HB1      LYS   1 -11.346  -3.794 -18.360
  160    HG2  LYS   1           HG2      LYS   1 -11.361  -6.078 -17.418
  161    HG3  LYS   1           HG1      LYS   1 -12.779  -5.666 -16.453
  162    HD2  LYS   1           HD2      LYS   1 -14.065  -5.216 -18.494
  163    HD3  LYS   1           HD1      LYS   1 -12.648  -5.573 -19.481
  164    HE2  LYS   1           HE2      LYS   1 -14.100  -7.540 -19.398
  165    HE3  LYS   1           HE1      LYS   1 -12.602  -7.874 -18.532
  166    HZ1  LYS   1           HZ1      LYS   1 -13.660  -7.555 -16.469
  167    HZ2  LYS   1           HZ2      LYS   1 -14.705  -8.543 -17.373
  168    HZ3  LYS   1           HZ3      LYS   1 -15.048  -6.891 -17.183
  169    H    ASN   2           HN       ASN   2 -10.830  -1.810 -14.546
  170    HA   ASN   2           HA       ASN   2 -10.429   0.415 -16.235
  171    HB2  ASN   2           HB2      ASN   2  -9.934   1.622 -14.121
  172    HB3  ASN   2           HB1      ASN   2 -11.393   0.646 -14.011
  173   HD21  ASN   2          HD21      ASN   2  -9.843   1.435 -11.697
  174   HD22  ASN   2          HD22      ASN   2  -9.200   0.024 -11.006
  175    HA   PRO   3           HA       PRO   3  -6.070   0.233 -17.037
  176    HB2  PRO   3           HB2      PRO   3  -5.446   2.917 -17.202
  177    HB3  PRO   3           HB1      PRO   3  -6.302   2.027 -18.478
  178    HG2  PRO   3           HG2      PRO   3  -7.416   3.780 -16.326
  179    HG3  PRO   3           HG1      PRO   3  -7.846   3.700 -18.046
  180    HD2  PRO   3           HD2      PRO   3  -9.367   2.505 -16.161
  181    HD3  PRO   3           HD1      PRO   3  -9.153   1.785 -17.771
  182    H    GLU   4           HN       GLU   4  -7.313   1.887 -14.267
  183    HA   GLU   4           HA       GLU   4  -4.902   2.646 -12.996
  184    HB2  GLU   4           HB2      GLU   4  -7.594   1.898 -11.825
  185    HB3  GLU   4           HB1      GLU   4  -6.281   2.651 -10.918
  186    HG2  GLU   4           HG2      GLU   4  -7.535   3.843 -13.407
  187    HG3  GLU   4           HG1      GLU   4  -7.973   4.298 -11.763
  188    H    ALA   5           HN       ALA   5  -6.323  -0.415 -13.550
  189    HA   ALA   5           HA       ALA   5  -5.459  -1.897 -11.336
  190    HB1  ALA   5           HB1      ALA   5  -6.980  -2.656 -13.230
  191    HB2  ALA   5           HB2      ALA   5  -5.777  -3.833 -12.697
  192    HB3  ALA   5           HB3      ALA   5  -5.517  -2.915 -14.180
  193    H    GLU   6           HN       GLU   6  -3.748  -0.766 -14.183
  194    HA   GLU   6           HA       GLU   6  -1.436  -2.369 -13.963
  195    HB2  GLU   6           HB2      GLU   6  -1.841   0.411 -15.086
  196    HB3  GLU   6           HB1      GLU   6  -0.335  -0.497 -15.238
  197    HG2  GLU   6           HG2      GLU   6  -1.512  -2.305 -16.399
  198    HG3  GLU   6           HG1      GLU   6  -3.045  -1.457 -16.202
  199    H    GLU   7           HN       GLU   7  -2.371   0.679 -12.424
  200    HA   GLU   7           HA       GLU   7   0.132   1.318 -11.287
  201    HB2  GLU   7           HB2      GLU   7  -1.812   2.885 -11.409
  202    HB3  GLU   7           HB1      GLU   7  -2.618   1.927 -10.167
  203    HG2  GLU   7           HG2      GLU   7  -1.520   3.822  -9.107
  204    HG3  GLU   7           HG1      GLU   7  -0.675   2.348  -8.642
  205    H    ILE   8           HN       ILE   8  -2.574  -0.659 -10.142
  206    HA   ILE   8           HA       ILE   8  -1.552  -1.203  -7.541
  207    HB   ILE   8           HB       ILE   8  -3.526  -2.617  -9.331
  208   HG12  ILE   8          HG12      ILE   8  -5.114  -1.874  -7.672
  209   HG13  ILE   8          HG11      ILE   8  -3.826  -1.416  -6.566
  210   HG21  ILE   8          HG21      ILE   8  -2.293  -3.585  -6.750
  211   HG22  ILE   8          HG22      ILE   8  -2.648  -4.497  -8.216
  212   HG23  ILE   8          HG23      ILE   8  -3.954  -4.008  -7.144
  213   HD11  ILE   8          HD11      ILE   8  -3.187   0.434  -7.902
  214   HD12  ILE   8          HD12      ILE   8  -4.950   0.476  -7.887
  215   HD13  ILE   8          HD13      ILE   8  -4.099  -0.163  -9.286
  216    H    THR   9           HN       THR   9  -1.075  -2.804 -10.660
  217    HA   THR   9           HA       THR   9   0.307  -5.070  -9.732
  218    HB   THR   9           HB       THR   9   0.644  -3.543 -12.327
  219    HG1  THR   9           HG1      THR   9  -0.677  -5.842 -12.511
  220   HG21  THR   9          HG21      THR   9   1.486  -6.319 -11.463
  221   HG22  THR   9          HG22      THR   9   2.524  -5.015 -12.040
  222   HG23  THR   9          HG23      THR   9   1.407  -5.811 -13.149
  223    H    ARG  10           HN       ARG  10   1.451  -1.830 -10.628
  224    HA   ARG  10           HA       ARG  10   4.216  -2.329 -10.310
  225    HB2  ARG  10           HB2      ARG  10   3.230  -0.302 -11.411
  226    HB3  ARG  10           HB1      ARG  10   2.767   0.282  -9.811
  227    HG2  ARG  10           HG2      ARG  10   5.158   0.157  -9.109
  228    HG3  ARG  10           HG1      ARG  10   5.587  -0.320 -10.752
  229    HD2  ARG  10           HD2      ARG  10   5.946   2.052 -10.588
  230    HD3  ARG  10           HD1      ARG  10   4.500   1.807 -11.562
  231    HE   ARG  10           HE       ARG  10   3.228   2.768  -9.848
  232   HH11  ARG  10          HH11      ARG  10   3.053   3.912  -7.889
  233   HH12  ARG  10          HH12      ARG  10   4.404   3.978  -6.807
  234   HH21  ARG  10          HH21      ARG  10   6.460   2.061  -8.839
  235   HH22  ARG  10          HH22      ARG  10   6.335   2.930  -7.346
  236    H    CYS  11           HN       CYS  11   1.685  -1.298  -8.052
  237    HA   CYS  11           HA       CYS  11   3.252  -0.698  -5.828
  238    HB2  CYS  11           HB2      CYS  11   0.813  -0.305  -5.953
  239    HB3  CYS  11           HB1      CYS  11   0.543  -2.041  -5.840
  240    H    LYS  12           HN       LYS  12   1.988  -3.833  -6.916
  241    HA   LYS  12           HA       LYS  12   2.902  -5.353  -4.722
  242    HB2  LYS  12           HB2      LYS  12   2.406  -6.101  -7.608
  243    HB3  LYS  12           HB1      LYS  12   2.814  -7.275  -6.356
  244    HG2  LYS  12           HG2      LYS  12   0.854  -6.566  -5.041
  245    HG3  LYS  12           HG1      LYS  12   0.444  -5.386  -6.286
  246    HD2  LYS  12           HD2      LYS  12   0.188  -7.199  -7.932
  247    HD3  LYS  12           HD1      LYS  12   0.609  -8.386  -6.698
  248    HE2  LYS  12           HE2      LYS  12  -1.346  -7.700  -5.362
  249    HE3  LYS  12           HE1      LYS  12  -1.769  -6.507  -6.590
  250    HZ1  LYS  12           HZ1      LYS  12  -1.354  -9.142  -7.653
  251    HZ2  LYS  12           HZ2      LYS  12  -2.644  -8.064  -7.896
  252    HZ3  LYS  12           HZ3      LYS  12  -2.625  -9.076  -6.532
  253    H    LYS  13           HN       LYS  13   4.440  -4.368  -7.742
  254    HA   LYS  13           HA       LYS  13   6.783  -5.915  -7.521
  255    HB2  LYS  13           HB2      LYS  13   6.116  -4.670  -9.565
  256    HB3  LYS  13           HB1      LYS  13   6.514  -3.162  -8.746
  257    HG2  LYS  13           HG2      LYS  13   8.838  -3.894  -8.467
  258    HG3  LYS  13           HG1      LYS  13   8.457  -5.436  -9.232
  259    HD2  LYS  13           HD2      LYS  13   7.839  -4.261 -11.309
  260    HD3  LYS  13           HD1      LYS  13   8.204  -2.713 -10.545
  261    HE2  LYS  13           HE2      LYS  13  10.109  -3.439 -11.906
  262    HE3  LYS  13           HE1      LYS  13  10.548  -3.459 -10.198
  263    HZ1  LYS  13           HZ1      LYS  13  10.323  -5.779 -10.105
  264    HZ2  LYS  13           HZ2      LYS  13  11.180  -5.478 -11.540
  265    HZ3  LYS  13           HZ3      LYS  13   9.526  -5.857 -11.600
  266    H    LEU  14           HN       LEU  14   5.939  -2.746  -6.167
  267    HA   LEU  14           HA       LEU  14   8.490  -2.016  -5.208
  268    HB2  LEU  14           HB2      LEU  14   5.709  -1.403  -4.184
  269    HB3  LEU  14           HB1      LEU  14   7.155  -0.628  -3.558
  270    HG   LEU  14           HG       LEU  14   6.408  -0.590  -6.500
  271   HD11  LEU  14          HD11      LEU  14   5.212   1.379  -6.245
  272   HD12  LEU  14          HD12      LEU  14   6.056   1.840  -4.767
  273   HD13  LEU  14          HD13      LEU  14   4.798   0.614  -4.715
  274   HD21  LEU  14          HD21      LEU  14   7.922   1.538  -6.271
  275   HD22  LEU  14          HD22      LEU  14   8.694  -0.040  -6.318
  276   HD23  LEU  14          HD23      LEU  14   8.470   0.787  -4.775
  277    H    LEU  15           HN       LEU  15   5.843  -3.819  -3.649
  278    HA   LEU  15           HA       LEU  15   7.252  -4.207  -1.187
  279    HB2  LEU  15           HB2      LEU  15   4.795  -5.427  -2.416
  280    HB3  LEU  15           HB1      LEU  15   5.491  -6.124  -0.951
  281    HG   LEU  15           HG       LEU  15   5.304  -3.988   0.213
  282   HD11  LEU  15          HD11      LEU  15   4.077  -2.105  -0.988
  283   HD12  LEU  15          HD12      LEU  15   4.360  -2.995  -2.478
  284   HD13  LEU  15          HD13      LEU  15   5.723  -2.407  -1.539
  285   HD21  LEU  15          HD21      LEU  15   2.778  -3.657   0.019
  286   HD22  LEU  15          HD22      LEU  15   3.314  -5.301   0.379
  287   HD23  LEU  15          HD23      LEU  15   2.814  -4.876  -1.258
  288    H    ASP  16           HN       ASP  16   6.989  -6.064  -4.161
  289    HA   ASP  16           HA       ASP  16   8.174  -8.458  -3.277
  290    HB2  ASP  16           HB2      ASP  16   8.077  -7.131  -5.989
  291    HB3  ASP  16           HB1      ASP  16   8.768  -8.732  -5.729
  292    H    ASP  17           HN       ASP  17   9.586  -5.454  -4.484
  293    HA   ASP  17           HA       ASP  17  12.256  -6.398  -4.690
  294    HB2  ASP  17           HB2      ASP  17  11.094  -3.632  -4.373
  295    HB3  ASP  17           HB1      ASP  17  12.822  -3.928  -4.552
  296    H    SER  18           HN       SER  18  10.294  -5.866  -2.012
  297    HA   SER  18           HA       SER  18  12.060  -4.798  -0.121
  298    HB2  SER  18           HB2      SER  18  10.550  -5.673   1.545
  299    HB3  SER  18           HB1      SER  18   9.598  -5.124   0.172
  300    HG   SER  18           HG       SER  18  10.405  -7.778   0.758
  301    H    SER  19           HN       SER  19  11.977  -7.845  -1.612
  302    HA   SER  19           HA       SER  19  13.430  -9.250   0.455
  303    HB2  SER  19           HB2      SER  19  12.791  -9.988  -2.404
  304    HB3  SER  19           HB1      SER  19  13.596 -11.057  -1.259
  305    HG   SER  19           HG       SER  19  10.996 -10.598  -1.562
  306    H    SER  20           HN       SER  20  14.196  -7.135  -2.033
  307    HA   SER  20           HA       SER  20  16.877  -8.109  -2.538
  308    HB2  SER  20           HB2      SER  20  15.659  -5.440  -3.275
  309    HB3  SER  20           HB1      SER  20  17.129  -6.149  -3.940
  310    HG   SER  20           HG       SER  20  15.755  -7.926  -4.623
  311    H1   LYS   1           HN       LYS   1  18.808  -7.051  -1.926
  312    HA   LYS   1           HA       LYS   1  18.760  -5.965   0.730
  313    HB2  LYS   1           HB2      LYS   1  20.998  -6.317  -1.276
  314    HB3  LYS   1           HB1      LYS   1  21.236  -5.724   0.369
  315    HG2  LYS   1           HG2      LYS   1  20.244  -7.805   1.260
  316    HG3  LYS   1           HG1      LYS   1  20.028  -8.402  -0.386
  317    HD2  LYS   1           HD2      LYS   1  22.454  -8.309  -0.760
  318    HD3  LYS   1           HD1      LYS   1  22.691  -7.664   0.864
  319    HE2  LYS   1           HE2      LYS   1  23.122 -10.070   0.874
  320    HE3  LYS   1           HE1      LYS   1  21.663  -9.728   1.802
  321    HZ1  LYS   1           HZ1      LYS   1  20.305 -10.426   0.027
  322    HZ2  LYS   1           HZ2      LYS   1  21.506 -11.617   0.184
  323    HZ3  LYS   1           HZ3      LYS   1  21.602 -10.469  -1.064
  324    H    ASN   2           HN       ASN   2  17.723  -4.559  -1.880
  325    HA   ASN   2           HA       ASN   2  19.210  -2.181  -2.167
  326    HB2  ASN   2           HB2      ASN   2  17.172  -1.336  -3.311
  327    HB3  ASN   2           HB1      ASN   2  17.642  -2.934  -3.871
  328   HD21  ASN   2          HD21      ASN   2  14.942  -1.918  -4.091
  329   HD22  ASN   2          HD22      ASN   2  13.951  -2.877  -3.099
  330    HA   PRO   3           HA       PRO   3  18.034   0.132   1.431
  331    HB2  PRO   3           HB2      PRO   3  18.085   2.710   0.445
  332    HB3  PRO   3           HB1      PRO   3  19.544   1.774   0.822
  333    HG2  PRO   3           HG2      PRO   3  18.212   2.210  -1.819
  334    HG3  PRO   3           HG1      PRO   3  19.937   2.250  -1.410
  335    HD2  PRO   3           HD2      PRO   3  18.821   0.092  -2.592
  336    HD3  PRO   3           HD1      PRO   3  20.129  -0.076  -1.401
  337    H    GLU   4           HN       GLU   4  16.188   0.299  -1.488
  338    HA   GLU   4           HA       GLU   4  14.047   1.950  -0.650
  339    HB2  GLU   4           HB2      GLU   4  14.112  -0.316  -2.657
  340    HB3  GLU   4           HB1      GLU   4  12.778   0.823  -2.474
  341    HG2  GLU   4           HG2      GLU   4  15.636   1.628  -3.081
  342    HG3  GLU   4           HG1      GLU   4  14.376   1.454  -4.301
  343    H    ALA   5           HN       ALA   5  14.970  -1.215   0.248
  344    HA   ALA   5           HA       ALA   5  12.510  -2.422   0.834
  345    HB1  ALA   5           HB1      ALA   5  14.816  -3.486   0.895
  346    HB2  ALA   5           HB2      ALA   5  13.749  -3.915   2.233
  347    HB3  ALA   5           HB3      ALA   5  15.031  -2.728   2.473
  348    H    GLU   6           HN       GLU   6  14.391  -0.017   2.561
  349    HA   GLU   6           HA       GLU   6  13.086  -0.158   5.058
  350    HB2  GLU   6           HB2      GLU   6  14.449   2.141   3.642
  351    HB3  GLU   6           HB1      GLU   6  13.870   2.222   5.307
  352    HG2  GLU   6           HG2      GLU   6  15.309   0.339   5.928
  353    HG3  GLU   6           HG1      GLU   6  15.855   0.184   4.259
  354    H    GLU   7           HN       GLU   7  12.305   1.558   2.062
  355    HA   GLU   7           HA       GLU   7  10.235   3.185   3.079
  356    HB2  GLU   7           HB2      GLU   7  11.295   3.471   0.833
  357    HB3  GLU   7           HB1      GLU   7  10.466   2.011   0.294
  358    HG2  GLU   7           HG2      GLU   7   9.161   3.947  -0.387
  359    HG3  GLU   7           HG1      GLU   7   8.281   3.092   0.876
  360    H    ILE   8           HN       ILE   8  10.256  -0.103   1.766
  361    HA   ILE   8           HA       ILE   8   7.440  -0.523   1.791
  362    HB   ILE   8           HB       ILE   8   9.815  -2.382   1.846
  363   HG12  ILE   8          HG12      ILE   8   9.059  -2.937  -0.378
  364   HG13  ILE   8          HG11      ILE   8   7.535  -2.096  -0.129
  365   HG21  ILE   8          HG21      ILE   8   6.897  -3.040   2.266
  366   HG22  ILE   8          HG22      ILE   8   8.306  -3.682   3.110
  367   HG23  ILE   8          HG23      ILE   8   7.956  -4.192   1.462
  368   HD11  ILE   8          HD11      ILE   8   8.575   0.033  -0.179
  369   HD12  ILE   8          HD12      ILE   8   9.330  -0.868  -1.493
  370   HD13  ILE   8          HD13      ILE   8  10.177  -0.667   0.035
  371    H    THR   9           HN       THR   9   9.929  -0.982   4.262
  372    HA   THR   9           HA       THR   9   8.347  -2.305   6.173
  373    HB   THR   9           HB       THR   9  10.632  -0.356   6.586
  374    HG1  THR   9           HG1      THR   9  11.210  -2.927   6.976
  375   HG21  THR   9          HG21      THR   9   9.309  -2.377   8.411
  376   HG22  THR   9          HG22      THR   9   9.464  -0.639   8.669
  377   HG23  THR   9          HG23      THR   9  10.892  -1.671   8.733
  378    H    ARG  10           HN       ARG  10   8.864   1.152   5.544
  379    HA   ARG  10           HA       ARG  10   7.346   2.140   7.714
  380    HB2  ARG  10           HB2      ARG  10   8.893   3.511   6.291
  381    HB3  ARG  10           HB1      ARG  10   7.696   3.429   4.996
  382    HG2  ARG  10           HG2      ARG  10   6.015   4.454   6.528
  383    HG3  ARG  10           HG1      ARG  10   7.269   4.612   7.756
  384    HD2  ARG  10           HD2      ARG  10   7.121   6.727   6.622
  385    HD3  ARG  10           HD1      ARG  10   8.610   5.952   6.091
  386    HE   ARG  10           HE       ARG  10   7.688   5.733   3.951
  387   HH11  ARG  10          HH11      ARG  10   6.080   6.203   2.408
  388   HH12  ARG  10          HH12      ARG  10   4.526   6.762   2.930
  389   HH21  ARG  10          HH21      ARG  10   5.330   6.662   6.302
  390   HH22  ARG  10          HH22      ARG  10   4.100   7.022   5.136
  391    H    CYS  11           HN       CYS  11   6.482   1.211   4.402
  392    HA   CYS  11           HA       CYS  11   3.842   2.100   4.338
  393    HB2  CYS  11           HB2      CYS  11   5.033   1.164   2.386
  394    HB3  CYS  11           HB1      CYS  11   4.944  -0.436   3.115
  395    H    LYS  12           HN       LYS  12   5.165  -0.943   5.602
  396    HA   LYS  12           HA       LYS  12   2.697  -2.145   6.258
  397    HB2  LYS  12           HB2      LYS  12   5.457  -2.462   7.447
  398    HB3  LYS  12           HB1      LYS  12   4.078  -3.461   7.913
  399    HG2  LYS  12           HG2      LYS  12   3.791  -4.167   5.569
  400    HG3  LYS  12           HG1      LYS  12   5.166  -3.167   5.097
  401    HD2  LYS  12           HD2      LYS  12   6.638  -4.478   6.572
  402    HD3  LYS  12           HD1      LYS  12   5.268  -5.475   7.061
  403    HE2  LYS  12           HE2      LYS  12   4.959  -6.206   4.726
  404    HE3  LYS  12           HE1      LYS  12   6.325  -5.205   4.231
  405    HZ1  LYS  12           HZ1      LYS  12   6.916  -6.963   6.428
  406    HZ2  LYS  12           HZ2      LYS  12   7.781  -6.691   4.991
  407    HZ3  LYS  12           HZ3      LYS  12   6.483  -7.788   5.011
  408    H    LYS  13           HN       LYS  13   4.807   0.074   8.014
  409    HA   LYS  13           HA       LYS  13   3.492  -0.010  10.502
  410    HB2  LYS  13           HB2      LYS  13   5.698   1.068  10.124
  411    HB3  LYS  13           HB1      LYS  13   4.886   2.363   9.247
  412    HG2  LYS  13           HG2      LYS  13   3.575   2.931  11.241
  413    HG3  LYS  13           HG1      LYS  13   4.333   1.607  12.128
  414    HD2  LYS  13           HD2      LYS  13   6.539   2.662  11.836
  415    HD3  LYS  13           HD1      LYS  13   5.793   3.980  10.933
  416    HE2  LYS  13           HE2      LYS  13   6.140   4.659  13.262
  417    HE3  LYS  13           HE1      LYS  13   4.413   4.537  12.923
  418    HZ1  LYS  13           HZ1      LYS  13   4.284   2.482  14.023
  419    HZ2  LYS  13           HZ2      LYS  13   5.212   3.474  15.044
  420    HZ3  LYS  13           HZ3      LYS  13   5.969   2.299  14.078
  421    H    LEU  14           HN       LEU  14   2.845   1.894   7.580
  422    HA   LEU  14           HA       LEU  14   0.924   3.659   8.654
  423    HB2  LEU  14           HB2      LEU  14   1.250   2.491   5.882
  424    HB3  LEU  14           HB1      LEU  14   0.111   3.772   6.256
  425    HG   LEU  14           HG       LEU  14   3.081   3.988   6.843
  426   HD11  LEU  14          HD11      LEU  14   3.497   4.925   4.766
  427   HD12  LEU  14          HD12      LEU  14   1.834   5.467   4.543
  428   HD13  LEU  14          HD13      LEU  14   2.250   3.779   4.293
  429   HD21  LEU  14          HD21      LEU  14   2.356   6.498   6.662
  430   HD22  LEU  14          HD22      LEU  14   1.959   5.616   8.130
  431   HD23  LEU  14          HD23      LEU  14   0.724   5.875   6.894
  432    H    LEU  15           HN       LEU  15   0.557   0.462   7.124
  433    HA   LEU  15           HA       LEU  15  -2.291   0.401   7.402
  434    HB2  LEU  15           HB2      LEU  15  -0.200  -1.663   6.774
  435    HB3  LEU  15           HB1      LEU  15  -1.861  -2.159   7.100
  436    HG   LEU  15           HG       LEU  15  -2.692  -0.717   5.314
  437   HD11  LEU  15          HD11      LEU  15  -0.963   0.413   3.825
  438   HD12  LEU  15          HD12      LEU  15   0.203   0.112   5.106
  439   HD13  LEU  15          HD13      LEU  15  -1.185   1.145   5.411
  440   HD21  LEU  15          HD21      LEU  15  -1.402  -1.754   3.359
  441   HD22  LEU  15          HD22      LEU  15  -2.085  -2.888   4.529
  442   HD23  LEU  15          HD23      LEU  15  -0.365  -2.502   4.576
  443    H    ASP  16           HN       ASP  16   0.376  -0.682   9.420
  444    HA   ASP  16           HA       ASP  16  -1.084  -2.208  11.278
  445    HB2  ASP  16           HB2      ASP  16   1.474  -0.621  11.529
  446    HB3  ASP  16           HB1      ASP  16   0.842  -1.631  12.827
  447    H    ASP  17           HN       ASP  17  -0.428   1.258  11.097
  448    HA   ASP  17           HA       ASP  17  -1.470   1.928  13.652
  449    HB2  ASP  17           HB2      ASP  17  -1.060   3.539  11.135
  450    HB3  ASP  17           HB1      ASP  17  -1.674   4.240  12.630
  451    H    SER  18           HN       SER  18  -2.983   0.805  10.866
  452    HA   SER  18           HA       SER  18  -5.377   2.253  10.803
  453    HB2  SER  18           HB2      SER  18  -6.274   0.403   9.543
  454    HB3  SER  18           HB1      SER  18  -4.590   0.616   9.084
  455    HG   SER  18           HG       SER  18  -5.675  -1.274  10.893
  456    H    SER  19           HN       SER  19  -4.211  -0.017  13.043
  457    HA   SER  19           HA       SER  19  -6.796  -0.800  14.073
  458    HB2  SER  19           HB2      SER  19  -4.001  -1.207  15.144
  459    HB3  SER  19           HB1      SER  19  -5.453  -1.881  15.879
  460    HG   SER  19           HG       SER  19  -4.027  -2.843  13.867
  461    H    SER  20           HN       SER  20  -4.748   1.831  14.422
  462    HA   SER  20           HA       SER  20  -5.508   2.543  17.126
  463    HB2  SER  20           HB2      SER  20  -4.139   4.231  15.020
  464    HB3  SER  20           HB1      SER  20  -4.240   4.581  16.742
  465    HG   SER  20           HG       SER  20  -3.146   2.526  17.048
  466    H2   ZBR 100           HA3      TBS 100  -1.627   1.315  -1.962
  467    H4   ZBR 100           HC3      TBS 100   0.633   1.863   1.697
  468    H6   ZBR 100           HB3      TBS 100   2.606   0.385  -1.871
  469    H7   ZBR 100          HB11      TBS 100   0.885   1.167  -4.128
  470    H7A  ZBR 100          HB12      TBS 100  -0.621   0.290  -3.824
  471    H8   ZBR 100          HA11      TBS 100  -2.110   3.124   0.306
  472    H8A  ZBR 100          HA12      TBS 100  -1.702   2.145   1.719
  473    H9   ZBR 100          HC11      TBS 100   3.466   2.030   0.876
  474    H9A  ZBR 100          HC12      TBS 100   3.778   0.440   0.169
  Start of MODEL    6
    1    H1   LYS   1           HN       LYS   1  -6.797   3.965  16.485
    2    HA   LYS   1           HA       LYS   1  -8.857   4.617  14.525
    3    HB2  LYS   1           HB2      LYS   1  -8.437   5.446  17.404
    4    HB3  LYS   1           HB1      LYS   1  -9.785   5.997  16.409
    5    HG2  LYS   1           HG2      LYS   1 -10.481   3.658  16.048
    6    HG3  LYS   1           HG1      LYS   1  -9.135   3.103  17.043
    7    HD2  LYS   1           HD2      LYS   1 -10.043   4.332  18.976
    8    HD3  LYS   1           HD1      LYS   1 -11.380   4.912  17.982
    9    HE2  LYS   1           HE2      LYS   1 -12.085   2.964  19.305
   10    HE3  LYS   1           HE1      LYS   1 -12.090   2.572  17.585
   11    HZ1  LYS   1           HZ1      LYS   1 -10.479   1.077  17.854
   12    HZ2  LYS   1           HZ2      LYS   1 -10.814   1.165  19.518
   13    HZ3  LYS   1           HZ3      LYS   1  -9.559   2.095  18.850
   14    H    ASN   2           HN       ASN   2  -5.850   5.492  14.657
   15    HA   ASN   2           HA       ASN   2  -5.870   8.277  14.931
   16    HB2  ASN   2           HB2      ASN   2  -3.688   8.239  13.806
   17    HB3  ASN   2           HB1      ASN   2  -3.796   6.966  15.022
   18   HD21  ASN   2          HD21      ASN   2  -5.787   5.961  12.569
   19   HD22  ASN   2          HD22      ASN   2  -4.680   5.035  11.679
   20    HA   PRO   3           HA       PRO   3  -7.663   9.843  11.182
   21    HB2  PRO   3           HB2      PRO   3  -5.223  11.555  10.857
   22    HB3  PRO   3           HB1      PRO   3  -6.931  12.032  10.930
   23    HG2  PRO   3           HG2      PRO   3  -5.313  12.450  12.991
   24    HG3  PRO   3           HG1      PRO   3  -6.996  11.949  13.236
   25    HD2  PRO   3           HD2      PRO   3  -4.485  10.334  13.463
   26    HD3  PRO   3           HD1      PRO   3  -5.970  10.280  14.435
   27    H    GLU   4           HN       GLU   4  -4.341   8.742  11.151
   28    HA   GLU   4           HA       GLU   4  -3.855   8.758   8.377
   29    HB2  GLU   4           HB2      GLU   4  -2.763   6.977  10.570
   30    HB3  GLU   4           HB1      GLU   4  -2.145   7.002   8.919
   31    HG2  GLU   4           HG2      GLU   4  -1.594   9.375   9.122
   32    HG3  GLU   4           HG1      GLU   4  -2.289   9.421  10.741
   33    H    ALA   5           HN       ALA   5  -5.953   6.859  10.276
   34    HA   ALA   5           HA       ALA   5  -5.966   4.406   8.919
   35    HB1  ALA   5           HB1      ALA   5  -7.175   4.863  11.051
   36    HB2  ALA   5           HB2      ALA   5  -8.199   4.099   9.835
   37    HB3  ALA   5           HB3      ALA   5  -8.341   5.829  10.147
   38    H    GLU   6           HN       GLU   6  -7.294   7.524   8.070
   39    HA   GLU   6           HA       GLU   6  -9.132   6.708   6.088
   40    HB2  GLU   6           HB2      GLU   6  -7.522   9.250   6.412
   41    HB3  GLU   6           HB1      GLU   6  -8.764   9.036   5.178
   42    HG2  GLU   6           HG2      GLU   6 -10.447   8.607   6.897
   43    HG3  GLU   6           HG1      GLU   6  -9.219   8.710   8.157
   44    H    GLU   7           HN       GLU   7  -5.653   7.346   5.995
   45    HA   GLU   7           HA       GLU   7  -5.328   7.235   3.194
   46    HB2  GLU   7           HB2      GLU   7  -3.652   7.935   5.104
   47    HB3  GLU   7           HB1      GLU   7  -3.191   6.233   5.066
   48    HG2  GLU   7           HG2      GLU   7  -3.183   8.141   2.709
   49    HG3  GLU   7           HG1      GLU   7  -1.761   7.518   3.545
   50    H    ILE   8           HN       ILE   8  -5.302   4.758   5.707
   51    HA   ILE   8           HA       ILE   8  -4.505   2.579   4.067
   52    HB   ILE   8           HB       ILE   8  -6.021   2.791   6.665
   53   HG12  ILE   8          HG12      ILE   8  -4.023   1.737   7.564
   54   HG13  ILE   8          HG11      ILE   8  -3.402   1.436   5.942
   55   HG21  ILE   8          HG21      ILE   8  -5.749   0.211   6.696
   56   HG22  ILE   8          HG22      ILE   8  -5.613   0.344   4.944
   57   HG23  ILE   8          HG23      ILE   8  -7.079   0.885   5.756
   58   HD11  ILE   8          HD11      ILE   8  -3.025   3.745   5.541
   59   HD12  ILE   8          HD12      ILE   8  -2.450   3.473   7.188
   60   HD13  ILE   8          HD13      ILE   8  -4.022   4.219   6.914
   61    H    THR   9           HN       THR   9  -7.676   3.945   4.829
   62    HA   THR   9           HA       THR   9  -9.262   1.994   3.591
   63    HB   THR   9           HB       THR   9  -9.763   4.970   3.874
   64    HG1  THR   9           HG1      THR   9 -11.022   3.084   5.455
   65   HG21  THR   9          HG21      THR   9 -11.263   4.029   2.211
   66   HG22  THR   9          HG22      THR   9 -12.165   4.271   3.707
   67   HG23  THR   9          HG23      THR   9 -11.619   2.655   3.258
   68    H    ARG  10           HN       ARG  10  -7.705   4.902   2.304
   69    HA   ARG  10           HA       ARG  10  -8.793   4.794  -0.298
   70    HB2  ARG  10           HB2      ARG  10  -7.593   6.760   0.600
   71    HB3  ARG  10           HB1      ARG  10  -6.087   5.841   0.567
   72    HG2  ARG  10           HG2      ARG  10  -6.225   5.598  -1.846
   73    HG3  ARG  10           HG1      ARG  10  -7.815   6.362  -1.869
   74    HD2  ARG  10           HD2      ARG  10  -6.119   7.996  -2.508
   75    HD3  ARG  10           HD1      ARG  10  -6.802   8.434  -0.945
   76    HE   ARG  10           HE       ARG  10  -4.470   6.810  -0.621
   77   HH11  ARG  10          HH11      ARG  10  -2.587   7.857   0.102
   78   HH12  ARG  10          HH12      ARG  10  -2.455   9.579  -0.020
   79   HH21  ARG  10          HH21      ARG  10  -5.590   9.987  -1.443
   80   HH22  ARG  10          HH22      ARG  10  -4.154  10.785  -0.895
   81    H    CYS  11           HN       CYS  11  -5.894   3.336   1.122
   82    HA   CYS  11           HA       CYS  11  -4.882   2.206  -1.269
   83    HB2  CYS  11           HB2      CYS  11  -4.445   1.809   1.648
   84    HB3  CYS  11           HB1      CYS  11  -3.908   0.522   0.571
   85    H    LYS  12           HN       LYS  12  -7.204   1.081   1.125
   86    HA   LYS  12           HA       LYS  12  -7.401  -1.596   0.318
   87    HB2  LYS  12           HB2      LYS  12  -8.423  -0.674   2.385
   88    HB3  LYS  12           HB1      LYS  12  -9.604   0.182   1.394
   89    HG2  LYS  12           HG2      LYS  12 -10.432  -1.941   0.493
   90    HG3  LYS  12           HG1      LYS  12  -9.214  -2.825   1.413
   91    HD2  LYS  12           HD2      LYS  12 -10.191  -1.996   3.517
   92    HD3  LYS  12           HD1      LYS  12 -11.405  -1.099   2.602
   93    HE2  LYS  12           HE2      LYS  12 -12.337  -3.235   3.382
   94    HE3  LYS  12           HE1      LYS  12 -12.221  -3.225   1.622
   95    HZ1  LYS  12           HZ1      LYS  12 -11.392  -5.292   2.642
   96    HZ2  LYS  12           HZ2      LYS  12 -10.184  -4.399   3.436
   97    HZ3  LYS  12           HZ3      LYS  12 -10.204  -4.486   1.739
   98    H    LYS  13           HN       LYS  13  -9.144   1.294  -0.795
   99    HA   LYS  13           HA       LYS  13 -10.837  -0.027  -2.641
  100    HB2  LYS  13           HB2      LYS  13  -9.797   2.808  -2.531
  101    HB3  LYS  13           HB1      LYS  13 -10.985   2.255  -3.713
  102    HG2  LYS  13           HG2      LYS  13 -12.489   1.559  -1.891
  103    HG3  LYS  13           HG1      LYS  13 -11.302   2.095  -0.701
  104    HD2  LYS  13           HD2      LYS  13 -11.457   4.397  -1.594
  105    HD3  LYS  13           HD1      LYS  13 -12.669   3.858  -2.757
  106    HE2  LYS  13           HE2      LYS  13 -12.941   3.675   0.259
  107    HE3  LYS  13           HE1      LYS  13 -13.718   4.887  -0.761
  108    HZ1  LYS  13           HZ1      LYS  13 -14.439   2.148  -0.308
  109    HZ2  LYS  13           HZ2      LYS  13 -14.360   2.539  -1.960
  110    HZ3  LYS  13           HZ3      LYS  13 -15.371   3.425  -0.922
  111    H    LEU  14           HN       LEU  14  -7.596   1.359  -2.931
  112    HA   LEU  14           HA       LEU  14  -7.321   1.047  -5.725
  113    HB2  LEU  14           HB2      LEU  14  -5.301   1.151  -3.484
  114    HB3  LEU  14           HB1      LEU  14  -4.838   1.084  -5.184
  115    HG   LEU  14           HG       LEU  14  -6.715   3.186  -4.062
  116   HD11  LEU  14          HD11      LEU  14  -3.705   3.118  -4.217
  117   HD12  LEU  14          HD12      LEU  14  -4.742   3.743  -2.937
  118   HD13  LEU  14          HD13      LEU  14  -4.549   4.652  -4.431
  119   HD21  LEU  14          HD21      LEU  14  -5.723   4.366  -6.199
  120   HD22  LEU  14          HD22      LEU  14  -7.005   3.175  -6.396
  121   HD23  LEU  14          HD23      LEU  14  -5.327   2.723  -6.702
  122    H    LEU  15           HN       LEU  15  -6.584  -1.102  -3.028
  123    HA   LEU  15           HA       LEU  15  -5.342  -3.138  -4.546
  124    HB2  LEU  15           HB2      LEU  15  -6.822  -3.201  -1.910
  125    HB3  LEU  15           HB1      LEU  15  -5.960  -4.590  -2.576
  126    HG   LEU  15           HG       LEU  15  -4.671  -1.887  -2.112
  127   HD11  LEU  15          HD11      LEU  15  -5.290  -2.684   0.055
  128   HD12  LEU  15          HD12      LEU  15  -3.584  -3.080  -0.147
  129   HD13  LEU  15          HD13      LEU  15  -4.808  -4.334  -0.342
  130   HD21  LEU  15          HD21      LEU  15  -3.265  -2.979  -3.618
  131   HD22  LEU  15          HD22      LEU  15  -3.696  -4.584  -3.030
  132   HD23  LEU  15          HD23      LEU  15  -2.605  -3.561  -2.092
  133    H    ASP  16           HN       ASP  16  -8.702  -2.567  -3.630
  134    HA   ASP  16           HA       ASP  16  -9.768  -4.987  -4.620
  135    HB2  ASP  16           HB2      ASP  16 -10.990  -2.257  -4.205
  136    HB3  ASP  16           HB1      ASP  16 -11.923  -3.653  -4.742
  137    H    ASP  17           HN       ASP  17  -9.106  -1.883  -6.138
  138    HA   ASP  17           HA       ASP  17 -10.406  -2.389  -8.602
  139    HB2  ASP  17           HB2      ASP  17  -8.153  -0.530  -7.838
  140    HB3  ASP  17           HB1      ASP  17  -8.833  -0.589  -9.463
  141    H    SER  18           HN       SER  18  -7.688  -3.811  -7.222
  142    HA   SER  18           HA       SER  18  -5.962  -4.167  -9.379
  143    HB2  SER  18           HB2      SER  18  -5.095  -6.091  -8.149
  144    HB3  SER  18           HB1      SER  18  -5.432  -4.770  -7.032
  145    HG   SER  18           HG       SER  18  -6.752  -7.200  -7.406
  146    H    SER  19           HN       SER  19  -8.920  -5.757  -8.555
  147    HA   SER  19           HA       SER  19  -8.615  -7.801 -10.607
  148    HB2  SER  19           HB2      SER  19 -10.931  -7.130  -8.786
  149    HB3  SER  19           HB1      SER  19 -10.922  -8.467  -9.932
  150    HG   SER  19           HG       SER  19  -8.678  -8.414  -8.406
  151    H    SER  20           HN       SER  20  -9.690  -4.634 -10.420
  152    HA   SER  20           HA       SER  20 -11.642  -4.771 -12.561
  153    HB2  SER  20           HB2      SER  20 -10.326  -2.336 -11.340
  154    HB3  SER  20           HB1      SER  20 -11.755  -2.352 -12.371
  155    HG   SER  20           HG       SER  20 -12.403  -2.298 -10.227
  156    H1   LYS   1           HN       LYS   1 -11.403  -3.874 -14.640
  157    HA   LYS   1           HA       LYS   1  -8.698  -4.112 -15.711
  158    HB2  LYS   1           HB2      LYS   1 -11.388  -3.727 -17.041
  159    HB3  LYS   1           HB1      LYS   1  -9.861  -3.867 -17.913
  160    HG2  LYS   1           HG2      LYS   1  -9.476  -6.082 -16.906
  161    HG3  LYS   1           HG1      LYS   1 -10.996  -5.948 -16.021
  162    HD2  LYS   1           HD2      LYS   1 -12.236  -5.816 -18.141
  163    HD3  LYS   1           HD1      LYS   1 -10.722  -5.913 -19.041
  164    HE2  LYS   1           HE2      LYS   1 -11.791  -8.123 -18.935
  165    HE3  LYS   1           HE1      LYS   1 -10.276  -8.133 -18.031
  166    HZ1  LYS   1           HZ1      LYS   1 -11.343  -8.506 -16.129
  167    HZ2  LYS   1           HZ2      LYS   1 -12.698  -8.902 -17.075
  168    HZ3  LYS   1           HZ3      LYS   1 -12.527  -7.333 -16.445
  169    H    ASN   2           HN       ASN   2 -10.043  -1.765 -14.116
  170    HA   ASN   2           HA       ASN   2 -10.040   0.439 -15.840
  171    HB2  ASN   2           HB2      ASN   2  -9.973   1.820 -13.816
  172    HB3  ASN   2           HB1      ASN   2 -11.115   0.489 -13.627
  173   HD21  ASN   2          HD21      ASN   2  -8.160  -0.981 -13.513
  174   HD22  ASN   2          HD22      ASN   2  -7.887  -0.932 -11.839
  175    HA   PRO   3           HA       PRO   3  -5.769   1.412 -16.557
  176    HB2  PRO   3           HB2      PRO   3  -6.370   4.209 -15.654
  177    HB3  PRO   3           HB1      PRO   3  -5.663   3.646 -17.182
  178    HG2  PRO   3           HG2      PRO   3  -8.172   4.496 -17.081
  179    HG3  PRO   3           HG1      PRO   3  -7.717   3.112 -18.091
  180    HD2  PRO   3           HD2      PRO   3  -9.129   3.149 -15.452
  181    HD3  PRO   3           HD1      PRO   3  -9.381   2.106 -16.867
  182    H    GLU   4           HN       GLU   4  -7.239   2.349 -13.522
  183    HA   GLU   4           HA       GLU   4  -4.943   3.139 -12.097
  184    HB2  GLU   4           HB2      GLU   4  -7.521   1.869 -11.142
  185    HB3  GLU   4           HB1      GLU   4  -6.297   2.550 -10.071
  186    HG2  GLU   4           HG2      GLU   4  -6.540   4.741 -11.139
  187    HG3  GLU   4           HG1      GLU   4  -7.714   4.077 -12.274
  188    H    ALA   5           HN       ALA   5  -5.921   0.086 -13.258
  189    HA   ALA   5           HA       ALA   5  -4.885  -1.669 -11.332
  190    HB1  ALA   5           HB1      ALA   5  -6.263  -2.357 -13.292
  191    HB2  ALA   5           HB2      ALA   5  -4.791  -3.315 -13.122
  192    HB3  ALA   5           HB3      ALA   5  -4.879  -2.041 -14.338
  193    H    GLU   6           HN       GLU   6  -3.311   0.305 -13.746
  194    HA   GLU   6           HA       GLU   6  -0.806  -0.997 -13.830
  195    HB2  GLU   6           HB2      GLU   6  -1.583   1.896 -14.257
  196    HB3  GLU   6           HB1      GLU   6   0.042   1.273 -14.544
  197    HG2  GLU   6           HG2      GLU   6  -0.827  -0.328 -16.177
  198    HG3  GLU   6           HG1      GLU   6  -2.475   0.206 -15.853
  199    H    GLU   7           HN       GLU   7  -2.157   1.442 -11.654
  200    HA   GLU   7           HA       GLU   7   0.221   2.056 -10.262
  201    HB2  GLU   7           HB2      GLU   7  -2.159   3.190 -10.207
  202    HB3  GLU   7           HB1      GLU   7  -2.457   2.066  -8.880
  203    HG2  GLU   7           HG2      GLU   7  -0.187   4.071  -9.058
  204    HG3  GLU   7           HG1      GLU   7  -1.590   4.181  -7.996
  205    H    ILE   8           HN       ILE   8  -2.251  -0.420  -9.808
  206    HA   ILE   8           HA       ILE   8  -1.285  -1.452  -7.342
  207    HB   ILE   8           HB       ILE   8  -2.971  -2.594  -9.566
  208   HG12  ILE   8          HG12      ILE   8  -4.711  -2.525  -7.868
  209   HG13  ILE   8          HG11      ILE   8  -3.533  -2.126  -6.620
  210   HG21  ILE   8          HG21      ILE   8  -3.323  -4.555  -7.914
  211   HG22  ILE   8          HG22      ILE   8  -1.799  -4.045  -7.191
  212   HG23  ILE   8          HG23      ILE   8  -1.845  -4.557  -8.875
  213   HD11  ILE   8          HD11      ILE   8  -3.153   0.037  -7.518
  214   HD12  ILE   8          HD12      ILE   8  -4.903  -0.177  -7.590
  215   HD13  ILE   8          HD13      ILE   8  -3.928  -0.380  -9.043
  216    H    THR   9           HN       THR   9  -0.520  -2.219 -10.706
  217    HA   THR   9           HA       THR   9   1.114  -4.449 -10.249
  218    HB   THR   9           HB       THR   9   1.311  -2.358 -12.433
  219    HG1  THR   9           HG1      THR   9   0.249  -4.866 -12.882
  220   HG21  THR   9          HG21      THR   9   3.358  -3.644 -12.346
  221   HG22  THR   9          HG22      THR   9   2.392  -4.252 -13.690
  222   HG23  THR   9          HG23      THR   9   2.456  -5.149 -12.173
  223    H    ARG  10           HN       ARG  10   1.846  -0.988 -10.301
  224    HA   ARG  10           HA       ARG  10   4.647  -1.185 -10.020
  225    HB2  ARG  10           HB2      ARG  10   3.477   0.907 -10.631
  226    HB3  ARG  10           HB1      ARG  10   2.805   0.992  -9.002
  227    HG2  ARG  10           HG2      ARG  10   5.029   1.167  -8.037
  228    HG3  ARG  10           HG1      ARG  10   5.773   0.926  -9.618
  229    HD2  ARG  10           HD2      ARG  10   5.762   3.305  -9.086
  230    HD3  ARG  10           HD1      ARG  10   4.661   2.998 -10.426
  231    HE   ARG  10           HE       ARG  10   3.278   2.891  -7.923
  232   HH11  ARG  10          HH11      ARG  10   1.918   4.641  -7.429
  233   HH12  ARG  10          HH12      ARG  10   2.097   6.141  -8.276
  234   HH21  ARG  10          HH21      ARG  10   4.718   5.020 -10.250
  235   HH22  ARG  10          HH22      ARG  10   3.682   6.356  -9.873
  236    H    CYS  11           HN       CYS  11   2.027  -1.054  -7.638
  237    HA   CYS  11           HA       CYS  11   3.677  -0.972  -5.335
  238    HB2  CYS  11           HB2      CYS  11   0.820  -1.595  -5.910
  239    HB3  CYS  11           HB1      CYS  11   1.470  -2.122  -4.358
  240    H    LYS  12           HN       LYS  12   2.402  -3.608  -7.285
  241    HA   LYS  12           HA       LYS  12   2.988  -5.741  -5.563
  242    HB2  LYS  12           HB2      LYS  12   1.629  -5.941  -7.632
  243    HB3  LYS  12           HB1      LYS  12   3.093  -5.717  -8.589
  244    HG2  LYS  12           HG2      LYS  12   4.080  -7.734  -7.599
  245    HG3  LYS  12           HG1      LYS  12   2.655  -7.947  -6.582
  246    HD2  LYS  12           HD2      LYS  12   1.249  -8.210  -8.581
  247    HD3  LYS  12           HD1      LYS  12   2.659  -7.967  -9.613
  248    HE2  LYS  12           HE2      LYS  12   2.191 -10.366  -9.366
  249    HE3  LYS  12           HE1      LYS  12   3.728  -9.961  -8.603
  250    HZ1  LYS  12           HZ1      LYS  12   2.300 -11.391  -7.220
  251    HZ2  LYS  12           HZ2      LYS  12   1.138 -10.153  -7.166
  252    HZ3  LYS  12           HZ3      LYS  12   2.670  -9.915  -6.472
  253    H    LYS  13           HN       LYS  13   4.967  -4.146  -8.044
  254    HA   LYS  13           HA       LYS  13   7.240  -5.813  -7.785
  255    HB2  LYS  13           HB2      LYS  13   6.935  -2.953  -8.708
  256    HB3  LYS  13           HB1      LYS  13   8.458  -3.840  -8.784
  257    HG2  LYS  13           HG2      LYS  13   7.387  -5.572 -10.174
  258    HG3  LYS  13           HG1      LYS  13   5.860  -4.691 -10.098
  259    HD2  LYS  13           HD2      LYS  13   6.937  -2.746 -11.183
  260    HD3  LYS  13           HD1      LYS  13   8.448  -3.650 -11.289
  261    HE2  LYS  13           HE2      LYS  13   5.822  -4.476 -12.562
  262    HE3  LYS  13           HE1      LYS  13   7.187  -3.755 -13.416
  263    HZ1  LYS  13           HZ1      LYS  13   6.817  -6.455 -12.509
  264    HZ2  LYS  13           HZ2      LYS  13   8.321  -5.803 -12.060
  265    HZ3  LYS  13           HZ3      LYS  13   7.863  -5.845 -13.696
  266    H    LEU  14           HN       LEU  14   6.246  -2.846  -6.137
  267    HA   LEU  14           HA       LEU  14   8.626  -2.429  -4.674
  268    HB2  LEU  14           HB2      LEU  14   5.756  -1.652  -4.145
  269    HB3  LEU  14           HB1      LEU  14   7.094  -1.130  -3.121
  270    HG   LEU  14           HG       LEU  14   7.023  -0.671  -6.119
  271   HD11  LEU  14          HD11      LEU  14   5.907   0.969  -3.850
  272   HD12  LEU  14          HD12      LEU  14   5.228   0.667  -5.448
  273   HD13  LEU  14          HD13      LEU  14   6.572   1.787  -5.263
  274   HD21  LEU  14          HD21      LEU  14   8.636   1.237  -5.260
  275   HD22  LEU  14          HD22      LEU  14   9.255  -0.399  -5.455
  276   HD23  LEU  14          HD23      LEU  14   8.815   0.190  -3.852
  277    H    LEU  15           HN       LEU  15   5.707  -4.276  -3.957
  278    HA   LEU  15           HA       LEU  15   6.387  -4.972  -1.303
  279    HB2  LEU  15           HB2      LEU  15   4.630  -6.325  -3.358
  280    HB3  LEU  15           HB1      LEU  15   4.752  -6.857  -1.680
  281    HG   LEU  15           HG       LEU  15   4.013  -4.030  -2.485
  282   HD11  LEU  15          HD11      LEU  15   2.248  -5.388  -3.329
  283   HD12  LEU  15          HD12      LEU  15   1.678  -4.781  -1.774
  284   HD13  LEU  15          HD13      LEU  15   2.276  -6.434  -1.908
  285   HD21  LEU  15          HD21      LEU  15   4.682  -3.886  -0.253
  286   HD22  LEU  15          HD22      LEU  15   4.179  -5.534   0.122
  287   HD23  LEU  15          HD23      LEU  15   2.972  -4.257  -0.053
  288    H    ASP  16           HN       ASP  16   7.028  -6.516  -4.410
  289    HA   ASP  16           HA       ASP  16   8.182  -8.892  -3.411
  290    HB2  ASP  16           HB2      ASP  16   8.539  -7.406  -6.016
  291    HB3  ASP  16           HB1      ASP  16   9.310  -8.956  -5.683
  292    H    ASP  17           HN       ASP  17   9.517  -5.715  -4.118
  293    HA   ASP  17           HA       ASP  17  12.251  -6.383  -3.809
  294    HB2  ASP  17           HB2      ASP  17  10.757  -3.771  -3.538
  295    HB3  ASP  17           HB1      ASP  17  12.508  -3.895  -3.379
  296    H    SER  18           HN       SER  18   9.743  -6.312  -1.571
  297    HA   SER  18           HA       SER  18  10.925  -5.255   0.718
  298    HB2  SER  18           HB2      SER  18   9.300  -6.581   1.967
  299    HB3  SER  18           HB1      SER  18   8.535  -5.902   0.530
  300    HG   SER  18           HG       SER  18   9.217  -8.530   1.143
  301    H    SER  19           HN       SER  19  11.319  -8.323  -0.825
  302    HA   SER  19           HA       SER  19  12.869  -9.446   1.368
  303    HB2  SER  19           HB2      SER  19  12.291 -10.501  -1.402
  304    HB3  SER  19           HB1      SER  19  13.186 -11.378  -0.166
  305    HG   SER  19           HG       SER  19  10.836 -10.359   0.759
  306    H    SER  20           HN       SER  20  13.430  -7.474  -1.277
  307    HA   SER  20           HA       SER  20  16.178  -8.269  -1.764
  308    HB2  SER  20           HB2      SER  20  14.755  -5.765  -2.685
  309    HB3  SER  20           HB1      SER  20  16.258  -6.426  -3.322
  310    HG   SER  20           HG       SER  20  14.630  -7.130  -4.644
  311    H1   LYS   1           HN       LYS   1  18.029  -7.026  -1.290
  312    HA   LYS   1           HA       LYS   1  17.833  -5.534   1.211
  313    HB2  LYS   1           HB2      LYS   1  20.196  -6.453  -0.437
  314    HB3  LYS   1           HB1      LYS   1  20.338  -5.543   1.067
  315    HG2  LYS   1           HG2      LYS   1  19.101  -7.312   2.260
  316    HG3  LYS   1           HG1      LYS   1  18.958  -8.226   0.758
  317    HD2  LYS   1           HD2      LYS   1  21.412  -8.382   0.608
  318    HD3  LYS   1           HD1      LYS   1  21.566  -7.447   2.095
  319    HE2  LYS   1           HE2      LYS   1  21.770  -9.848   2.577
  320    HE3  LYS   1           HE1      LYS   1  20.305  -9.197   3.315
  321    HZ1  LYS   1           HZ1      LYS   1  19.027 -10.475   2.041
  322    HZ2  LYS   1           HZ2      LYS   1  20.434 -11.343   1.647
  323    HZ3  LYS   1           HZ3      LYS   1  19.888 -10.097   0.630
  324    H    ASN   2           HN       ASN   2  17.141  -4.667  -1.728
  325    HA   ASN   2           HA       ASN   2  18.857  -2.545  -2.334
  326    HB2  ASN   2           HB2      ASN   2  17.094  -1.761  -3.850
  327    HB3  ASN   2           HB1      ASN   2  17.314  -3.505  -3.988
  328   HD21  ASN   2          HD21      ASN   2  15.859  -3.095  -1.045
  329   HD22  ASN   2          HD22      ASN   2  14.236  -3.239  -1.516
  330    HA   PRO   3           HA       PRO   3  17.782   0.733   0.462
  331    HB2  PRO   3           HB2      PRO   3  17.447   2.512  -1.929
  332    HB3  PRO   3           HB1      PRO   3  18.487   2.723  -0.506
  333    HG2  PRO   3           HG2      PRO   3  19.512   2.014  -2.849
  334    HG3  PRO   3           HG1      PRO   3  20.130   1.329  -1.334
  335    HD2  PRO   3           HD2      PRO   3  18.342   0.082  -3.386
  336    HD3  PRO   3           HD1      PRO   3  19.644  -0.638  -2.416
  337    H    GLU   4           HN       GLU   4  15.741   0.112  -2.311
  338    HA   GLU   4           HA       GLU   4  13.545   1.756  -1.669
  339    HB2  GLU   4           HB2      GLU   4  13.675  -0.871  -3.171
  340    HB3  GLU   4           HB1      GLU   4  12.244   0.158  -3.095
  341    HG2  GLU   4           HG2      GLU   4  13.492   2.011  -4.106
  342    HG3  GLU   4           HG1      GLU   4  14.955   1.028  -4.137
  343    H    ALA   5           HN       ALA   5  14.764  -1.050  -0.165
  344    HA   ALA   5           HA       ALA   5  12.450  -2.274   0.834
  345    HB1  ALA   5           HB1      ALA   5  14.750  -3.218   1.009
  346    HB2  ALA   5           HB2      ALA   5  13.891  -3.223   2.550
  347    HB3  ALA   5           HB3      ALA   5  15.124  -2.003   2.231
  348    H    GLU   6           HN       GLU   6  14.103   0.655   1.777
  349    HA   GLU   6           HA       GLU   6  13.006   0.984   4.359
  350    HB2  GLU   6           HB2      GLU   6  13.944   2.992   2.299
  351    HB3  GLU   6           HB1      GLU   6  13.458   3.435   3.936
  352    HG2  GLU   6           HG2      GLU   6  15.181   1.989   4.880
  353    HG3  GLU   6           HG1      GLU   6  15.627   1.425   3.271
  354    H    GLU   7           HN       GLU   7  11.811   1.820   1.135
  355    HA   GLU   7           HA       GLU   7   9.587   3.355   1.951
  356    HB2  GLU   7           HB2      GLU   7  10.642   2.967  -0.434
  357    HB3  GLU   7           HB1      GLU   7   9.487   1.635  -0.522
  358    HG2  GLU   7           HG2      GLU   7   8.833   4.546   0.027
  359    HG3  GLU   7           HG1      GLU   7   8.481   3.662  -1.457
  360    H    ILE   8           HN       ILE   8  10.043  -0.104   1.418
  361    HA   ILE   8           HA       ILE   8   7.329  -0.882   1.743
  362    HB   ILE   8           HB       ILE   8   9.965  -2.313   2.055
  363   HG12  ILE   8          HG12      ILE   8   9.183  -3.533   0.101
  364   HG13  ILE   8          HG11      ILE   8   7.585  -2.801   0.233
  365   HG21  ILE   8          HG21      ILE   8   8.484  -4.418   2.288
  366   HG22  ILE   8          HG22      ILE   8   7.212  -3.311   2.796
  367   HG23  ILE   8          HG23      ILE   8   8.703  -3.423   3.726
  368   HD11  ILE   8          HD11      ILE   8   8.405  -0.652  -0.372
  369   HD12  ILE   8          HD12      ILE   8   9.177  -1.773  -1.497
  370   HD13  ILE   8          HD13      ILE   8  10.078  -1.144  -0.120
  371    H    THR   9           HN       THR   9   9.972  -0.449   4.050
  372    HA   THR   9           HA       THR   9   8.690  -1.460   6.326
  373    HB   THR   9           HB       THR   9  10.727   0.773   6.120
  374    HG1  THR   9           HG1      THR   9  11.453  -1.722   6.998
  375   HG21  THR   9          HG21      THR   9   9.681   0.835   8.295
  376   HG22  THR   9          HG22      THR   9  11.252   0.056   8.479
  377   HG23  THR   9          HG23      THR   9   9.782  -0.918   8.447
  378    H    ARG  10           HN       ARG  10   8.683   1.773   4.889
  379    HA   ARG  10           HA       ARG  10   7.210   3.083   6.908
  380    HB2  ARG  10           HB2      ARG  10   8.419   4.271   5.105
  381    HB3  ARG  10           HB1      ARG  10   7.249   3.659   3.936
  382    HG2  ARG  10           HG2      ARG  10   5.437   4.829   5.057
  383    HG3  ARG  10           HG1      ARG  10   6.522   5.342   6.350
  384    HD2  ARG  10           HD2      ARG  10   6.220   7.173   4.763
  385    HD3  ARG  10           HD1      ARG  10   7.880   6.588   4.686
  386    HE   ARG  10           HE       ARG  10   6.233   5.253   2.764
  387   HH11  ARG  10          HH11      ARG  10   6.527   5.834   0.588
  388   HH12  ARG  10          HH12      ARG  10   7.326   7.318   0.190
  389   HH21  ARG  10          HH21      ARG  10   7.857   8.227   3.494
  390   HH22  ARG  10          HH22      ARG  10   8.078   8.673   1.835
  391    H    CYS  11           HN       CYS  11   6.203   1.309   4.010
  392    HA   CYS  11           HA       CYS  11   3.427   1.831   4.246
  393    HB2  CYS  11           HB2      CYS  11   5.133  -0.120   2.777
  394    HB3  CYS  11           HB1      CYS  11   3.427  -0.523   2.957
  395    H    LYS  12           HN       LYS  12   5.533  -0.641   5.610
  396    HA   LYS  12           HA       LYS  12   3.572  -2.386   6.594
  397    HB2  LYS  12           HB2      LYS  12   6.000  -2.896   6.540
  398    HB3  LYS  12           HB1      LYS  12   6.255  -1.722   7.831
  399    HG2  LYS  12           HG2      LYS  12   4.800  -3.005   9.327
  400    HG3  LYS  12           HG1      LYS  12   4.460  -4.158   8.036
  401    HD2  LYS  12           HD2      LYS  12   6.843  -4.766   7.939
  402    HD3  LYS  12           HD1      LYS  12   7.198  -3.600   9.215
  403    HE2  LYS  12           HE2      LYS  12   6.993  -5.850  10.170
  404    HE3  LYS  12           HE1      LYS  12   5.671  -4.830  10.738
  405    HZ1  LYS  12           HZ1      LYS  12   4.927  -7.036  10.004
  406    HZ2  LYS  12           HZ2      LYS  12   5.498  -6.702   8.439
  407    HZ3  LYS  12           HZ3      LYS  12   4.226  -5.787   9.096
  408    H    LYS  13           HN       LYS  13   5.082   0.473   8.066
  409    HA   LYS  13           HA       LYS  13   3.746   0.311  10.556
  410    HB2  LYS  13           HB2      LYS  13   4.935   2.647   9.054
  411    HB3  LYS  13           HB1      LYS  13   4.277   2.779  10.685
  412    HG2  LYS  13           HG2      LYS  13   5.847   1.047  11.467
  413    HG3  LYS  13           HG1      LYS  13   6.505   0.904   9.836
  414    HD2  LYS  13           HD2      LYS  13   7.177   3.285   9.907
  415    HD3  LYS  13           HD1      LYS  13   6.551   3.405  11.552
  416    HE2  LYS  13           HE2      LYS  13   8.752   1.519  10.656
  417    HE3  LYS  13           HE1      LYS  13   9.001   3.028  11.535
  418    HZ1  LYS  13           HZ1      LYS  13   8.107   0.470  12.499
  419    HZ2  LYS  13           HZ2      LYS  13   7.138   1.763  13.025
  420    HZ3  LYS  13           HZ3      LYS  13   8.806   1.763  13.345
  421    H    LEU  14           HN       LEU  14   2.916   1.877   7.496
  422    HA   LEU  14           HA       LEU  14   0.614   3.243   8.399
  423    HB2  LEU  14           HB2      LEU  14   1.426   2.206   5.681
  424    HB3  LEU  14           HB1      LEU  14  -0.030   3.166   5.944
  425    HG   LEU  14           HG       LEU  14   2.729   4.079   6.813
  426   HD11  LEU  14          HD11      LEU  14   1.326   4.334   4.161
  427   HD12  LEU  14          HD12      LEU  14   3.033   4.061   4.502
  428   HD13  LEU  14          HD13      LEU  14   2.341   5.663   4.724
  429   HD21  LEU  14          HD21      LEU  14   1.411   6.350   6.516
  430   HD22  LEU  14          HD22      LEU  14   1.181   5.400   7.980
  431   HD23  LEU  14          HD23      LEU  14  -0.015   5.325   6.684
  432    H    LEU  15           HN       LEU  15   1.076   0.003   7.081
  433    HA   LEU  15           HA       LEU  15  -1.658  -0.699   6.933
  434    HB2  LEU  15           HB2      LEU  15   0.840  -2.368   7.254
  435    HB3  LEU  15           HB1      LEU  15  -0.764  -3.059   6.999
  436    HG   LEU  15           HG       LEU  15   0.492  -1.017   5.144
  437   HD11  LEU  15          HD11      LEU  15   1.895  -2.948   5.012
  438   HD12  LEU  15          HD12      LEU  15   0.806  -3.035   3.628
  439   HD13  LEU  15          HD13      LEU  15   0.508  -4.039   5.046
  440   HD21  LEU  15          HD21      LEU  15  -1.796  -0.957   4.679
  441   HD22  LEU  15          HD22      LEU  15  -2.044  -2.646   5.123
  442   HD23  LEU  15          HD23      LEU  15  -1.277  -2.238   3.587
  443    H    ASP  16           HN       ASP  16   0.745  -1.017   9.498
  444    HA   ASP  16           HA       ASP  16  -0.837  -2.510  11.299
  445    HB2  ASP  16           HB2      ASP  16   1.467  -0.605  11.726
  446    HB3  ASP  16           HB1      ASP  16   0.718  -1.515  13.037
  447    H    ASP  17           HN       ASP  17  -0.520   0.948  10.716
  448    HA   ASP  17           HA       ASP  17  -2.019   1.840  12.944
  449    HB2  ASP  17           HB2      ASP  17  -1.430   3.097  10.261
  450    HB3  ASP  17           HB1      ASP  17  -2.330   3.925  11.531
  451    H    SER  18           HN       SER  18  -2.959   0.112  10.210
  452    HA   SER  18           HA       SER  18  -5.449   1.185   9.574
  453    HB2  SER  18           HB2      SER  18  -5.978  -1.025   8.670
  454    HB3  SER  18           HB1      SER  18  -4.313  -0.598   8.280
  455    HG   SER  18           HG       SER  18  -5.322  -2.489  10.066
  456    H    SER  19           HN       SER  19  -4.452  -0.825  12.204
  457    HA   SER  19           HA       SER  19  -7.173  -1.317  13.115
  458    HB2  SER  19           HB2      SER  19  -4.505  -1.964  14.375
  459    HB3  SER  19           HB1      SER  19  -6.064  -2.426  15.048
  460    HG   SER  19           HG       SER  19  -5.887  -3.068  12.427
  461    H    SER  20           HN       SER  20  -4.878   1.103  13.413
  462    HA   SER  20           HA       SER  20  -5.669   2.050  16.039
  463    HB2  SER  20           HB2      SER  20  -4.048   3.488  13.931
  464    HB3  SER  20           HB1      SER  20  -4.167   3.900  15.639
  465    HG   SER  20           HG       SER  20  -2.335   2.694  15.407
  466    H2   ZBR 100           HA3      TBS 100  -1.667   0.900  -1.590
  467    H4   ZBR 100           HC3      TBS 100   1.114   1.126   1.720
  468    H6   ZBR 100           HB3      TBS 100   2.472  -0.236  -2.167
  469    H7   ZBR 100          HB11      TBS 100  -0.782   0.659  -3.787
  470    H7A  ZBR 100          HB12      TBS 100  -0.334  -1.026  -3.538
  471    H8   ZBR 100          HA11      TBS 100  -1.001   2.182   1.866
  472    H8A  ZBR 100          HA12      TBS 100  -1.923   0.706   1.585
  473    H9   ZBR 100          HC11      TBS 100   4.046   0.347  -0.482
  474    H9A  ZBR 100          HC12      TBS 100   3.443  -0.789   0.724
  Start of MODEL    7
    1    H1   LYS   1           HN       LYS   1  -6.551   4.252  16.558
    2    HA   LYS   1           HA       LYS   1  -8.708   4.666  14.619
    3    HB2  LYS   1           HB2      LYS   1  -8.345   5.597  17.461
    4    HB3  LYS   1           HB1      LYS   1  -9.767   5.936  16.476
    5    HG2  LYS   1           HG2      LYS   1 -10.103   3.482  16.172
    6    HG3  LYS   1           HG1      LYS   1  -8.745   3.190  17.258
    7    HD2  LYS   1           HD2      LYS   1 -11.154   4.835  18.063
    8    HD3  LYS   1           HD1      LYS   1 -11.059   3.096  18.337
    9    HE2  LYS   1           HE2      LYS   1  -8.858   3.537  19.556
   10    HE3  LYS   1           HE1      LYS   1  -9.263   5.249  19.481
   11    HZ1  LYS   1           HZ1      LYS   1 -10.479   4.959  21.270
   12    HZ2  LYS   1           HZ2      LYS   1 -10.233   3.279  21.242
   13    HZ3  LYS   1           HZ3      LYS   1 -11.526   3.965  20.379
   14    H    ASN   2           HN       ASN   2  -5.797   5.828  14.703
   15    HA   ASN   2           HA       ASN   2  -6.005   8.578  14.976
   16    HB2  ASN   2           HB2      ASN   2  -3.974   8.627  13.423
   17    HB3  ASN   2           HB1      ASN   2  -3.818   7.686  14.906
   18   HD21  ASN   2          HD21      ASN   2  -5.328   6.962  11.696
   19   HD22  ASN   2          HD22      ASN   2  -4.473   5.514  11.479
   20    HA   PRO   3           HA       PRO   3  -8.198  10.091  11.428
   21    HB2  PRO   3           HB2      PRO   3  -5.865  11.912  10.917
   22    HB3  PRO   3           HB1      PRO   3  -7.582  12.313  11.126
   23    HG2  PRO   3           HG2      PRO   3  -5.827  12.788  13.060
   24    HG3  PRO   3           HG1      PRO   3  -7.463  12.210  13.430
   25    HD2  PRO   3           HD2      PRO   3  -4.875  10.711  13.465
   26    HD3  PRO   3           HD1      PRO   3  -6.293  10.575  14.525
   27    H    GLU   4           HN       GLU   4  -4.868   9.098  11.107
   28    HA   GLU   4           HA       GLU   4  -4.607   9.151   8.299
   29    HB2  GLU   4           HB2      GLU   4  -3.285   7.407  10.386
   30    HB3  GLU   4           HB1      GLU   4  -2.824   7.419   8.684
   31    HG2  GLU   4           HG2      GLU   4  -2.308   9.805   8.809
   32    HG3  GLU   4           HG1      GLU   4  -2.843   9.854  10.488
   33    H    ALA   5           HN       ALA   5  -6.600   7.282  10.275
   34    HA   ALA   5           HA       ALA   5  -6.635   4.780   9.032
   35    HB1  ALA   5           HB1      ALA   5  -8.765   4.454  10.047
   36    HB2  ALA   5           HB2      ALA   5  -9.089   6.187  10.088
   37    HB3  ALA   5           HB3      ALA   5  -7.862   5.496  11.148
   38    H    GLU   6           HN       GLU   6  -7.943   7.862   8.022
   39    HA   GLU   6           HA       GLU   6  -9.792   6.958   6.084
   40    HB2  GLU   6           HB2      GLU   6  -8.158   9.493   6.278
   41    HB3  GLU   6           HB1      GLU   6  -9.396   9.229   5.049
   42    HG2  GLU   6           HG2      GLU   6 -11.087   8.894   6.788
   43    HG3  GLU   6           HG1      GLU   6  -9.860   9.075   8.041
   44    H    GLU   7           HN       GLU   7  -6.319   7.638   5.915
   45    HA   GLU   7           HA       GLU   7  -6.041   7.241   3.117
   46    HB2  GLU   7           HB2      GLU   7  -4.049   7.012   5.385
   47    HB3  GLU   7           HB1      GLU   7  -3.610   6.903   3.680
   48    HG2  GLU   7           HG2      GLU   7  -5.068   9.257   4.912
   49    HG3  GLU   7           HG1      GLU   7  -3.326   9.206   4.641
   50    H    ILE   8           HN       ILE   8  -5.925   5.091   5.900
   51    HA   ILE   8           HA       ILE   8  -4.916   2.775   4.577
   52    HB   ILE   8           HB       ILE   8  -6.873   2.863   6.897
   53   HG12  ILE   8          HG12      ILE   8  -5.008   4.326   7.421
   54   HG13  ILE   8          HG11      ILE   8  -4.782   2.818   8.301
   55   HG21  ILE   8          HG21      ILE   8  -6.446   0.640   5.839
   56   HG22  ILE   8          HG22      ILE   8  -5.831   0.729   7.488
   57   HG23  ILE   8          HG23      ILE   8  -4.721   0.869   6.126
   58   HD11  ILE   8          HD11      ILE   8  -2.662   3.264   7.384
   59   HD12  ILE   8          HD12      ILE   8  -3.334   3.807   5.852
   60   HD13  ILE   8          HD13      ILE   8  -3.349   2.091   6.259
   61    H    THR   9           HN       THR   9  -8.216   3.976   5.063
   62    HA   THR   9           HA       THR   9  -9.564   1.780   3.913
   63    HB   THR   9           HB       THR   9 -10.354   4.703   3.988
   64    HG1  THR   9           HG1      THR   9  -9.985   3.110   5.928
   65   HG21  THR   9          HG21      THR   9 -11.694   3.608   2.337
   66   HG22  THR   9          HG22      THR   9 -12.678   3.698   3.797
   67   HG23  THR   9          HG23      THR   9 -11.896   2.181   3.351
   68    H    ARG  10           HN       ARG  10  -8.233   4.749   2.503
   69    HA   ARG  10           HA       ARG  10  -9.194   4.376  -0.127
   70    HB2  ARG  10           HB2      ARG  10  -8.226   6.504   0.725
   71    HB3  ARG  10           HB1      ARG  10  -6.634   5.743   0.736
   72    HG2  ARG  10           HG2      ARG  10  -6.766   5.356  -1.678
   73    HG3  ARG  10           HG1      ARG  10  -8.395   6.034  -1.716
   74    HD2  ARG  10           HD2      ARG  10  -6.877   7.770  -2.417
   75    HD3  ARG  10           HD1      ARG  10  -7.443   8.175  -0.801
   76    HE   ARG  10           HE       ARG  10  -5.289   7.732   0.033
   77   HH11  ARG  10          HH11      ARG  10  -3.056   7.495  -0.292
   78   HH12  ARG  10          HH12      ARG  10  -2.462   7.058  -1.859
   79   HH21  ARG  10          HH21      ARG  10  -5.607   6.914  -3.305
   80   HH22  ARG  10          HH22      ARG  10  -3.906   6.729  -3.563
   81    H    CYS  11           HN       CYS  11  -6.210   3.328   1.482
   82    HA   CYS  11           HA       CYS  11  -4.883   2.244  -0.732
   83    HB2  CYS  11           HB2      CYS  11  -3.951   2.557   1.589
   84    HB3  CYS  11           HB1      CYS  11  -4.838   1.112   2.069
   85    H    LYS  12           HN       LYS  12  -7.322   0.848   1.413
   86    HA   LYS  12           HA       LYS  12  -7.280  -1.780   0.378
   87    HB2  LYS  12           HB2      LYS  12  -8.383  -1.116   2.487
   88    HB3  LYS  12           HB1      LYS  12  -9.629  -0.283   1.560
   89    HG2  LYS  12           HG2      LYS  12 -10.168  -2.437   0.410
   90    HG3  LYS  12           HG1      LYS  12  -8.982  -3.245   1.432
   91    HD2  LYS  12           HD2      LYS  12 -11.278  -1.649   2.573
   92    HD3  LYS  12           HD1      LYS  12 -11.421  -3.368   2.206
   93    HE2  LYS  12           HE2      LYS  12  -9.377  -3.738   3.671
   94    HE3  LYS  12           HE1      LYS  12  -9.524  -2.056   4.172
   95    HZ1  LYS  12           HZ1      LYS  12 -10.867  -4.224   5.203
   96    HZ2  LYS  12           HZ2      LYS  12 -12.027  -3.338   4.334
   97    HZ3  LYS  12           HZ3      LYS  12 -11.121  -2.587   5.561
   98    H    LYS  13           HN       LYS  13  -9.152   1.101  -0.521
   99    HA   LYS  13           HA       LYS  13 -10.792  -0.125  -2.459
  100    HB2  LYS  13           HB2      LYS  13  -9.809   2.713  -2.149
  101    HB3  LYS  13           HB1      LYS  13 -10.948   2.231  -3.408
  102    HG2  LYS  13           HG2      LYS  13 -12.487   1.369  -1.670
  103    HG3  LYS  13           HG1      LYS  13 -11.351   1.880  -0.420
  104    HD2  LYS  13           HD2      LYS  13 -11.566   4.217  -1.160
  105    HD3  LYS  13           HD1      LYS  13 -12.678   3.719  -2.437
  106    HE2  LYS  13           HE2      LYS  13 -14.251   2.864  -0.743
  107    HE3  LYS  13           HE1      LYS  13 -13.143   3.350   0.537
  108    HZ1  LYS  13           HZ1      LYS  13 -13.895   5.386  -1.407
  109    HZ2  LYS  13           HZ2      LYS  13 -13.624   5.526   0.264
  110    HZ3  LYS  13           HZ3      LYS  13 -15.094   4.900  -0.311
  111    H    LEU  14           HN       LEU  14  -7.584   1.357  -2.686
  112    HA   LEU  14           HA       LEU  14  -7.328   1.206  -5.498
  113    HB2  LEU  14           HB2      LEU  14  -5.243   1.150  -3.302
  114    HB3  LEU  14           HB1      LEU  14  -4.873   1.335  -5.015
  115    HG   LEU  14           HG       LEU  14  -6.708   3.182  -3.463
  116   HD11  LEU  14          HD11      LEU  14  -3.747   3.275  -4.015
  117   HD12  LEU  14          HD12      LEU  14  -4.621   3.676  -2.537
  118   HD13  LEU  14          HD13      LEU  14  -4.664   4.775  -3.909
  119   HD21  LEU  14          HD21      LEU  14  -7.310   3.449  -5.705
  120   HD22  LEU  14          HD22      LEU  14  -5.686   3.093  -6.295
  121   HD23  LEU  14          HD23      LEU  14  -6.034   4.653  -5.543
  122    H    LEU  15           HN       LEU  15  -6.456  -1.052  -2.916
  123    HA   LEU  15           HA       LEU  15  -5.248  -2.996  -4.591
  124    HB2  LEU  15           HB2      LEU  15  -6.547  -3.219  -1.869
  125    HB3  LEU  15           HB1      LEU  15  -5.672  -4.535  -2.651
  126    HG   LEU  15           HG       LEU  15  -4.469  -1.798  -2.153
  127   HD11  LEU  15          HD11      LEU  15  -4.939  -2.752   0.010
  128   HD12  LEU  15          HD12      LEU  15  -3.218  -2.979  -0.308
  129   HD13  LEU  15          HD13      LEU  15  -4.335  -4.330  -0.502
  130   HD21  LEU  15          HD21      LEU  15  -3.457  -4.422  -3.246
  131   HD22  LEU  15          HD22      LEU  15  -2.344  -3.388  -2.348
  132   HD23  LEU  15          HD23      LEU  15  -3.131  -2.780  -3.799
  133    H    ASP  16           HN       ASP  16  -8.552  -2.517  -3.474
  134    HA   ASP  16           HA       ASP  16  -9.640  -4.933  -4.442
  135    HB2  ASP  16           HB2      ASP  16 -10.863  -2.224  -3.912
  136    HB3  ASP  16           HB1      ASP  16 -11.814  -3.610  -4.441
  137    H    ASP  17           HN       ASP  17  -9.013  -1.841  -5.972
  138    HA   ASP  17           HA       ASP  17 -10.480  -2.266  -8.349
  139    HB2  ASP  17           HB2      ASP  17  -8.080  -0.535  -7.740
  140    HB3  ASP  17           HB1      ASP  17  -8.901  -0.533  -9.299
  141    H    SER  18           HN       SER  18  -7.778  -3.858  -7.152
  142    HA   SER  18           HA       SER  18  -6.189  -4.267  -9.404
  143    HB2  SER  18           HB2      SER  18  -5.359  -6.250  -8.256
  144    HB3  SER  18           HB1      SER  18  -5.580  -4.951  -7.088
  145    HG   SER  18           HG       SER  18  -6.504  -7.225  -6.728
  146    H    SER  19           HN       SER  19  -9.258  -5.557  -8.564
  147    HA   SER  19           HA       SER  19  -9.153  -7.674 -10.564
  148    HB2  SER  19           HB2      SER  19 -11.372  -8.263  -9.820
  149    HB3  SER  19           HB1      SER  19 -10.372  -7.972  -8.400
  150    HG   SER  19           HG       SER  19 -12.299  -6.863  -8.160
  151    H    SER  20           HN       SER  20  -9.948  -4.407 -10.430
  152    HA   SER  20           HA       SER  20 -11.877  -4.419 -12.595
  153    HB2  SER  20           HB2      SER  20 -12.156  -2.669 -11.009
  154    HB3  SER  20           HB1      SER  20 -10.462  -2.210 -11.115
  155    HG   SER  20           HG       SER  20 -10.810  -1.350 -13.089
  156    H1   LYS   1           HN       LYS   1 -11.535  -3.552 -14.677
  157    HA   LYS   1           HA       LYS   1  -8.812  -3.966 -15.678
  158    HB2  LYS   1           HB2      LYS   1 -11.435  -3.538 -17.094
  159    HB3  LYS   1           HB1      LYS   1  -9.896  -3.810 -17.909
  160    HG2  LYS   1           HG2      LYS   1  -9.661  -5.972 -16.694
  161    HG3  LYS   1           HG1      LYS   1 -11.251  -5.715 -15.977
  162    HD2  LYS   1           HD2      LYS   1 -10.794  -5.747 -18.967
  163    HD3  LYS   1           HD1      LYS   1 -11.209  -7.198 -18.056
  164    HE2  LYS   1           HE2      LYS   1 -13.233  -5.910 -17.178
  165    HE3  LYS   1           HE1      LYS   1 -12.863  -4.681 -18.383
  166    HZ1  LYS   1           HZ1      LYS   1 -13.971  -5.890 -19.824
  167    HZ2  LYS   1           HZ2      LYS   1 -14.146  -7.170 -18.722
  168    HZ3  LYS   1           HZ3      LYS   1 -12.768  -7.081 -19.712
  169    H    ASN   2           HN       ASN   2 -10.096  -1.501 -14.224
  170    HA   ASN   2           HA       ASN   2 -10.043   0.631 -15.991
  171    HB2  ASN   2           HB2      ASN   2  -9.543   2.019 -13.900
  172    HB3  ASN   2           HB1      ASN   2 -11.009   1.041 -13.875
  173   HD21  ASN   2          HD21      ASN   2  -7.528   0.243 -13.278
  174   HD22  ASN   2          HD22      ASN   2  -7.823  -0.481 -11.772
  175    HA   PRO   3           HA       PRO   3  -5.798   1.404 -17.007
  176    HB2  PRO   3           HB2      PRO   3  -6.223   4.233 -16.094
  177    HB3  PRO   3           HB1      PRO   3  -5.633   3.631 -17.657
  178    HG2  PRO   3           HG2      PRO   3  -8.098   4.583 -17.405
  179    HG3  PRO   3           HG1      PRO   3  -7.759   3.184 -18.439
  180    HD2  PRO   3           HD2      PRO   3  -9.035   3.272 -15.734
  181    HD3  PRO   3           HD1      PRO   3  -9.365   2.220 -17.126
  182    H    GLU   4           HN       GLU   4  -7.030   2.366 -13.890
  183    HA   GLU   4           HA       GLU   4  -4.621   3.080 -12.609
  184    HB2  GLU   4           HB2      GLU   4  -7.186   1.916 -11.509
  185    HB3  GLU   4           HB1      GLU   4  -5.860   2.492 -10.501
  186    HG2  GLU   4           HG2      GLU   4  -6.038   4.722 -11.500
  187    HG3  GLU   4           HG1      GLU   4  -7.321   4.159 -12.569
  188    H    ALA   5           HN       ALA   5  -5.647   0.113 -13.837
  189    HA   ALA   5           HA       ALA   5  -4.683  -1.756 -11.995
  190    HB1  ALA   5           HB1      ALA   5  -4.667  -3.321 -13.796
  191    HB2  ALA   5           HB2      ALA   5  -4.477  -2.042 -14.995
  192    HB3  ALA   5           HB3      ALA   5  -5.999  -2.211 -14.122
  193    H    GLU   6           HN       GLU   6  -3.004   0.330 -14.247
  194    HA   GLU   6           HA       GLU   6  -0.516  -1.008 -14.343
  195    HB2  GLU   6           HB2      GLU   6  -1.239   1.915 -14.601
  196    HB3  GLU   6           HB1      GLU   6   0.386   1.289 -14.883
  197    HG2  GLU   6           HG2      GLU   6  -0.462  -0.194 -16.636
  198    HG3  GLU   6           HG1      GLU   6  -2.109   0.354 -16.328
  199    H    GLU   7           HN       GLU   7  -1.834   1.388 -12.089
  200    HA   GLU   7           HA       GLU   7   0.532   1.725 -10.556
  201    HB2  GLU   7           HB2      GLU   7  -2.384   2.144  -9.865
  202    HB3  GLU   7           HB1      GLU   7  -1.052   2.599  -8.804
  203    HG2  GLU   7           HG2      GLU   7  -1.383   3.584 -11.651
  204    HG3  GLU   7           HG1      GLU   7  -1.868   4.494 -10.220
  205    H    ILE   8           HN       ILE   8  -2.164  -0.527 -10.395
  206    HA   ILE   8           HA       ILE   8  -1.569  -1.686  -7.861
  207    HB   ILE   8           HB       ILE   8  -2.788  -3.070 -10.273
  208   HG12  ILE   8          HG12      ILE   8  -3.976  -0.984  -9.923
  209   HG13  ILE   8          HG11      ILE   8  -4.965  -2.285  -9.269
  210   HG21  ILE   8          HG21      ILE   8  -2.166  -4.479  -8.288
  211   HG22  ILE   8          HG22      ILE   8  -3.901  -4.438  -8.593
  212   HG23  ILE   8          HG23      ILE   8  -3.212  -3.465  -7.294
  213   HD11  ILE   8          HD11      ILE   8  -5.028  -0.621  -7.613
  214   HD12  ILE   8          HD12      ILE   8  -3.322  -0.241  -7.790
  215   HD13  ILE   8          HD13      ILE   8  -3.813  -1.747  -7.011
  216    H    THR   9           HN       THR   9  -0.485  -2.479 -11.142
  217    HA   THR   9           HA       THR   9   0.991  -4.792 -10.477
  218    HB   THR   9           HB       THR   9   1.471  -2.770 -12.682
  219    HG1  THR   9           HG1      THR   9  -0.542  -4.284 -12.311
  220   HG21  THR   9          HG21      THR   9   3.455  -4.069 -12.432
  221   HG22  THR   9          HG22      THR   9   2.566  -4.796 -13.770
  222   HG23  THR   9          HG23      THR   9   2.538  -5.551 -12.175
  223    H    ARG  10           HN       ARG  10   1.875  -1.353 -10.561
  224    HA   ARG  10           HA       ARG  10   4.629  -1.661 -10.015
  225    HB2  ARG  10           HB2      ARG  10   3.579   0.454 -10.797
  226    HB3  ARG  10           HB1      ARG  10   2.824   0.633  -9.214
  227    HG2  ARG  10           HG2      ARG  10   5.018   0.706  -8.137
  228    HG3  ARG  10           HG1      ARG  10   5.813   0.435  -9.688
  229    HD2  ARG  10           HD2      ARG  10   5.895   2.801  -9.250
  230    HD3  ARG  10           HD1      ARG  10   4.713   2.539 -10.528
  231    HE   ARG  10           HE       ARG  10   3.003   3.126  -9.026
  232   HH11  ARG  10          HH11      ARG  10   2.312   4.154  -7.123
  233   HH12  ARG  10          HH12      ARG  10   3.437   4.400  -5.829
  234   HH21  ARG  10          HH21      ARG  10   6.090   2.921  -7.496
  235   HH22  ARG  10          HH22      ARG  10   5.574   3.703  -6.041
  236    H    CYS  11           HN       CYS  11   1.815  -1.297  -7.881
  237    HA   CYS  11           HA       CYS  11   3.139  -1.113  -5.422
  238    HB2  CYS  11           HB2      CYS  11   0.653  -0.854  -5.892
  239    HB3  CYS  11           HB1      CYS  11   0.561  -2.613  -5.857
  240    H    LYS  12           HN       LYS  12   2.199  -3.946  -7.322
  241    HA   LYS  12           HA       LYS  12   2.934  -5.920  -5.439
  242    HB2  LYS  12           HB2      LYS  12   1.563  -6.341  -7.452
  243    HB3  LYS  12           HB1      LYS  12   2.992  -6.119  -8.458
  244    HG2  LYS  12           HG2      LYS  12   4.116  -7.975  -7.216
  245    HG3  LYS  12           HG1      LYS  12   2.628  -8.225  -6.304
  246    HD2  LYS  12           HD2      LYS  12   2.692  -8.300  -9.320
  247    HD3  LYS  12           HD1      LYS  12   2.993  -9.738  -8.346
  248    HE2  LYS  12           HE2      LYS  12   0.769  -9.287  -7.196
  249    HE3  LYS  12           HE1      LYS  12   0.472  -8.059  -8.424
  250    HZ1  LYS  12           HZ1      LYS  12  -0.010 -10.751  -8.629
  251    HZ2  LYS  12           HZ2      LYS  12   1.347 -10.471  -9.610
  252    HZ3  LYS  12           HZ3      LYS  12  -0.089  -9.599  -9.871
  253    H    LYS  13           HN       LYS  13   4.749  -4.303  -8.021
  254    HA   LYS  13           HA       LYS  13   7.119  -5.814  -7.792
  255    HB2  LYS  13           HB2      LYS  13   6.609  -2.993  -8.742
  256    HB3  LYS  13           HB1      LYS  13   8.199  -3.753  -8.819
  257    HG2  LYS  13           HG2      LYS  13   7.235  -5.597 -10.169
  258    HG3  LYS  13           HG1      LYS  13   5.662  -4.799 -10.112
  259    HD2  LYS  13           HD2      LYS  13   6.604  -2.830 -11.254
  260    HD3  LYS  13           HD1      LYS  13   8.187  -3.607 -11.294
  261    HE2  LYS  13           HE2      LYS  13   7.280  -5.431 -12.663
  262    HE3  LYS  13           HE1      LYS  13   5.680  -4.695 -12.608
  263    HZ1  LYS  13           HZ1      LYS  13   7.882  -3.012 -13.512
  264    HZ2  LYS  13           HZ2      LYS  13   6.269  -3.075 -14.047
  265    HZ3  LYS  13           HZ3      LYS  13   7.385  -4.245 -14.566
  266    H    LEU  14           HN       LEU  14   6.021  -2.878  -6.145
  267    HA   LEU  14           HA       LEU  14   8.424  -2.341  -4.751
  268    HB2  LEU  14           HB2      LEU  14   5.542  -1.722  -4.055
  269    HB3  LEU  14           HB1      LEU  14   6.936  -1.046  -3.214
  270    HG   LEU  14           HG       LEU  14   6.449  -0.767  -6.194
  271   HD11  LEU  14          HD11      LEU  14   5.683   0.971  -3.853
  272   HD12  LEU  14          HD12      LEU  14   4.740   0.545  -5.280
  273   HD13  LEU  14          HD13      LEU  14   6.054   1.704  -5.410
  274   HD21  LEU  14          HD21      LEU  14   8.746  -0.431  -5.896
  275   HD22  LEU  14          HD22      LEU  14   8.545   0.250  -4.281
  276   HD23  LEU  14          HD23      LEU  14   8.122   1.206  -5.704
  277    H    LEU  15           HN       LEU  15   5.570  -4.254  -3.902
  278    HA   LEU  15           HA       LEU  15   6.413  -4.935  -1.279
  279    HB2  LEU  15           HB2      LEU  15   4.525  -6.313  -3.201
  280    HB3  LEU  15           HB1      LEU  15   4.748  -6.798  -1.519
  281    HG   LEU  15           HG       LEU  15   3.973  -3.989  -2.350
  282   HD11  LEU  15          HD11      LEU  15   2.172  -5.425  -3.047
  283   HD12  LEU  15          HD12      LEU  15   1.683  -4.668  -1.530
  284   HD13  LEU  15          HD13      LEU  15   2.249  -6.339  -1.539
  285   HD21  LEU  15          HD21      LEU  15   4.301  -5.439   0.275
  286   HD22  LEU  15          HD22      LEU  15   3.091  -4.161   0.151
  287   HD23  LEU  15          HD23      LEU  15   4.783  -3.801  -0.165
  288    H    ASP  16           HN       ASP  16   6.882  -6.454  -4.420
  289    HA   ASP  16           HA       ASP  16   8.060  -8.852  -3.516
  290    HB2  ASP  16           HB2      ASP  16   8.298  -7.325  -6.108
  291    HB3  ASP  16           HB1      ASP  16   9.097  -8.873  -5.841
  292    H    ASP  17           HN       ASP  17   9.376  -5.662  -4.142
  293    HA   ASP  17           HA       ASP  17  12.118  -6.330  -4.047
  294    HB2  ASP  17           HB2      ASP  17  10.639  -3.764  -3.452
  295    HB3  ASP  17           HB1      ASP  17  12.397  -3.887  -3.433
  296    H    SER  18           HN       SER  18   9.761  -6.465  -1.651
  297    HA   SER  18           HA       SER  18  11.083  -5.572   0.631
  298    HB2  SER  18           HB2      SER  18   9.550  -6.992   1.881
  299    HB3  SER  18           HB1      SER  18   8.686  -6.243   0.541
  300    HG   SER  18           HG       SER  18   8.652  -8.709   1.003
  301    H    SER  19           HN       SER  19  11.535  -8.415  -1.243
  302    HA   SER  19           HA       SER  19  13.140  -9.757   0.782
  303    HB2  SER  19           HB2      SER  19  13.396 -11.533  -0.841
  304    HB3  SER  19           HB1      SER  19  11.703 -11.042  -0.804
  305    HG   SER  19           HG       SER  19  12.447 -11.183  -2.939
  306    H    SER  20           HN       SER  20  13.599  -7.480  -1.659
  307    HA   SER  20           HA       SER  20  16.374  -8.105  -2.212
  308    HB2  SER  20           HB2      SER  20  15.192  -7.075  -4.005
  309    HB3  SER  20           HB1      SER  20  14.601  -5.787  -2.964
  310    HG   SER  20           HG       SER  20  16.572  -4.884  -2.940
  311    H1   LYS   1           HN       LYS   1  18.170  -6.855  -1.602
  312    HA   LYS   1           HA       LYS   1  17.873  -5.555   1.009
  313    HB2  LYS   1           HB2      LYS   1  20.306  -6.379  -0.563
  314    HB3  LYS   1           HB1      LYS   1  20.356  -5.628   1.031
  315    HG2  LYS   1           HG2      LYS   1  18.970  -7.491   1.928
  316    HG3  LYS   1           HG1      LYS   1  19.020  -8.264   0.345
  317    HD2  LYS   1           HD2      LYS   1  21.522  -7.525   1.876
  318    HD3  LYS   1           HD1      LYS   1  20.743  -9.098   2.042
  319    HE2  LYS   1           HE2      LYS   1  20.919  -9.319  -0.492
  320    HE3  LYS   1           HE1      LYS   1  21.946  -7.889  -0.464
  321    HZ1  LYS   1           HZ1      LYS   1  23.621  -9.215  -0.013
  322    HZ2  LYS   1           HZ2      LYS   1  22.600 -10.558   0.175
  323    HZ3  LYS   1           HZ3      LYS   1  22.921  -9.541   1.497
  324    H    ASN   2           HN       ASN   2  17.332  -4.482  -1.885
  325    HA   ASN   2           HA       ASN   2  19.096  -2.395  -2.344
  326    HB2  ASN   2           HB2      ASN   2  17.138  -1.352  -3.612
  327    HB3  ASN   2           HB1      ASN   2  17.642  -2.964  -4.119
  328   HD21  ASN   2          HD21      ASN   2  15.562  -1.820  -1.388
  329   HD22  ASN   2          HD22      ASN   2  14.255  -2.821  -1.798
  330    HA   PRO   3           HA       PRO   3  18.265   0.737   0.682
  331    HB2  PRO   3           HB2      PRO   3  17.878   2.659  -1.591
  332    HB3  PRO   3           HB1      PRO   3  18.977   2.765  -0.201
  333    HG2  PRO   3           HG2      PRO   3  19.887   2.155  -2.623
  334    HG3  PRO   3           HG1      PRO   3  20.553   1.385  -1.171
  335    HD2  PRO   3           HD2      PRO   3  18.684   0.264  -3.217
  336    HD3  PRO   3           HD1      PRO   3  19.978  -0.523  -2.291
  337    H    GLU   4           HN       GLU   4  16.076   0.297  -1.998
  338    HA   GLU   4           HA       GLU   4  13.952   1.962  -1.177
  339    HB2  GLU   4           HB2      GLU   4  13.962  -0.586  -2.806
  340    HB3  GLU   4           HB1      GLU   4  12.538   0.427  -2.580
  341    HG2  GLU   4           HG2      GLU   4  13.708   2.335  -3.575
  342    HG3  GLU   4           HG1      GLU   4  15.171   1.367  -3.750
  343    H    ALA   5           HN       ALA   5  15.244  -0.800   0.258
  344    HA   ALA   5           HA       ALA   5  13.012  -2.142   1.277
  345    HB1  ALA   5           HB1      ALA   5  14.491  -3.093   2.889
  346    HB2  ALA   5           HB2      ALA   5  15.590  -1.717   2.793
  347    HB3  ALA   5           HB3      ALA   5  15.458  -2.836   1.436
  348    H    GLU   6           HN       GLU   6  14.504   0.883   2.215
  349    HA   GLU   6           HA       GLU   6  13.402   1.152   4.802
  350    HB2  GLU   6           HB2      GLU   6  14.205   3.209   2.737
  351    HB3  GLU   6           HB1      GLU   6  13.707   3.623   4.378
  352    HG2  GLU   6           HG2      GLU   6  15.516   2.248   5.298
  353    HG3  GLU   6           HG1      GLU   6  15.994   1.763   3.672
  354    H    GLU   7           HN       GLU   7  12.152   1.994   1.596
  355    HA   GLU   7           HA       GLU   7   9.793   3.291   2.501
  356    HB2  GLU   7           HB2      GLU   7  10.461   1.926  -0.116
  357    HB3  GLU   7           HB1      GLU   7   8.973   2.830   0.163
  358    HG2  GLU   7           HG2      GLU   7  11.758   3.974   0.516
  359    HG3  GLU   7           HG1      GLU   7  10.770   4.197  -0.928
  360    H    ILE   8           HN       ILE   8  10.593  -0.054   1.757
  361    HA   ILE   8           HA       ILE   8   7.954  -1.126   1.832
  362    HB   ILE   8           HB       ILE   8  10.517  -2.507   2.693
  363   HG12  ILE   8          HG12      ILE   8  10.900  -1.492   0.522
  364   HG13  ILE   8          HG11      ILE   8  10.624  -3.212   0.278
  365   HG21  ILE   8          HG21      ILE   8   8.342  -3.673   3.138
  366   HG22  ILE   8          HG22      ILE   8   9.348  -4.524   1.968
  367   HG23  ILE   8          HG23      ILE   8   7.975  -3.565   1.417
  368   HD11  ILE   8          HD11      ILE   8   9.310  -2.175  -1.373
  369   HD12  ILE   8          HD12      ILE   8   8.767  -0.908  -0.284
  370   HD13  ILE   8          HD13      ILE   8   8.146  -2.550  -0.104
  371    H    THR   9           HN       THR   9  10.377  -0.605   4.367
  372    HA   THR   9           HA       THR   9   8.947  -1.816   6.480
  373    HB   THR   9           HB       THR   9  10.910   0.490   6.550
  374    HG1  THR   9           HG1      THR   9  11.327  -1.878   5.792
  375   HG21  THR   9          HG21      THR   9   9.701   0.469   8.615
  376   HG22  THR   9          HG22      THR   9  11.236  -0.338   8.926
  377   HG23  THR   9          HG23      THR   9   9.766  -1.289   8.712
  378    H    ARG  10           HN       ARG  10   8.948   1.497   5.205
  379    HA   ARG  10           HA       ARG  10   7.262   2.647   7.157
  380    HB2  ARG  10           HB2      ARG  10   8.603   3.946   5.508
  381    HB3  ARG  10           HB1      ARG  10   7.503   3.412   4.236
  382    HG2  ARG  10           HG2      ARG  10   5.618   4.481   5.372
  383    HG3  ARG  10           HG1      ARG  10   6.667   4.958   6.709
  384    HD2  ARG  10           HD2      ARG  10   6.437   6.869   5.257
  385    HD3  ARG  10           HD1      ARG  10   8.067   6.235   5.057
  386    HE   ARG  10           HE       ARG  10   7.495   5.525   2.892
  387   HH11  ARG  10          HH11      ARG  10   6.163   5.648   1.058
  388   HH12  ARG  10          HH12      ARG  10   4.537   6.221   1.221
  389   HH21  ARG  10          HH21      ARG  10   4.782   6.747   4.637
  390   HH22  ARG  10          HH22      ARG  10   3.756   6.842   3.246
  391    H    CYS  11           HN       CYS  11   6.562   1.029   4.077
  392    HA   CYS  11           HA       CYS  11   3.802   1.484   3.955
  393    HB2  CYS  11           HB2      CYS  11   5.277   0.434   2.182
  394    HB3  CYS  11           HB1      CYS  11   5.169  -1.067   3.100
  395    H    LYS  12           HN       LYS  12   5.656  -1.015   5.641
  396    HA   LYS  12           HA       LYS  12   3.467  -2.564   6.534
  397    HB2  LYS  12           HB2      LYS  12   5.826  -3.298   6.590
  398    HB3  LYS  12           HB1      LYS  12   6.138  -2.158   7.896
  399    HG2  LYS  12           HG2      LYS  12   4.383  -3.285   9.265
  400    HG3  LYS  12           HG1      LYS  12   4.161  -4.459   7.969
  401    HD2  LYS  12           HD2      LYS  12   6.847  -3.969   9.262
  402    HD3  LYS  12           HD1      LYS  12   5.708  -5.162   9.885
  403    HE2  LYS  12           HE2      LYS  12   5.669  -6.182   7.557
  404    HE3  LYS  12           HE1      LYS  12   7.007  -5.113   7.147
  405    HZ1  LYS  12           HZ1      LYS  12   7.167  -7.558   8.375
  406    HZ2  LYS  12           HZ2      LYS  12   7.495  -6.427   9.600
  407    HZ3  LYS  12           HZ3      LYS  12   8.416  -6.431   8.171
  408    H    LYS  13           HN       LYS  13   5.167   0.203   7.960
  409    HA   LYS  13           HA       LYS  13   3.809   0.226  10.432
  410    HB2  LYS  13           HB2      LYS  13   5.143   2.422   8.845
  411    HB3  LYS  13           HB1      LYS  13   4.469   2.679  10.456
  412    HG2  LYS  13           HG2      LYS  13   5.924   0.878  11.338
  413    HG3  LYS  13           HG1      LYS  13   6.612   0.658   9.729
  414    HD2  LYS  13           HD2      LYS  13   7.426   2.981   9.746
  415    HD3  LYS  13           HD1      LYS  13   6.719   3.224  11.344
  416    HE2  LYS  13           HE2      LYS  13   8.166   1.448  12.258
  417    HE3  LYS  13           HE1      LYS  13   8.876   1.204  10.663
  418    HZ1  LYS  13           HZ1      LYS  13   8.883   3.926  11.687
  419    HZ2  LYS  13           HZ2      LYS  13  10.067   3.096  10.795
  420    HZ3  LYS  13           HZ3      LYS  13   9.916   2.831  12.467
  421    H    LEU  14           HN       LEU  14   3.068   1.732   7.316
  422    HA   LEU  14           HA       LEU  14   0.839   3.245   8.181
  423    HB2  LEU  14           HB2      LEU  14   1.506   2.052   5.478
  424    HB3  LEU  14           HB1      LEU  14   0.211   3.215   5.758
  425    HG   LEU  14           HG       LEU  14   3.125   3.710   6.434
  426   HD11  LEU  14          HD11      LEU  14   1.488   4.306   3.975
  427   HD12  LEU  14          HD12      LEU  14   3.140   3.703   4.095
  428   HD13  LEU  14          HD13      LEU  14   2.794   5.390   4.449
  429   HD21  LEU  14          HD21      LEU  14   1.934   5.185   7.794
  430   HD22  LEU  14          HD22      LEU  14   0.596   5.331   6.652
  431   HD23  LEU  14          HD23      LEU  14   2.126   6.153   6.335
  432    H    LEU  15           HN       LEU  15   1.122  -0.036   6.889
  433    HA   LEU  15           HA       LEU  15  -1.661  -0.594   6.830
  434    HB2  LEU  15           HB2      LEU  15   0.750  -2.412   7.016
  435    HB3  LEU  15           HB1      LEU  15  -0.901  -2.987   6.791
  436    HG   LEU  15           HG       LEU  15   0.415  -0.964   4.959
  437   HD11  LEU  15          HD11      LEU  15   1.691  -3.002   4.768
  438   HD12  LEU  15          HD12      LEU  15   0.614  -2.910   3.373
  439   HD13  LEU  15          HD13      LEU  15   0.218  -3.974   4.723
  440   HD21  LEU  15          HD21      LEU  15  -2.214  -2.443   4.995
  441   HD22  LEU  15          HD22      LEU  15  -1.478  -2.060   3.438
  442   HD23  LEU  15          HD23      LEU  15  -1.876  -0.767   4.561
  443    H    ASP  16           HN       ASP  16   0.830  -1.031   9.283
  444    HA   ASP  16           HA       ASP  16  -0.701  -2.512  11.130
  445    HB2  ASP  16           HB2      ASP  16   1.667  -0.671  11.467
  446    HB3  ASP  16           HB1      ASP  16   0.947  -1.545  12.818
  447    H    ASP  17           HN       ASP  17  -0.415   0.932  10.522
  448    HA   ASP  17           HA       ASP  17  -1.733   1.860  12.842
  449    HB2  ASP  17           HB2      ASP  17  -1.426   3.062  10.083
  450    HB3  ASP  17           HB1      ASP  17  -2.173   3.910  11.435
  451    H    SER  18           HN       SER  18  -2.887   0.034  10.263
  452    HA   SER  18           HA       SER  18  -5.431   1.071   9.797
  453    HB2  SER  18           HB2      SER  18  -6.018  -1.158   9.006
  454    HB3  SER  18           HB1      SER  18  -4.378  -0.774   8.491
  455    HG   SER  18           HG       SER  18  -5.003  -2.889   9.703
  456    H    SER  19           HN       SER  19  -4.175  -0.686  12.474
  457    HA   SER  19           HA       SER  19  -6.796  -1.272  13.599
  458    HB2  SER  19           HB2      SER  19  -5.597  -2.306  15.425
  459    HB3  SER  19           HB1      SER  19  -4.862  -2.823  13.910
  460    HG   SER  19           HG       SER  19  -3.282  -2.149  15.399
  461    H    SER  20           HN       SER  20  -4.614   1.291  13.599
  462    HA   SER  20           HA       SER  20  -5.335   2.377  16.186
  463    HB2  SER  20           HB2      SER  20  -3.139   2.913  15.436
  464    HB3  SER  20           HB1      SER  20  -3.729   3.469  13.877
  465    HG   SER  20           HG       SER  20  -4.482   5.273  14.788
  466    H2   ZBR 100           HA3      TBS 100  -1.521   0.943  -1.898
  467    H4   ZBR 100           HC3      TBS 100   0.825   1.481   1.681
  468    H6   ZBR 100           HB3      TBS 100   2.673  -0.072  -1.894
  469    H7   ZBR 100          HB11      TBS 100   1.089   0.616  -4.096
  470    H7A  ZBR 100          HB12      TBS 100  -0.559   0.041  -3.827
  471    H8   ZBR 100          HA11      TBS 100  -2.029   2.696   0.213
  472    H8A  ZBR 100          HA12      TBS 100  -1.462   1.977   1.722
  473    H9   ZBR 100          HC11      TBS 100   3.495   1.584   1.047
  474    H9A  ZBR 100          HC12      TBS 100   3.971   0.223   0.028
  Start of MODEL    8
    1    H1   LYS   1           HN       LYS   1  -6.033   4.769  16.872
    2    HA   LYS   1           HA       LYS   1  -8.221   5.627  15.216
    3    HB2  LYS   1           HB2      LYS   1  -7.012   6.784  17.738
    4    HB3  LYS   1           HB1      LYS   1  -8.463   7.414  16.959
    5    HG2  LYS   1           HG2      LYS   1  -9.564   5.227  17.214
    6    HG3  LYS   1           HG1      LYS   1  -8.111   4.580  17.979
    7    HD2  LYS   1           HD2      LYS   1  -8.320   6.255  19.787
    8    HD3  LYS   1           HD1      LYS   1  -9.784   6.883  19.027
    9    HE2  LYS   1           HE2      LYS   1 -10.880   4.697  19.290
   10    HE3  LYS   1           HE1      LYS   1  -9.415   4.042  20.021
   11    HZ1  LYS   1           HZ1      LYS   1 -11.365   5.918  21.125
   12    HZ2  LYS   1           HZ2      LYS   1  -9.741   6.117  21.578
   13    HZ3  LYS   1           HZ3      LYS   1 -10.537   4.647  21.883
   14    H    ASN   2           HN       ASN   2  -5.172   5.890  14.562
   15    HA   ASN   2           HA       ASN   2  -4.568   8.611  14.353
   16    HB2  ASN   2           HB2      ASN   2  -3.648   6.311  12.609
   17    HB3  ASN   2           HB1      ASN   2  -2.909   7.910  12.635
   18   HD21  ASN   2          HD21      ASN   2  -1.958   5.111  13.539
   19   HD22  ASN   2          HD22      ASN   2  -1.376   5.383  15.113
   20    HA   PRO   3           HA       PRO   3  -7.132  10.003  10.992
   21    HB2  PRO   3           HB2      PRO   3  -5.490  11.941   9.896
   22    HB3  PRO   3           HB1      PRO   3  -6.403  12.163  11.403
   23    HG2  PRO   3           HG2      PRO   3  -3.530  11.432  11.024
   24    HG3  PRO   3           HG1      PRO   3  -4.259  12.556  12.183
   25    HD2  PRO   3           HD2      PRO   3  -3.504  10.070  12.906
   26    HD3  PRO   3           HD1      PRO   3  -4.921  10.857  13.623
   27    H    GLU   4           HN       GLU   4  -3.979   8.708  10.470
   28    HA   GLU   4           HA       GLU   4  -3.896   8.743   7.642
   29    HB2  GLU   4           HB2      GLU   4  -2.578   6.895   9.642
   30    HB3  GLU   4           HB1      GLU   4  -2.225   6.900   7.914
   31    HG2  GLU   4           HG2      GLU   4  -1.547   9.258   8.039
   32    HG3  GLU   4           HG1      GLU   4  -1.934   9.288   9.758
   33    H    ALA   5           HN       ALA   5  -5.874   7.056   9.797
   34    HA   ALA   5           HA       ALA   5  -6.198   4.545   8.648
   35    HB1  ALA   5           HB1      ALA   5  -8.457   6.205   9.770
   36    HB2  ALA   5           HB2      ALA   5  -7.244   5.430  10.789
   37    HB3  ALA   5           HB3      ALA   5  -8.300   4.449   9.771
   38    H    GLU   6           HN       GLU   6  -7.288   7.679   7.565
   39    HA   GLU   6           HA       GLU   6  -9.282   6.848   5.735
   40    HB2  GLU   6           HB2      GLU   6  -7.457   9.258   5.791
   41    HB3  GLU   6           HB1      GLU   6  -8.740   9.047   4.599
   42    HG2  GLU   6           HG2      GLU   6 -10.412   8.918   6.372
   43    HG3  GLU   6           HG1      GLU   6  -9.153   9.016   7.601
   44    H    GLU   7           HN       GLU   7  -5.771   7.197   5.464
   45    HA   GLU   7           HA       GLU   7  -5.601   6.729   2.673
   46    HB2  GLU   7           HB2      GLU   7  -3.776   7.724   4.079
   47    HB3  GLU   7           HB1      GLU   7  -3.490   6.119   4.753
   48    HG2  GLU   7           HG2      GLU   7  -1.936   6.475   2.916
   49    HG3  GLU   7           HG1      GLU   7  -3.118   5.264   2.422
   50    H    ILE   8           HN       ILE   8  -5.543   4.613   5.489
   51    HA   ILE   8           HA       ILE   8  -4.828   2.221   4.153
   52    HB   ILE   8           HB       ILE   8  -6.316   2.830   6.704
   53   HG12  ILE   8          HG12      ILE   8  -4.337   1.626   7.673
   54   HG13  ILE   8          HG11      ILE   8  -3.679   1.465   6.045
   55   HG21  ILE   8          HG21      ILE   8  -6.002   0.149   5.357
   56   HG22  ILE   8          HG22      ILE   8  -7.448   0.860   6.067
   57   HG23  ILE   8          HG23      ILE   8  -6.149   0.287   7.107
   58   HD11  ILE   8          HD11      ILE   8  -3.465   3.841   5.813
   59   HD12  ILE   8          HD12      ILE   8  -2.806   3.436   7.401
   60   HD13  ILE   8          HD13      ILE   8  -4.421   4.119   7.265
   61    H    THR   9           HN       THR   9  -7.980   3.739   4.734
   62    HA   THR   9           HA       THR   9  -9.585   1.664   3.723
   63    HB   THR   9           HB       THR   9 -10.045   4.656   3.681
   64    HG1  THR   9           HG1      THR   9 -10.649   2.587   5.514
   65   HG21  THR   9          HG21      THR   9 -12.467   3.920   3.614
   66   HG22  THR   9          HG22      THR   9 -11.883   2.298   3.239
   67   HG23  THR   9          HG23      THR   9 -11.558   3.630   2.131
   68    H    ARG  10           HN       ARG  10  -8.027   4.430   2.149
   69    HA   ARG  10           HA       ARG  10  -9.047   3.986  -0.459
   70    HB2  ARG  10           HB2      ARG  10  -6.560   5.361   0.559
   71    HB3  ARG  10           HB1      ARG  10  -6.987   5.302  -1.150
   72    HG2  ARG  10           HG2      ARG  10  -8.997   6.519  -0.806
   73    HG3  ARG  10           HG1      ARG  10  -8.928   6.291   0.942
   74    HD2  ARG  10           HD2      ARG  10  -8.224   8.584   0.162
   75    HD3  ARG  10           HD1      ARG  10  -7.020   7.744   1.133
   76    HE   ARG  10           HE       ARG  10  -5.652   7.604  -0.752
   77   HH11  ARG  10          HH11      ARG  10  -5.111   8.167  -2.876
   78   HH12  ARG  10          HH12      ARG  10  -6.326   8.789  -3.942
   79   HH21  ARG  10          HH21      ARG  10  -8.858   8.609  -1.576
   80   HH22  ARG  10          HH22      ARG  10  -8.451   9.039  -3.204
   81    H    CYS  11           HN       CYS  11  -6.208   2.776   1.257
   82    HA   CYS  11           HA       CYS  11  -4.847   1.547  -0.840
   83    HB2  CYS  11           HB2      CYS  11  -4.208   1.776   1.665
   84    HB3  CYS  11           HB1      CYS  11  -5.076   0.255   1.869
   85    H    LYS  12           HN       LYS  12  -7.443   0.253   1.216
   86    HA   LYS  12           HA       LYS  12  -7.530  -2.319   0.066
   87    HB2  LYS  12           HB2      LYS  12  -9.647  -0.676   1.465
   88    HB3  LYS  12           HB1      LYS  12  -9.878  -2.360   0.994
   89    HG2  LYS  12           HG2      LYS  12  -7.909  -3.004   2.344
   90    HG3  LYS  12           HG1      LYS  12  -7.694  -1.321   2.825
   91    HD2  LYS  12           HD2      LYS  12  -9.948  -1.332   3.849
   92    HD3  LYS  12           HD1      LYS  12 -10.135  -3.027   3.399
   93    HE2  LYS  12           HE2      LYS  12  -7.965  -1.927   5.211
   94    HE3  LYS  12           HE1      LYS  12  -9.399  -2.800   5.750
   95    HZ1  LYS  12           HZ1      LYS  12  -6.978  -3.871   4.914
   96    HZ2  LYS  12           HZ2      LYS  12  -8.115  -4.260   3.712
   97    HZ3  LYS  12           HZ3      LYS  12  -8.394  -4.709   5.326
   98    H    LYS  13           HN       LYS  13  -9.220   0.688  -0.738
   99    HA   LYS  13           HA       LYS  13 -10.892  -0.401  -2.755
  100    HB2  LYS  13           HB2      LYS  13  -9.823   2.405  -2.387
  101    HB3  LYS  13           HB1      LYS  13 -11.111   1.958  -3.505
  102    HG2  LYS  13           HG2      LYS  13 -11.206   1.488  -0.513
  103    HG3  LYS  13           HG1      LYS  13 -11.964   2.857  -1.325
  104    HD2  LYS  13           HD2      LYS  13 -13.163   1.055  -2.773
  105    HD3  LYS  13           HD1      LYS  13 -12.673  -0.076  -1.513
  106    HE2  LYS  13           HE2      LYS  13 -14.316   2.424  -1.093
  107    HE3  LYS  13           HE1      LYS  13 -14.907   0.763  -1.047
  108    HZ1  LYS  13           HZ1      LYS  13 -14.471   1.568   1.171
  109    HZ2  LYS  13           HZ2      LYS  13 -12.865   1.935   0.760
  110    HZ3  LYS  13           HZ3      LYS  13 -13.391   0.318   0.789
  111    H    LEU  14           HN       LEU  14  -7.662   1.011  -2.834
  112    HA   LEU  14           HA       LEU  14  -7.359   1.017  -5.641
  113    HB2  LEU  14           HB2      LEU  14  -5.365   0.867  -3.380
  114    HB3  LEU  14           HB1      LEU  14  -4.881   0.994  -5.071
  115    HG   LEU  14           HG       LEU  14  -6.776   2.953  -3.739
  116   HD11  LEU  14          HD11      LEU  14  -3.773   3.150  -4.132
  117   HD12  LEU  14          HD12      LEU  14  -4.619   3.063  -2.587
  118   HD13  LEU  14          HD13      LEU  14  -4.810   4.479  -3.620
  119   HD21  LEU  14          HD21      LEU  14  -5.376   2.779  -6.409
  120   HD22  LEU  14          HD22      LEU  14  -5.743   4.364  -5.729
  121   HD23  LEU  14          HD23      LEU  14  -7.046   3.227  -6.056
  122    H    LEU  15           HN       LEU  15  -6.604  -1.411  -3.195
  123    HA   LEU  15           HA       LEU  15  -5.370  -3.263  -4.943
  124    HB2  LEU  15           HB2      LEU  15  -6.773  -3.622  -2.290
  125    HB3  LEU  15           HB1      LEU  15  -5.910  -4.918  -3.123
  126    HG   LEU  15           HG       LEU  15  -4.652  -2.252  -2.412
  127   HD11  LEU  15          HD11      LEU  15  -4.408  -4.895  -0.953
  128   HD12  LEU  15          HD12      LEU  15  -5.343  -3.510  -0.384
  129   HD13  LEU  15          HD13      LEU  15  -3.589  -3.392  -0.537
  130   HD21  LEU  15          HD21      LEU  15  -3.664  -4.809  -3.663
  131   HD22  LEU  15          HD22      LEU  15  -2.557  -3.893  -2.638
  132   HD23  LEU  15          HD23      LEU  15  -3.263  -3.139  -4.063
  133    H    ASP  16           HN       ASP  16  -8.711  -2.802  -3.925
  134    HA   ASP  16           HA       ASP  16  -9.789  -5.131  -5.092
  135    HB2  ASP  16           HB2      ASP  16 -11.003  -2.440  -4.451
  136    HB3  ASP  16           HB1      ASP  16 -11.943  -3.796  -5.070
  137    H    ASP  17           HN       ASP  17  -9.114  -1.931  -6.373
  138    HA   ASP  17           HA       ASP  17 -10.475  -2.191  -8.834
  139    HB2  ASP  17           HB2      ASP  17  -8.118  -0.489  -8.004
  140    HB3  ASP  17           HB1      ASP  17  -8.879  -0.379  -9.590
  141    H    SER  18           HN       SER  18  -7.800  -3.841  -7.648
  142    HA   SER  18           HA       SER  18  -6.108  -4.064  -9.842
  143    HB2  SER  18           HB2      SER  18  -5.336  -6.146  -8.829
  144    HB3  SER  18           HB1      SER  18  -5.613  -4.942  -7.572
  145    HG   SER  18           HG       SER  18  -6.990  -6.285  -6.758
  146    H    SER  19           HN       SER  19  -9.136  -5.593  -9.172
  147    HA   SER  19           HA       SER  19  -8.926  -7.348 -11.509
  148    HB2  SER  19           HB2      SER  19 -11.126  -7.023  -9.465
  149    HB3  SER  19           HB1      SER  19 -11.157  -8.174 -10.797
  150    HG   SER  19           HG       SER  19  -8.973  -8.064  -9.018
  151    H    SER  20           HN       SER  20  -9.955  -4.258 -10.786
  152    HA   SER  20           HA       SER  20 -12.082  -4.091 -12.753
  153    HB2  SER  20           HB2      SER  20 -12.207  -1.755 -12.174
  154    HB3  SER  20           HB1      SER  20 -12.055  -2.686 -10.688
  155    HG   SER  20           HG       SER  20  -9.746  -1.778 -11.989
  156    H1   LYS   1           HN       LYS   1 -12.013  -2.901 -14.689
  157    HA   LYS   1           HA       LYS   1  -9.520  -3.097 -16.110
  158    HB2  LYS   1           HB2      LYS   1 -12.215  -1.967 -16.895
  159    HB3  LYS   1           HB1      LYS   1 -10.841  -2.100 -17.993
  160    HG2  LYS   1           HG2      LYS   1 -10.769  -4.534 -17.626
  161    HG3  LYS   1           HG1      LYS   1 -12.134  -4.411 -16.515
  162    HD2  LYS   1           HD2      LYS   1 -13.535  -3.504 -18.339
  163    HD3  LYS   1           HD1      LYS   1 -12.173  -3.648 -19.450
  164    HE2  LYS   1           HE2      LYS   1 -12.110  -6.081 -19.077
  165    HE3  LYS   1           HE1      LYS   1 -13.459  -5.948 -17.949
  166    HZ1  LYS   1           HZ1      LYS   1 -13.438  -5.713 -20.861
  167    HZ2  LYS   1           HZ2      LYS   1 -14.527  -4.730 -20.006
  168    HZ3  LYS   1           HZ3      LYS   1 -14.593  -6.419 -19.839
  169    H    ASN   2           HN       ASN   2 -10.197  -1.082 -13.815
  170    HA   ASN   2           HA       ASN   2 -10.042   1.506 -14.864
  171    HB2  ASN   2           HB2      ASN   2  -9.033   0.464 -12.204
  172    HB3  ASN   2           HB1      ASN   2  -9.255   2.165 -12.599
  173   HD21  ASN   2          HD21      ASN   2 -10.676   0.204 -10.664
  174   HD22  ASN   2          HD22      ASN   2 -12.325   0.452 -11.003
  175    HA   PRO   3           HA       PRO   3  -5.813   1.846 -16.201
  176    HB2  PRO   3           HB2      PRO   3  -5.358   4.531 -15.706
  177    HB3  PRO   3           HB1      PRO   3  -6.314   3.931 -17.077
  178    HG2  PRO   3           HG2      PRO   3  -7.244   4.995 -14.444
  179    HG3  PRO   3           HG1      PRO   3  -7.895   5.286 -16.067
  180    HD2  PRO   3           HD2      PRO   3  -9.060   3.548 -14.359
  181    HD3  PRO   3           HD1      PRO   3  -9.061   3.276 -16.109
  182    H    GLU   4           HN       GLU   4  -6.776   2.627 -12.983
  183    HA   GLU   4           HA       GLU   4  -4.258   3.224 -11.845
  184    HB2  GLU   4           HB2      GLU   4  -6.766   2.063 -10.611
  185    HB3  GLU   4           HB1      GLU   4  -5.356   2.583  -9.687
  186    HG2  GLU   4           HG2      GLU   4  -5.573   4.856 -10.604
  187    HG3  GLU   4           HG1      GLU   4  -6.965   4.345 -11.559
  188    H    ALA   5           HN       ALA   5  -5.497   0.360 -13.138
  189    HA   ALA   5           HA       ALA   5  -4.519  -1.651 -11.486
  190    HB1  ALA   5           HB1      ALA   5  -4.434  -1.747 -14.502
  191    HB2  ALA   5           HB2      ALA   5  -5.934  -1.897 -13.586
  192    HB3  ALA   5           HB3      ALA   5  -4.651  -3.090 -13.380
  193    H    GLU   6           HN       GLU   6  -2.833   0.508 -13.651
  194    HA   GLU   6           HA       GLU   6  -0.398  -0.915 -13.893
  195    HB2  GLU   6           HB2      GLU   6  -1.042   2.038 -13.985
  196    HB3  GLU   6           HB1      GLU   6   0.564   1.390 -14.321
  197    HG2  GLU   6           HG2      GLU   6  -0.316   0.047 -16.150
  198    HG3  GLU   6           HG1      GLU   6  -1.962   0.553 -15.772
  199    H    GLU   7           HN       GLU   7  -1.630   1.342 -11.463
  200    HA   GLU   7           HA       GLU   7   0.774   1.585  -9.981
  201    HB2  GLU   7           HB2      GLU   7  -1.192   3.131  -9.790
  202    HB3  GLU   7           HB1      GLU   7  -2.050   1.854  -8.928
  203    HG2  GLU   7           HG2      GLU   7  -1.030   3.345  -7.297
  204    HG3  GLU   7           HG1      GLU   7  -0.185   1.799  -7.252
  205    H    ILE   8           HN       ILE   8  -1.949  -0.646  -9.824
  206    HA   ILE   8           HA       ILE   8  -1.231  -1.949  -7.413
  207    HB   ILE   8           HB       ILE   8  -2.852  -2.749  -9.825
  208   HG12  ILE   8          HG12      ILE   8  -4.657  -2.838  -8.082
  209   HG13  ILE   8          HG11      ILE   8  -3.481  -2.292  -6.887
  210   HG21  ILE   8          HG21      ILE   8  -1.958  -4.513  -7.549
  211   HG22  ILE   8          HG22      ILE   8  -1.957  -4.856  -9.275
  212   HG23  ILE   8          HG23      ILE   8  -3.478  -4.809  -8.391
  213   HD11  ILE   8          HD11      ILE   8  -3.188  -0.197  -8.016
  214   HD12  ILE   8          HD12      ILE   8  -4.930  -0.470  -7.909
  215   HD13  ILE   8          HD13      ILE   8  -4.081  -0.772  -9.419
  216    H    THR   9           HN       THR   9  -0.302  -2.557 -10.781
  217    HA   THR   9           HA       THR   9   1.130  -4.936 -10.349
  218    HB   THR   9           HB       THR   9   1.597  -2.747 -12.392
  219    HG1  THR   9           HG1      THR   9   0.035  -5.108 -12.345
  220   HG21  THR   9          HG21      THR   9   2.597  -4.703 -13.681
  221   HG22  THR   9          HG22      THR   9   2.597  -5.588 -12.156
  222   HG23  THR   9          HG23      THR   9   3.552  -4.114 -12.321
  223    H    ARG  10           HN       ARG  10   2.099  -1.531 -10.202
  224    HA   ARG  10           HA       ARG  10   4.850  -1.959  -9.669
  225    HB2  ARG  10           HB2      ARG  10   2.985   0.335  -9.053
  226    HB3  ARG  10           HB1      ARG  10   4.708   0.372  -8.682
  227    HG2  ARG  10           HG2      ARG  10   5.317   0.182 -10.971
  228    HG3  ARG  10           HG1      ARG  10   3.682  -0.276 -11.449
  229    HD2  ARG  10           HD2      ARG  10   4.307   2.126 -11.952
  230    HD3  ARG  10           HD1      ARG  10   2.843   1.922 -10.997
  231    HE   ARG  10           HE       ARG  10   3.938   2.889  -9.176
  232   HH11  ARG  10          HH11      ARG  10   5.669   4.033  -8.264
  233   HH12  ARG  10          HH12      ARG  10   7.199   4.077  -9.075
  234   HH21  ARG  10          HH21      ARG  10   6.136   2.124 -11.737
  235   HH22  ARG  10          HH22      ARG  10   7.464   2.995 -11.044
  236    H    CYS  11           HN       CYS  11   1.997  -1.720  -7.601
  237    HA   CYS  11           HA       CYS  11   3.210  -1.581  -5.098
  238    HB2  CYS  11           HB2      CYS  11   0.702  -1.506  -5.741
  239    HB3  CYS  11           HB1      CYS  11   0.760  -3.261  -5.585
  240    H    LYS  12           HN       LYS  12   2.361  -4.449  -7.025
  241    HA   LYS  12           HA       LYS  12   3.232  -6.374  -5.157
  242    HB2  LYS  12           HB2      LYS  12   3.009  -6.463  -8.172
  243    HB3  LYS  12           HB1      LYS  12   3.394  -7.872  -7.182
  244    HG2  LYS  12           HG2      LYS  12   1.286  -7.569  -5.930
  245    HG3  LYS  12           HG1      LYS  12   0.897  -6.169  -6.929
  246    HD2  LYS  12           HD2      LYS  12   0.937  -7.605  -8.945
  247    HD3  LYS  12           HD1      LYS  12   1.282  -9.006  -7.930
  248    HE2  LYS  12           HE2      LYS  12  -1.184  -7.251  -7.709
  249    HE3  LYS  12           HE1      LYS  12  -1.132  -8.846  -8.459
  250    HZ1  LYS  12           HZ1      LYS  12  -1.498  -8.250  -5.773
  251    HZ2  LYS  12           HZ2      LYS  12   0.036  -8.969  -5.899
  252    HZ3  LYS  12           HZ3      LYS  12  -1.338  -9.783  -6.480
  253    H    LYS  13           HN       LYS  13   4.916  -4.705  -7.792
  254    HA   LYS  13           HA       LYS  13   7.358  -6.129  -7.580
  255    HB2  LYS  13           HB2      LYS  13   6.796  -3.323  -8.559
  256    HB3  LYS  13           HB1      LYS  13   8.316  -4.184  -8.795
  257    HG2  LYS  13           HG2      LYS  13   5.619  -5.165  -9.772
  258    HG3  LYS  13           HG1      LYS  13   6.794  -4.322 -10.779
  259    HD2  LYS  13           HD2      LYS  13   8.450  -6.185 -10.045
  260    HD3  LYS  13           HD1      LYS  13   7.014  -7.064  -9.525
  261    HE2  LYS  13           HE2      LYS  13   7.525  -6.023 -12.314
  262    HE3  LYS  13           HE1      LYS  13   7.599  -7.707 -11.795
  263    HZ1  LYS  13           HZ1      LYS  13   5.474  -7.226 -12.801
  264    HZ2  LYS  13           HZ2      LYS  13   5.201  -5.959 -11.703
  265    HZ3  LYS  13           HZ3      LYS  13   5.266  -7.565 -11.151
  266    H    LEU  14           HN       LEU  14   6.170  -3.189  -6.035
  267    HA   LEU  14           HA       LEU  14   8.575  -2.496  -4.726
  268    HB2  LEU  14           HB2      LEU  14   5.676  -1.952  -4.080
  269    HB3  LEU  14           HB1      LEU  14   7.007  -1.263  -3.151
  270    HG   LEU  14           HG       LEU  14   6.760  -0.962  -6.159
  271   HD11  LEU  14          HD11      LEU  14   5.833   0.909  -3.958
  272   HD12  LEU  14          HD12      LEU  14   4.810   0.091  -5.138
  273   HD13  LEU  14          HD13      LEU  14   5.935   1.342  -5.662
  274   HD21  LEU  14          HD21      LEU  14   8.549   0.184  -4.012
  275   HD22  LEU  14          HD22      LEU  14   8.216   1.136  -5.459
  276   HD23  LEU  14          HD23      LEU  14   8.983  -0.441  -5.603
  277    H    LEU  15           HN       LEU  15   5.849  -4.512  -3.735
  278    HA   LEU  15           HA       LEU  15   6.759  -5.025  -1.103
  279    HB2  LEU  15           HB2      LEU  15   4.930  -6.578  -2.943
  280    HB3  LEU  15           HB1      LEU  15   5.212  -7.007  -1.254
  281    HG   LEU  15           HG       LEU  15   4.252  -4.275  -2.150
  282   HD11  LEU  15          HD11      LEU  15   2.616  -6.560  -1.023
  283   HD12  LEU  15          HD12      LEU  15   2.618  -6.064  -2.717
  284   HD13  LEU  15          HD13      LEU  15   2.017  -4.965  -1.475
  285   HD21  LEU  15          HD21      LEU  15   4.765  -5.586   0.513
  286   HD22  LEU  15          HD22      LEU  15   3.435  -4.431   0.391
  287   HD23  LEU  15          HD23      LEU  15   5.075  -3.927   0.002
  288    H    ASP  16           HN       ASP  16   7.287  -6.660  -4.178
  289    HA   ASP  16           HA       ASP  16   8.614  -8.938  -3.178
  290    HB2  ASP  16           HB2      ASP  16   8.755  -7.515  -5.837
  291    HB3  ASP  16           HB1      ASP  16   9.621  -9.014  -5.509
  292    H    ASP  17           HN       ASP  17   9.740  -5.720  -4.019
  293    HA   ASP  17           HA       ASP  17  12.516  -6.222  -3.892
  294    HB2  ASP  17           HB2      ASP  17  10.906  -3.696  -3.488
  295    HB3  ASP  17           HB1      ASP  17  12.669  -3.732  -3.482
  296    H    SER  18           HN       SER  18  10.185  -6.328  -1.478
  297    HA   SER  18           HA       SER  18  11.427  -5.178   0.726
  298    HB2  SER  18           HB2      SER  18  10.027  -6.651   2.078
  299    HB3  SER  18           HB1      SER  18   9.102  -6.051   0.702
  300    HG   SER  18           HG       SER  18   8.845  -8.054   0.164
  301    H    SER  19           HN       SER  19  11.995  -8.203  -0.853
  302    HA   SER  19           HA       SER  19  13.868  -9.091   1.217
  303    HB2  SER  19           HB2      SER  19  12.994 -10.392  -1.363
  304    HB3  SER  19           HB1      SER  19  14.125 -11.106  -0.217
  305    HG   SER  19           HG       SER  19  11.609 -10.168   0.633
  306    H    SER  20           HN       SER  20  13.911  -7.271  -1.584
  307    HA   SER  20           HA       SER  20  16.614  -7.918  -2.417
  308    HB2  SER  20           HB2      SER  20  16.332  -6.200  -4.082
  309    HB3  SER  20           HB1      SER  20  14.855  -7.159  -4.023
  310    HG   SER  20           HG       SER  20  15.096  -4.909  -2.371
  311    H1   LYS   1           HN       LYS   1  18.414  -6.537  -2.280
  312    HA   LYS   1           HA       LYS   1  18.596  -5.061   0.181
  313    HB2  LYS   1           HB2      LYS   1  20.552  -5.449  -2.097
  314    HB3  LYS   1           HB1      LYS   1  20.934  -4.608  -0.593
  315    HG2  LYS   1           HG2      LYS   1  20.399  -6.626   0.697
  316    HG3  LYS   1           HG1      LYS   1  19.973  -7.477  -0.788
  317    HD2  LYS   1           HD2      LYS   1  22.279  -7.167  -1.624
  318    HD3  LYS   1           HD1      LYS   1  22.704  -6.335  -0.127
  319    HE2  LYS   1           HE2      LYS   1  22.162  -8.356   1.167
  320    HE3  LYS   1           HE1      LYS   1  21.704  -9.192  -0.318
  321    HZ1  LYS   1           HZ1      LYS   1  24.358  -8.455   0.661
  322    HZ2  LYS   1           HZ2      LYS   1  24.102  -8.413  -1.018
  323    HZ3  LYS   1           HZ3      LYS   1  23.853  -9.854  -0.154
  324    H    ASN   2           HN       ASN   2  16.973  -4.231  -2.361
  325    HA   ASN   2           HA       ASN   2  18.047  -1.840  -3.327
  326    HB2  ASN   2           HB2      ASN   2  15.143  -2.652  -3.044
  327    HB3  ASN   2           HB1      ASN   2  15.714  -1.296  -4.012
  328   HD21  ASN   2          HD21      ASN   2  14.445  -4.036  -4.702
  329   HD22  ASN   2          HD22      ASN   2  15.479  -4.655  -5.903
  330    HA   PRO   3           HA       PRO   3  17.480   1.013   0.043
  331    HB2  PRO   3           HB2      PRO   3  17.041   3.352  -1.374
  332    HB3  PRO   3           HB1      PRO   3  18.640   2.607  -1.172
  333    HG2  PRO   3           HG2      PRO   3  16.758   2.449  -3.488
  334    HG3  PRO   3           HG1      PRO   3  18.520   2.643  -3.482
  335    HD2  PRO   3           HD2      PRO   3  17.358   0.260  -3.988
  336    HD3  PRO   3           HD1      PRO   3  18.907   0.378  -3.135
  337    H    GLU   4           HN       GLU   4  15.053   0.513  -2.354
  338    HA   GLU   4           HA       GLU   4  12.999   2.162  -1.325
  339    HB2  GLU   4           HB2      GLU   4  12.868  -0.382  -2.958
  340    HB3  GLU   4           HB1      GLU   4  11.473   0.637  -2.597
  341    HG2  GLU   4           HG2      GLU   4  12.562   2.548  -3.692
  342    HG3  GLU   4           HG1      GLU   4  13.984   1.561  -4.024
  343    H    ALA   5           HN       ALA   5  14.467  -0.606  -0.071
  344    HA   ALA   5           HA       ALA   5  12.399  -2.024   1.133
  345    HB1  ALA   5           HB1      ALA   5  15.066  -1.502   2.446
  346    HB2  ALA   5           HB2      ALA   5  14.885  -2.594   1.072
  347    HB3  ALA   5           HB3      ALA   5  14.045  -2.934   2.586
  348    H    GLU   6           HN       GLU   6  13.806   1.062   1.965
  349    HA   GLU   6           HA       GLU   6  12.878   1.272   4.631
  350    HB2  GLU   6           HB2      GLU   6  13.458   3.353   2.515
  351    HB3  GLU   6           HB1      GLU   6  13.034   3.758   4.179
  352    HG2  GLU   6           HG2      GLU   6  14.957   2.515   5.011
  353    HG3  GLU   6           HG1      GLU   6  15.351   1.977   3.380
  354    H    GLU   7           HN       GLU   7  11.384   1.983   1.503
  355    HA   GLU   7           HA       GLU   7   9.041   3.216   2.520
  356    HB2  GLU   7           HB2      GLU   7   9.827   3.365   0.141
  357    HB3  GLU   7           HB1      GLU   7   9.316   1.691  -0.079
  358    HG2  GLU   7           HG2      GLU   7   7.526   3.151  -0.835
  359    HG3  GLU   7           HG1      GLU   7   7.007   2.353   0.648
  360    H    ILE   8           HN       ILE   8   9.888  -0.121   1.762
  361    HA   ILE   8           HA       ILE   8   7.311  -1.250   2.089
  362    HB   ILE   8           HB       ILE   8  10.115  -2.332   2.312
  363   HG12  ILE   8          HG12      ILE   8   9.306  -3.717   0.381
  364   HG13  ILE   8          HG11      ILE   8   7.765  -2.864   0.458
  365   HG21  ILE   8          HG21      ILE   8   7.549  -3.725   3.069
  366   HG22  ILE   8          HG22      ILE   8   9.068  -3.664   3.956
  367   HG23  ILE   8          HG23      ILE   8   8.946  -4.627   2.486
  368   HD11  ILE   8          HD11      ILE   8   8.806  -0.773  -0.091
  369   HD12  ILE   8          HD12      ILE   8   9.435  -1.962  -1.236
  370   HD13  ILE   8          HD13      ILE   8  10.412  -1.457   0.136
  371    H    THR   9           HN       THR   9   9.904  -0.589   4.413
  372    HA   THR   9           HA       THR   9   8.729  -1.832   6.645
  373    HB   THR   9           HB       THR   9  10.530   0.600   6.516
  374    HG1  THR   9           HG1      THR   9  10.989  -2.184   6.748
  375   HG21  THR   9          HG21      THR   9  11.117  -0.160   8.860
  376   HG22  THR   9          HG22      THR   9   9.714  -1.225   8.784
  377   HG23  THR   9          HG23      THR   9   9.501   0.522   8.681
  378    H    ARG  10           HN       ARG  10   8.436   1.450   5.342
  379    HA   ARG  10           HA       ARG  10   6.753   2.495   7.369
  380    HB2  ARG  10           HB2      ARG  10   7.165   3.243   4.471
  381    HB3  ARG  10           HB1      ARG  10   6.101   4.142   5.552
  382    HG2  ARG  10           HG2      ARG  10   7.890   4.750   6.991
  383    HG3  ARG  10           HG1      ARG  10   8.981   3.569   6.264
  384    HD2  ARG  10           HD2      ARG  10   9.361   5.965   5.533
  385    HD3  ARG  10           HD1      ARG  10   9.109   4.816   4.223
  386    HE   ARG  10           HE       ARG  10   7.081   5.866   3.740
  387   HH11  ARG  10          HH11      ARG  10   5.610   7.573   3.970
  388   HH12  ARG  10          HH12      ARG  10   5.685   8.596   5.367
  389   HH21  ARG  10          HH21      ARG  10   8.378   6.920   6.769
  390   HH22  ARG  10          HH22      ARG  10   7.255   8.226   6.953
  391    H    CYS  11           HN       CYS  11   6.115   0.754   4.362
  392    HA   CYS  11           HA       CYS  11   3.352   1.059   4.190
  393    HB2  CYS  11           HB2      CYS  11   5.003  -0.126   2.582
  394    HB3  CYS  11           HB1      CYS  11   4.704  -1.558   3.566
  395    H    LYS  12           HN       LYS  12   5.235  -1.389   5.958
  396    HA   LYS  12           HA       LYS  12   3.035  -2.839   6.965
  397    HB2  LYS  12           HB2      LYS  12   5.846  -2.466   8.022
  398    HB3  LYS  12           HB1      LYS  12   4.683  -3.590   8.727
  399    HG2  LYS  12           HG2      LYS  12   4.466  -4.732   6.546
  400    HG3  LYS  12           HG1      LYS  12   5.638  -3.614   5.848
  401    HD2  LYS  12           HD2      LYS  12   7.333  -4.386   7.484
  402    HD3  LYS  12           HD1      LYS  12   6.163  -5.533   8.138
  403    HE2  LYS  12           HE2      LYS  12   7.140  -5.485   5.267
  404    HE3  LYS  12           HE1      LYS  12   7.685  -6.615   6.506
  405    HZ1  LYS  12           HZ1      LYS  12   5.463  -6.850   4.862
  406    HZ2  LYS  12           HZ2      LYS  12   4.866  -6.569   6.427
  407    HZ3  LYS  12           HZ3      LYS  12   5.918  -7.871   6.139
  408    H    LYS  13           HN       LYS  13   4.820  -0.055   8.239
  409    HA   LYS  13           HA       LYS  13   3.479   0.076  10.740
  410    HB2  LYS  13           HB2      LYS  13   4.818   2.245   9.110
  411    HB3  LYS  13           HB1      LYS  13   4.318   2.412  10.793
  412    HG2  LYS  13           HG2      LYS  13   6.269   0.324   9.782
  413    HG3  LYS  13           HG1      LYS  13   6.743   1.838  10.548
  414    HD2  LYS  13           HD2      LYS  13   5.219   1.068  12.515
  415    HD3  LYS  13           HD1      LYS  13   5.315  -0.528  11.772
  416    HE2  LYS  13           HE2      LYS  13   7.673   1.146  12.647
  417    HE3  LYS  13           HE1      LYS  13   7.050  -0.287  13.464
  418    HZ1  LYS  13           HZ1      LYS  13   8.914  -0.848  12.053
  419    HZ2  LYS  13           HZ2      LYS  13   8.125  -0.195  10.698
  420    HZ3  LYS  13           HZ3      LYS  13   7.499  -1.576  11.466
  421    H    LEU  14           HN       LEU  14   2.815   1.523   7.594
  422    HA   LEU  14           HA       LEU  14   0.664   3.158   8.416
  423    HB2  LEU  14           HB2      LEU  14   1.367   1.903   5.761
  424    HB3  LEU  14           HB1      LEU  14   0.013   3.015   5.963
  425    HG   LEU  14           HG       LEU  14   2.851   3.692   6.792
  426   HD11  LEU  14          HD11      LEU  14   1.403   4.341   4.205
  427   HD12  LEU  14          HD12      LEU  14   2.817   3.302   4.374
  428   HD13  LEU  14          HD13      LEU  14   2.949   5.029   4.697
  429   HD21  LEU  14          HD21      LEU  14   0.238   5.196   6.609
  430   HD22  LEU  14          HD22      LEU  14   1.755   6.070   6.384
  431   HD23  LEU  14          HD23      LEU  14   1.447   5.220   7.894
  432    H    LEU  15           HN       LEU  15   0.782  -0.165   7.228
  433    HA   LEU  15           HA       LEU  15  -2.017  -0.579   7.143
  434    HB2  LEU  15           HB2      LEU  15   0.300  -2.499   7.428
  435    HB3  LEU  15           HB1      LEU  15  -1.376  -3.015   7.220
  436    HG   LEU  15           HG       LEU  15   0.046  -1.137   5.311
  437   HD11  LEU  15          HD11      LEU  15  -0.441  -4.109   5.000
  438   HD12  LEU  15          HD12      LEU  15   1.120  -3.380   5.376
  439   HD13  LEU  15          HD13      LEU  15   0.339  -3.046   3.830
  440   HD21  LEU  15          HD21      LEU  15  -2.669  -2.442   5.393
  441   HD22  LEU  15          HD22      LEU  15  -1.905  -2.191   3.821
  442   HD23  LEU  15          HD23      LEU  15  -2.223  -0.816   4.873
  443    H    ASP  16           HN       ASP  16   0.392  -1.052   9.666
  444    HA   ASP  16           HA       ASP  16  -1.259  -2.377  11.528
  445    HB2  ASP  16           HB2      ASP  16   1.190  -0.642  11.868
  446    HB3  ASP  16           HB1      ASP  16   0.404  -1.469  13.212
  447    H    ASP  17           HN       ASP  17  -0.726   1.021  10.826
  448    HA   ASP  17           HA       ASP  17  -2.060   2.107  13.065
  449    HB2  ASP  17           HB2      ASP  17  -1.543   3.212  10.299
  450    HB3  ASP  17           HB1      ASP  17  -2.301   4.147  11.589
  451    H    SER  18           HN       SER  18  -3.254   0.293  10.503
  452    HA   SER  18           HA       SER  18  -5.678   1.499   9.881
  453    HB2  SER  18           HB2      SER  18  -6.416  -0.720   9.185
  454    HB3  SER  18           HB1      SER  18  -4.733  -0.485   8.718
  455    HG   SER  18           HG       SER  18  -4.298  -2.151   9.901
  456    H    SER  19           HN       SER  19  -4.734  -0.368  12.636
  457    HA   SER  19           HA       SER  19  -7.465  -0.454  13.691
  458    HB2  SER  19           HB2      SER  19  -4.868  -1.500  14.821
  459    HB3  SER  19           HB1      SER  19  -6.442  -1.688  15.588
  460    HG   SER  19           HG       SER  19  -6.089  -2.444  12.906
  461    H    SER  20           HN       SER  20  -4.817   1.582  13.762
  462    HA   SER  20           HA       SER  20  -5.258   2.692  16.406
  463    HB2  SER  20           HB2      SER  20  -3.508   4.249  15.868
  464    HB3  SER  20           HB1      SER  20  -3.008   2.657  15.305
  465    HG   SER  20           HG       SER  20  -4.447   4.318  13.574
  466    H2   ZBR 100           HA3      TBS 100  -1.445   0.515  -2.064
  467    H4   ZBR 100           HC3      TBS 100   0.450   1.165   1.769
  468    H6   ZBR 100           HB3      TBS 100   2.761  -0.356  -1.563
  469    H7   ZBR 100          HB11      TBS 100   1.536   0.117  -3.907
  470    H7A  ZBR 100          HB12      TBS 100  -0.201  -0.210  -3.903
  471    H8   ZBR 100          HA11      TBS 100  -2.366   2.124  -0.147
  472    H8A  ZBR 100          HA12      TBS 100  -1.797   1.750   1.487
  473    H9   ZBR 100          HC11      TBS 100   3.122   1.307   1.534
  474    H9A  ZBR 100          HC12      TBS 100   3.833   0.087   0.470
  Start of MODEL    9
    1    H1   LYS   1           HN       LYS   1  -6.461   5.056  16.818
    2    HA   LYS   1           HA       LYS   1  -8.455   5.829  14.892
    3    HB2  LYS   1           HB2      LYS   1  -7.554   7.329  17.363
    4    HB3  LYS   1           HB1      LYS   1  -9.093   7.495  16.522
    5    HG2  LYS   1           HG2      LYS   1  -8.156   4.940  17.860
    6    HG3  LYS   1           HG1      LYS   1  -9.245   6.107  18.611
    7    HD2  LYS   1           HD2      LYS   1 -10.794   5.805  16.639
    8    HD3  LYS   1           HD1      LYS   1  -9.749   4.497  16.092
    9    HE2  LYS   1           HE2      LYS   1 -11.575   3.550  17.357
   10    HE3  LYS   1           HE1      LYS   1 -10.077   3.358  18.271
   11    HZ1  LYS   1           HZ1      LYS   1 -10.634   5.172  19.651
   12    HZ2  LYS   1           HZ2      LYS   1 -12.026   4.202  19.565
   13    HZ3  LYS   1           HZ3      LYS   1 -11.930   5.636  18.659
   14    H    ASN   2           HN       ASN   2  -5.344   6.101  14.634
   15    HA   ASN   2           HA       ASN   2  -4.811   8.793  14.354
   16    HB2  ASN   2           HB2      ASN   2  -3.154   6.848  14.359
   17    HB3  ASN   2           HB1      ASN   2  -3.471   6.733  12.630
   18   HD21  ASN   2          HD21      ASN   2  -1.840   7.827  11.506
   19   HD22  ASN   2          HD22      ASN   2  -1.132   9.291  11.987
   20    HA   PRO   3           HA       PRO   3  -7.166   9.912  10.675
   21    HB2  PRO   3           HB2      PRO   3  -4.826  11.700  10.081
   22    HB3  PRO   3           HB1      PRO   3  -6.550  12.104  10.198
   23    HG2  PRO   3           HG2      PRO   3  -4.850  12.757  12.136
   24    HG3  PRO   3           HG1      PRO   3  -6.502  12.227  12.501
   25    HD2  PRO   3           HD2      PRO   3  -3.928  10.729  12.782
   26    HD3  PRO   3           HD1      PRO   3  -5.399  10.694  13.778
   27    H    GLU   4           HN       GLU   4  -3.825   8.900  10.556
   28    HA   GLU   4           HA       GLU   4  -3.457   8.742   7.765
   29    HB2  GLU   4           HB2      GLU   4  -2.237   7.138  10.014
   30    HB3  GLU   4           HB1      GLU   4  -1.701   7.041   8.339
   31    HG2  GLU   4           HG2      GLU   4  -1.179   9.429   8.328
   32    HG3  GLU   4           HG1      GLU   4  -1.781   9.594   9.976
   33    H    ALA   5           HN       ALA   5  -5.447   6.946   9.852
   34    HA   ALA   5           HA       ALA   5  -5.460   4.399   8.682
   35    HB1  ALA   5           HB1      ALA   5  -7.650   4.120   9.689
   36    HB2  ALA   5           HB2      ALA   5  -7.836   5.866   9.853
   37    HB3  ALA   5           HB3      ALA   5  -6.621   5.016  10.808
   38    H    GLU   6           HN       GLU   6  -6.788   7.429   7.605
   39    HA   GLU   6           HA       GLU   6  -8.724   6.495   5.786
   40    HB2  GLU   6           HB2      GLU   6  -7.012   8.988   5.772
   41    HB3  GLU   6           HB1      GLU   6  -8.321   8.699   4.626
   42    HG2  GLU   6           HG2      GLU   6  -9.918   8.487   6.484
   43    HG3  GLU   6           HG1      GLU   6  -8.614   8.738   7.643
   44    H    GLU   7           HN       GLU   7  -5.235   6.963   5.472
   45    HA   GLU   7           HA       GLU   7  -5.045   6.594   2.690
   46    HB2  GLU   7           HB2      GLU   7  -3.224   7.457   4.209
   47    HB3  GLU   7           HB1      GLU   7  -2.970   5.793   4.735
   48    HG2  GLU   7           HG2      GLU   7  -1.396   6.269   2.955
   49    HG3  GLU   7           HG1      GLU   7  -2.610   5.152   2.333
   50    H    ILE   8           HN       ILE   8  -5.051   4.314   5.372
   51    HA   ILE   8           HA       ILE   8  -4.390   1.991   3.904
   52    HB   ILE   8           HB       ILE   8  -5.858   2.456   6.505
   53   HG12  ILE   8          HG12      ILE   8  -3.833   1.393   7.429
   54   HG13  ILE   8          HG11      ILE   8  -3.218   1.125   5.799
   55   HG21  ILE   8          HG21      ILE   8  -6.912   0.470   5.747
   56   HG22  ILE   8          HG22      ILE   8  -5.578  -0.119   6.732
   57   HG23  ILE   8          HG23      ILE   8  -5.444  -0.122   4.977
   58   HD11  ILE   8          HD11      ILE   8  -2.886   3.433   5.417
   59   HD12  ILE   8          HD12      ILE   8  -2.350   3.203   7.078
   60   HD13  ILE   8          HD13      ILE   8  -3.937   3.899   6.755
   61    H    THR   9           HN       THR   9  -7.475   3.564   4.634
   62    HA   THR   9           HA       THR   9  -9.188   1.589   3.599
   63    HB   THR   9           HB       THR   9  -9.545   4.596   3.651
   64    HG1  THR   9           HG1      THR   9 -10.011   2.492   5.457
   65   HG21  THR   9          HG21      THR   9 -11.144   3.689   2.123
   66   HG22  THR   9          HG22      THR   9 -11.997   3.925   3.647
   67   HG23  THR   9          HG23      THR   9 -11.466   2.311   3.174
   68    H    ARG  10           HN       ARG  10  -7.537   4.307   2.039
   69    HA   ARG  10           HA       ARG  10  -8.693   4.022  -0.530
   70    HB2  ARG  10           HB2      ARG  10  -6.059   5.159   0.412
   71    HB3  ARG  10           HB1      ARG  10  -6.567   5.200  -1.276
   72    HG2  ARG  10           HG2      ARG  10  -8.485   6.530  -0.765
   73    HG3  ARG  10           HG1      ARG  10  -8.281   6.276   0.969
   74    HD2  ARG  10           HD2      ARG  10  -7.481   8.517   0.202
   75    HD3  ARG  10           HD1      ARG  10  -6.226   7.558   0.972
   76    HE   ARG  10           HE       ARG  10  -5.133   7.381  -1.084
   77   HH11  ARG  10          HH11      ARG  10  -4.824   8.035  -3.238
   78   HH12  ARG  10          HH12      ARG  10  -6.095   8.853  -4.084
   79   HH21  ARG  10          HH21      ARG  10  -8.294   8.759  -1.404
   80   HH22  ARG  10          HH22      ARG  10  -8.062   9.263  -3.045
   81    H    CYS  11           HN       CYS  11  -5.839   2.569   0.981
   82    HA   CYS  11           HA       CYS  11  -4.791   1.282  -1.286
   83    HB2  CYS  11           HB2      CYS  11  -4.650   0.717   1.660
   84    HB3  CYS  11           HB1      CYS  11  -3.908  -0.375   0.493
   85    H    LYS  12           HN       LYS  12  -7.240   0.236   1.060
   86    HA   LYS  12           HA       LYS  12  -7.561  -2.399   0.129
   87    HB2  LYS  12           HB2      LYS  12  -8.522  -1.540   2.249
   88    HB3  LYS  12           HB1      LYS  12  -9.664  -0.571   1.317
   89    HG2  LYS  12           HG2      LYS  12 -10.605  -2.599   0.310
   90    HG3  LYS  12           HG1      LYS  12  -9.435  -3.592   1.179
   91    HD2  LYS  12           HD2      LYS  12 -10.361  -2.797   3.325
   92    HD3  LYS  12           HD1      LYS  12 -11.542  -1.821   2.449
   93    HE2  LYS  12           HE2      LYS  12 -12.459  -3.864   1.408
   94    HE3  LYS  12           HE1      LYS  12 -11.279  -4.837   2.285
   95    HZ1  LYS  12           HZ1      LYS  12 -13.665  -4.459   3.234
   96    HZ2  LYS  12           HZ2      LYS  12 -12.993  -3.005   3.799
   97    HZ3  LYS  12           HZ3      LYS  12 -12.320  -4.492   4.268
   98    H    LYS  13           HN       LYS  13  -9.212   0.608  -0.797
   99    HA   LYS  13           HA       LYS  13 -10.939  -0.558  -2.720
  100    HB2  LYS  13           HB2      LYS  13 -11.297   1.694  -1.765
  101    HB3  LYS  13           HB1      LYS  13  -9.867   2.270  -2.623
  102    HG2  LYS  13           HG2      LYS  13 -10.904   1.690  -4.779
  103    HG3  LYS  13           HG1      LYS  13 -12.322   1.061  -3.938
  104    HD2  LYS  13           HD2      LYS  13 -12.743   3.296  -2.980
  105    HD3  LYS  13           HD1      LYS  13 -11.332   3.924  -3.831
  106    HE2  LYS  13           HE2      LYS  13 -12.355   3.330  -5.990
  107    HE3  LYS  13           HE1      LYS  13 -13.764   2.681  -5.151
  108    HZ1  LYS  13           HZ1      LYS  13 -13.288   5.259  -4.186
  109    HZ2  LYS  13           HZ2      LYS  13 -14.613   4.707  -5.095
  110    HZ3  LYS  13           HZ3      LYS  13 -13.244   5.336  -5.880
  111    H    LEU  14           HN       LEU  14  -7.686   0.810  -2.920
  112    HA   LEU  14           HA       LEU  14  -7.427   0.779  -5.718
  113    HB2  LEU  14           HB2      LEU  14  -5.457   0.639  -3.442
  114    HB3  LEU  14           HB1      LEU  14  -4.913   0.600  -5.118
  115    HG   LEU  14           HG       LEU  14  -6.798   2.768  -4.160
  116   HD11  LEU  14          HD11      LEU  14  -5.037   3.118  -2.641
  117   HD12  LEU  14          HD12      LEU  14  -4.589   4.153  -3.992
  118   HD13  LEU  14          HD13      LEU  14  -3.807   2.584  -3.784
  119   HD21  LEU  14          HD21      LEU  14  -4.822   2.440  -6.442
  120   HD22  LEU  14          HD22      LEU  14  -5.492   4.007  -6.002
  121   HD23  LEU  14          HD23      LEU  14  -6.561   2.720  -6.550
  122    H    LEU  15           HN       LEU  15  -6.714  -1.685  -3.290
  123    HA   LEU  15           HA       LEU  15  -5.549  -3.560  -5.054
  124    HB2  LEU  15           HB2      LEU  15  -6.995  -3.895  -2.420
  125    HB3  LEU  15           HB1      LEU  15  -6.176  -5.216  -3.256
  126    HG   LEU  15           HG       LEU  15  -4.823  -2.615  -2.488
  127   HD11  LEU  15          HD11      LEU  15  -3.764  -3.945  -0.672
  128   HD12  LEU  15          HD12      LEU  15  -4.833  -5.289  -1.068
  129   HD13  LEU  15          HD13      LEU  15  -5.508  -3.777  -0.459
  130   HD21  LEU  15          HD21      LEU  15  -3.446  -3.500  -4.130
  131   HD22  LEU  15          HD22      LEU  15  -3.919  -5.166  -3.800
  132   HD23  LEU  15          HD23      LEU  15  -2.792  -4.334  -2.726
  133    H    ASP  16           HN       ASP  16  -8.879  -3.009  -4.023
  134    HA   ASP  16           HA       ASP  16 -10.025  -5.265  -5.283
  135    HB2  ASP  16           HB2      ASP  16 -11.166  -2.583  -4.497
  136    HB3  ASP  16           HB1      ASP  16 -12.144  -3.872  -5.196
  137    H    ASP  17           HN       ASP  17  -9.307  -2.014  -6.414
  138    HA   ASP  17           HA       ASP  17 -10.667  -2.162  -8.888
  139    HB2  ASP  17           HB2      ASP  17  -8.328  -0.486  -7.968
  140    HB3  ASP  17           HB1      ASP  17  -9.079  -0.308  -9.552
  141    H    SER  18           HN       SER  18  -7.966  -3.823  -7.769
  142    HA   SER  18           HA       SER  18  -6.297  -3.948  -9.991
  143    HB2  SER  18           HB2      SER  18  -5.467  -6.041  -9.043
  144    HB3  SER  18           HB1      SER  18  -5.737  -4.865  -7.759
  145    HG   SER  18           HG       SER  18  -7.634  -6.810  -8.577
  146    H    SER  19           HN       SER  19  -9.283  -5.549  -9.320
  147    HA   SER  19           HA       SER  19  -9.064  -7.336 -11.603
  148    HB2  SER  19           HB2      SER  19 -11.332  -6.805  -9.685
  149    HB3  SER  19           HB1      SER  19 -11.400  -7.985 -10.990
  150    HG   SER  19           HG       SER  19 -10.283  -9.287  -9.788
  151    H    SER  20           HN       SER  20 -10.136  -4.201 -11.003
  152    HA   SER  20           HA       SER  20 -12.031  -4.054 -13.197
  153    HB2  SER  20           HB2      SER  20 -12.094  -2.638 -11.056
  154    HB3  SER  20           HB1      SER  20 -10.806  -1.687 -11.792
  155    HG   SER  20           HG       SER  20 -13.282  -1.295 -12.178
  156    H1   LYS   1           HN       LYS   1 -11.749  -2.855 -15.113
  157    HA   LYS   1           HA       LYS   1  -9.094  -3.027 -16.227
  158    HB2  LYS   1           HB2      LYS   1 -11.559  -1.767 -17.451
  159    HB3  LYS   1           HB1      LYS   1 -10.136  -2.368 -18.295
  160    HG2  LYS   1           HG2      LYS   1 -11.973  -4.122 -16.640
  161    HG3  LYS   1           HG1      LYS   1 -12.102  -3.939 -18.389
  162    HD2  LYS   1           HD2      LYS   1  -9.697  -4.700 -18.556
  163    HD3  LYS   1           HD1      LYS   1  -9.759  -5.067 -16.834
  164    HE2  LYS   1           HE2      LYS   1 -10.233  -7.084 -18.094
  165    HE3  LYS   1           HE1      LYS   1 -11.688  -6.566 -17.239
  166    HZ1  LYS   1           HZ1      LYS   1 -12.579  -5.655 -19.205
  167    HZ2  LYS   1           HZ2      LYS   1 -11.998  -7.194 -19.631
  168    HZ3  LYS   1           HZ3      LYS   1 -11.110  -5.804 -20.042
  169    H    ASN   2           HN       ASN   2 -10.157  -0.996 -14.085
  170    HA   ASN   2           HA       ASN   2  -9.900   1.522 -15.182
  171    HB2  ASN   2           HB2      ASN   2 -10.766   0.894 -12.862
  172    HB3  ASN   2           HB1      ASN   2  -9.080   0.943 -12.353
  173   HD21  ASN   2          HD21      ASN   2  -8.660   2.951 -11.396
  174   HD22  ASN   2          HD22      ASN   2  -9.264   4.439 -11.941
  175    HA   PRO   3           HA       PRO   3  -5.494   1.785 -16.095
  176    HB2  PRO   3           HB2      PRO   3  -5.783   4.651 -15.245
  177    HB3  PRO   3           HB1      PRO   3  -5.132   3.985 -16.757
  178    HG2  PRO   3           HG2      PRO   3  -7.539   5.109 -16.677
  179    HG3  PRO   3           HG1      PRO   3  -7.225   3.680 -17.679
  180    HD2  PRO   3           HD2      PRO   3  -8.672   3.882 -15.069
  181    HD3  PRO   3           HD1      PRO   3  -8.974   2.843 -16.478
  182    H    GLU   4           HN       GLU   4  -6.864   2.871 -13.072
  183    HA   GLU   4           HA       GLU   4  -4.505   3.461 -11.648
  184    HB2  GLU   4           HB2      GLU   4  -7.186   2.442 -10.700
  185    HB3  GLU   4           HB1      GLU   4  -5.901   2.969  -9.617
  186    HG2  GLU   4           HG2      GLU   4  -5.902   5.192 -10.643
  187    HG3  GLU   4           HG1      GLU   4  -7.138   4.684 -11.792
  188    H    ALA   5           HN       ALA   5  -5.715   0.511 -12.822
  189    HA   ALA   5           HA       ALA   5  -4.855  -1.335 -10.892
  190    HB1  ALA   5           HB1      ALA   5  -4.882  -2.975 -12.681
  191    HB2  ALA   5           HB2      ALA   5  -4.823  -1.701 -13.898
  192    HB3  ALA   5           HB3      ALA   5  -6.255  -1.886 -12.885
  193    H    GLU   6           HN       GLU   6  -3.088   0.567 -13.209
  194    HA   GLU   6           HA       GLU   6  -0.708  -0.931 -13.358
  195    HB2  GLU   6           HB2      GLU   6  -1.220   2.039 -13.592
  196    HB3  GLU   6           HB1      GLU   6   0.349   1.299 -13.909
  197    HG2  GLU   6           HG2      GLU   6  -0.661  -0.125 -15.642
  198    HG3  GLU   6           HG1      GLU   6  -2.241   0.583 -15.312
  199    H    GLU   7           HN       GLU   7  -1.852   1.451 -11.013
  200    HA   GLU   7           HA       GLU   7   0.558   1.779  -9.595
  201    HB2  GLU   7           HB2      GLU   7  -1.500   3.220  -9.387
  202    HB3  GLU   7           HB1      GLU   7  -2.225   1.926  -8.432
  203    HG2  GLU   7           HG2      GLU   7  -1.231   3.519  -6.902
  204    HG3  GLU   7           HG1      GLU   7  -0.252   2.053  -6.877
  205    H    ILE   8           HN       ILE   8  -2.064  -0.552  -9.275
  206    HA   ILE   8           HA       ILE   8  -1.200  -1.779  -6.876
  207    HB   ILE   8           HB       ILE   8  -2.909  -2.709  -9.191
  208   HG12  ILE   8          HG12      ILE   8  -4.668  -2.620  -7.453
  209   HG13  ILE   8          HG11      ILE   8  -3.463  -2.150  -6.256
  210   HG21  ILE   8          HG21      ILE   8  -1.968  -4.768  -8.506
  211   HG22  ILE   8          HG22      ILE   8  -3.448  -4.667  -7.558
  212   HG23  ILE   8          HG23      ILE   8  -1.896  -4.281  -6.816
  213   HD11  ILE   8          HD11      ILE   8  -3.121  -0.040  -7.244
  214   HD12  ILE   8          HD12      ILE   8  -4.864  -0.271  -7.379
  215   HD13  ILE   8          HD13      ILE   8  -3.829  -0.538  -8.782
  216    H    THR   9           HN       THR   9  -0.434  -2.378 -10.279
  217    HA   THR   9           HA       THR   9   1.050  -4.742  -9.945
  218    HB   THR   9           HB       THR   9   1.402  -2.531 -11.983
  219    HG1  THR   9           HG1      THR   9  -0.181  -4.859 -11.814
  220   HG21  THR   9          HG21      THR   9   3.376  -3.859 -12.042
  221   HG22  THR   9          HG22      THR   9   2.351  -4.489 -13.332
  222   HG23  THR   9          HG23      THR   9   2.469  -5.351 -11.798
  223    H    ARG  10           HN       ARG  10   1.994  -1.331  -9.769
  224    HA   ARG  10           HA       ARG  10   4.777  -1.725  -9.441
  225    HB2  ARG  10           HB2      ARG  10   2.914   0.495  -8.595
  226    HB3  ARG  10           HB1      ARG  10   4.656   0.559  -8.332
  227    HG2  ARG  10           HG2      ARG  10   5.109   0.448 -10.678
  228    HG3  ARG  10           HG1      ARG  10   3.433   0.042 -11.049
  229    HD2  ARG  10           HD2      ARG  10   3.985   2.437 -11.501
  230    HD3  ARG  10           HD1      ARG  10   2.685   2.233 -10.336
  231    HE   ARG  10           HE       ARG  10   4.082   3.082  -8.666
  232   HH11  ARG  10          HH11      ARG  10   5.959   4.182  -8.011
  233   HH12  ARG  10          HH12      ARG  10   7.319   4.282  -9.077
  234   HH21  ARG  10          HH21      ARG  10   5.795   2.476 -11.615
  235   HH22  ARG  10          HH22      ARG  10   7.226   3.316 -11.120
  236    H    CYS  11           HN       CYS  11   2.098  -1.588  -7.129
  237    HA   CYS  11           HA       CYS  11   3.604  -1.606  -4.754
  238    HB2  CYS  11           HB2      CYS  11   0.841  -2.551  -5.463
  239    HB3  CYS  11           HB1      CYS  11   1.490  -2.793  -3.842
  240    H    LYS  12           HN       LYS  12   2.425  -4.266  -6.786
  241    HA   LYS  12           HA       LYS  12   3.188  -6.393  -5.118
  242    HB2  LYS  12           HB2      LYS  12   1.741  -6.634  -7.121
  243    HB3  LYS  12           HB1      LYS  12   3.144  -6.324  -8.146
  244    HG2  LYS  12           HG2      LYS  12   4.275  -8.303  -7.238
  245    HG3  LYS  12           HG1      LYS  12   2.914  -8.604  -6.158
  246    HD2  LYS  12           HD2      LYS  12   1.431  -8.880  -8.114
  247    HD3  LYS  12           HD1      LYS  12   2.802  -8.596  -9.188
  248    HE2  LYS  12           HE2      LYS  12   3.952 -10.567  -8.244
  249    HE3  LYS  12           HE1      LYS  12   2.581 -10.849  -7.172
  250    HZ1  LYS  12           HZ1      LYS  12   2.777 -12.035  -9.492
  251    HZ2  LYS  12           HZ2      LYS  12   2.048 -10.600 -10.035
  252    HZ3  LYS  12           HZ3      LYS  12   1.273 -11.562  -8.867
  253    H    LYS  13           HN       LYS  13   4.966  -4.724  -7.700
  254    HA   LYS  13           HA       LYS  13   7.328  -6.280  -7.506
  255    HB2  LYS  13           HB2      LYS  13   6.810  -4.857  -9.453
  256    HB3  LYS  13           HB1      LYS  13   7.024  -3.422  -8.451
  257    HG2  LYS  13           HG2      LYS  13   9.359  -4.049  -8.011
  258    HG3  LYS  13           HG1      LYS  13   9.156  -5.521  -8.963
  259    HD2  LYS  13           HD2      LYS  13   8.650  -4.160 -10.956
  260    HD3  LYS  13           HD1      LYS  13   8.865  -2.689 -10.004
  261    HE2  LYS  13           HE2      LYS  13  11.202  -3.333  -9.536
  262    HE3  LYS  13           HE1      LYS  13  10.987  -4.803 -10.487
  263    HZ1  LYS  13           HZ1      LYS  13  10.126  -2.645 -12.032
  264    HZ2  LYS  13           HZ2      LYS  13  11.472  -3.650 -12.294
  265    HZ3  LYS  13           HZ3      LYS  13  11.637  -2.226 -11.383
  266    H    LEU  14           HN       LEU  14   6.270  -3.305  -5.915
  267    HA   LEU  14           HA       LEU  14   8.692  -2.670  -4.643
  268    HB2  LEU  14           HB2      LEU  14   5.801  -2.095  -4.025
  269    HB3  LEU  14           HB1      LEU  14   7.087  -1.509  -2.973
  270    HG   LEU  14           HG       LEU  14   7.193  -1.002  -5.958
  271   HD11  LEU  14          HD11      LEU  14   5.104  -0.021  -5.492
  272   HD12  LEU  14          HD12      LEU  14   6.220   1.322  -5.267
  273   HD13  LEU  14          HD13      LEU  14   5.578   0.461  -3.865
  274   HD21  LEU  14          HD21      LEU  14   8.368   0.303  -3.478
  275   HD22  LEU  14          HD22      LEU  14   8.414   1.066  -5.064
  276   HD23  LEU  14          HD23      LEU  14   9.242  -0.467  -4.804
  277    H    LEU  15           HN       LEU  15   5.988  -4.697  -3.614
  278    HA   LEU  15           HA       LEU  15   6.949  -5.233  -1.011
  279    HB2  LEU  15           HB2      LEU  15   5.134  -6.798  -2.852
  280    HB3  LEU  15           HB1      LEU  15   5.439  -7.245  -1.173
  281    HG   LEU  15           HG       LEU  15   4.396  -4.532  -2.031
  282   HD11  LEU  15          HD11      LEU  15   2.201  -5.347  -1.175
  283   HD12  LEU  15          HD12      LEU  15   2.898  -6.960  -1.016
  284   HD13  LEU  15          HD13      LEU  15   2.743  -6.220  -2.610
  285   HD21  LEU  15          HD21      LEU  15   5.256  -4.178   0.101
  286   HD22  LEU  15          HD22      LEU  15   4.973  -5.840   0.619
  287   HD23  LEU  15          HD23      LEU  15   3.627  -4.703   0.510
  288    H    ASP  16           HN       ASP  16   7.437  -6.842  -4.110
  289    HA   ASP  16           HA       ASP  16   8.864  -9.078  -3.134
  290    HB2  ASP  16           HB2      ASP  16   8.854  -7.692  -5.815
  291    HB3  ASP  16           HB1      ASP  16   9.785  -9.154  -5.499
  292    H    ASP  17           HN       ASP  17   9.866  -5.844  -4.083
  293    HA   ASP  17           HA       ASP  17  12.659  -6.277  -4.026
  294    HB2  ASP  17           HB2      ASP  17  10.996  -3.778  -3.688
  295    HB3  ASP  17           HB1      ASP  17  12.758  -3.767  -3.723
  296    H    SER  18           HN       SER  18  10.391  -6.294  -1.541
  297    HA   SER  18           HA       SER  18  11.713  -5.046   0.564
  298    HB2  SER  18           HB2      SER  18  10.323  -6.400   2.029
  299    HB3  SER  18           HB1      SER  18   9.377  -5.889   0.633
  300    HG   SER  18           HG       SER  18  10.760  -8.358   0.814
  301    H    SER  19           HN       SER  19  12.190  -8.149  -0.888
  302    HA   SER  19           HA       SER  19  14.015  -9.052   1.192
  303    HB2  SER  19           HB2      SER  19  13.256 -10.234  -1.475
  304    HB3  SER  19           HB1      SER  19  14.392 -10.987  -0.362
  305    HG   SER  19           HG       SER  19  12.766 -11.621   0.805
  306    H    SER  20           HN       SER  20  14.196  -7.243  -1.649
  307    HA   SER  20           HA       SER  20  16.991  -7.782  -2.217
  308    HB2  SER  20           HB2      SER  20  15.204  -7.072  -3.928
  309    HB3  SER  20           HB1      SER  20  15.420  -5.444  -3.292
  310    HG   SER  20           HG       SER  20  16.825  -6.411  -5.137
  311    H1   LYS   1           HN       LYS   1  18.707  -6.327  -1.926
  312    HA   LYS   1           HA       LYS   1  18.563  -4.772   0.489
  313    HB2  LYS   1           HB2      LYS   1  20.808  -4.862  -1.539
  314    HB3  LYS   1           HB1      LYS   1  20.919  -4.410   0.159
  315    HG2  LYS   1           HG2      LYS   1  20.100  -7.162  -0.820
  316    HG3  LYS   1           HG1      LYS   1  21.728  -6.741  -0.290
  317    HD2  LYS   1           HD2      LYS   1  20.732  -6.039   1.925
  318    HD3  LYS   1           HD1      LYS   1  19.195  -6.698   1.374
  319    HE2  LYS   1           HE2      LYS   1  20.353  -8.363   2.704
  320    HE3  LYS   1           HE1      LYS   1  20.269  -8.893   1.024
  321    HZ1  LYS   1           HZ1      LYS   1  22.498  -8.270   0.663
  322    HZ2  LYS   1           HZ2      LYS   1  22.489  -9.133   2.127
  323    HZ3  LYS   1           HZ3      LYS   1  22.592  -7.438   2.139
  324    H    ASN   2           HN       ASN   2  17.223  -4.107  -2.264
  325    HA   ASN   2           HA       ASN   2  18.288  -1.700  -3.095
  326    HB2  ASN   2           HB2      ASN   2  16.530  -3.128  -4.268
  327    HB3  ASN   2           HB1      ASN   2  15.348  -2.280  -3.275
  328   HD21  ASN   2          HD21      ASN   2  14.446  -0.601  -4.491
  329   HD22  ASN   2          HD22      ASN   2  15.296   0.406  -5.556
  330    HA   PRO   3           HA       PRO   3  17.240   1.077   0.298
  331    HB2  PRO   3           HB2      PRO   3  16.831   3.108  -1.875
  332    HB3  PRO   3           HB1      PRO   3  17.861   3.196  -0.432
  333    HG2  PRO   3           HG2      PRO   3  18.908   2.794  -2.843
  334    HG3  PRO   3           HG1      PRO   3  19.562   1.983  -1.408
  335    HD2  PRO   3           HD2      PRO   3  17.849   0.872  -3.595
  336    HD3  PRO   3           HD1      PRO   3  19.165   0.122  -2.664
  337    H    GLU   4           HN       GLU   4  15.201   0.665  -2.509
  338    HA   GLU   4           HA       GLU   4  12.955   2.166  -1.713
  339    HB2  GLU   4           HB2      GLU   4  13.167  -0.306  -3.432
  340    HB3  GLU   4           HB1      GLU   4  11.687   0.629  -3.241
  341    HG2  GLU   4           HG2      GLU   4  12.800   2.632  -4.105
  342    HG3  GLU   4           HG1      GLU   4  14.321   1.752  -4.246
  343    H    ALA   5           HN       ALA   5  14.286  -0.685  -0.435
  344    HA   ALA   5           HA       ALA   5  12.030  -2.083   0.471
  345    HB1  ALA   5           HB1      ALA   5  13.515  -3.100   2.104
  346    HB2  ALA   5           HB2      ALA   5  14.694  -1.807   1.883
  347    HB3  ALA   5           HB3      ALA   5  14.370  -2.938   0.570
  348    H    GLU   6           HN       GLU   6  13.511   0.863   1.581
  349    HA   GLU   6           HA       GLU   6  12.505   0.957   4.208
  350    HB2  GLU   6           HB2      GLU   6  13.167   3.159   2.242
  351    HB3  GLU   6           HB1      GLU   6  12.734   3.457   3.926
  352    HG2  GLU   6           HG2      GLU   6  14.617   2.063   4.672
  353    HG3  GLU   6           HG1      GLU   6  15.038   1.720   2.995
  354    H    GLU   7           HN       GLU   7  11.074   1.854   1.103
  355    HA   GLU   7           HA       GLU   7   8.794   3.173   2.096
  356    HB2  GLU   7           HB2      GLU   7   9.599   3.182  -0.295
  357    HB3  GLU   7           HB1      GLU   7   8.946   1.551  -0.448
  358    HG2  GLU   7           HG2      GLU   7   7.271   3.110  -1.245
  359    HG3  GLU   7           HG1      GLU   7   6.714   2.442   0.287
  360    H    ILE   8           HN       ILE   8   9.441  -0.225   1.415
  361    HA   ILE   8           HA       ILE   8   6.816  -1.200   1.803
  362    HB   ILE   8           HB       ILE   8   9.556  -2.456   2.017
  363   HG12  ILE   8          HG12      ILE   8   8.734  -3.698   0.032
  364   HG13  ILE   8          HG11      ILE   8   7.192  -2.851   0.150
  365   HG21  ILE   8          HG21      ILE   8   8.382  -3.743   3.615
  366   HG22  ILE   8          HG22      ILE   8   8.164  -4.658   2.128
  367   HG23  ILE   8          HG23      ILE   8   6.865  -3.634   2.731
  368   HD11  ILE   8          HD11      ILE   8   8.145  -0.774  -0.429
  369   HD12  ILE   8          HD12      ILE   8   8.961  -1.913  -1.501
  370   HD13  ILE   8          HD13      ILE   8   9.782  -1.315  -0.058
  371    H    THR   9           HN       THR   9   9.513  -0.646   4.029
  372    HA   THR   9           HA       THR   9   8.384  -1.818   6.323
  373    HB   THR   9           HB       THR   9  10.257   0.551   6.109
  374    HG1  THR   9           HG1      THR   9  10.574  -2.246   6.207
  375   HG21  THR   9          HG21      THR   9   9.334   0.543   8.312
  376   HG22  THR   9          HG22      THR   9  10.907  -0.245   8.439
  377   HG23  THR   9          HG23      THR   9   9.434  -1.214   8.419
  378    H    ARG  10           HN       ARG  10   8.104   1.448   4.980
  379    HA   ARG  10           HA       ARG  10   6.594   2.589   7.084
  380    HB2  ARG  10           HB2      ARG  10   6.805   3.224   4.140
  381    HB3  ARG  10           HB1      ARG  10   5.829   4.181   5.254
  382    HG2  ARG  10           HG2      ARG  10   7.742   4.774   6.566
  383    HG3  ARG  10           HG1      ARG  10   8.757   3.596   5.732
  384    HD2  ARG  10           HD2      ARG  10   9.110   5.948   4.945
  385    HD3  ARG  10           HD1      ARG  10   8.615   4.848   3.666
  386    HE   ARG  10           HE       ARG  10   6.575   5.978   3.520
  387   HH11  ARG  10          HH11      ARG  10   5.251   7.765   3.981
  388   HH12  ARG  10          HH12      ARG  10   5.620   8.791   5.328
  389   HH21  ARG  10          HH21      ARG  10   8.422   6.980   6.274
  390   HH22  ARG  10          HH22      ARG  10   7.417   8.345   6.627
  391    H    CYS  11           HN       CYS  11   5.664   0.803   4.172
  392    HA   CYS  11           HA       CYS  11   2.878   1.172   4.337
  393    HB2  CYS  11           HB2      CYS  11   4.622  -0.964   3.149
  394    HB3  CYS  11           HB1      CYS  11   2.868  -1.128   3.135
  395    H    LYS  12           HN       LYS  12   4.995  -1.276   5.796
  396    HA   LYS  12           HA       LYS  12   2.992  -2.903   6.906
  397    HB2  LYS  12           HB2      LYS  12   5.393  -3.522   6.784
  398    HB3  LYS  12           HB1      LYS  12   5.747  -2.316   8.021
  399    HG2  LYS  12           HG2      LYS  12   4.279  -3.483   9.608
  400    HG3  LYS  12           HG1      LYS  12   3.872  -4.674   8.372
  401    HD2  LYS  12           HD2      LYS  12   6.246  -5.338   8.238
  402    HD3  LYS  12           HD1      LYS  12   6.643  -4.157   9.488
  403    HE2  LYS  12           HE2      LYS  12   5.139  -5.320  11.064
  404    HE3  LYS  12           HE1      LYS  12   4.745  -6.500   9.815
  405    HZ1  LYS  12           HZ1      LYS  12   6.655  -6.917  11.555
  406    HZ2  LYS  12           HZ2      LYS  12   7.569  -6.050  10.415
  407    HZ3  LYS  12           HZ3      LYS  12   6.771  -7.479   9.960
  408    H    LYS  13           HN       LYS  13   4.700  -0.091   8.241
  409    HA   LYS  13           HA       LYS  13   3.403  -0.102  10.763
  410    HB2  LYS  13           HB2      LYS  13   5.492   1.137  10.330
  411    HB3  LYS  13           HB1      LYS  13   4.611   2.239   9.271
  412    HG2  LYS  13           HG2      LYS  13   3.171   2.918  11.151
  413    HG3  LYS  13           HG1      LYS  13   4.013   1.789  12.213
  414    HD2  LYS  13           HD2      LYS  13   6.125   3.007  11.829
  415    HD3  LYS  13           HD1      LYS  13   5.275   4.140  10.778
  416    HE2  LYS  13           HE2      LYS  13   3.822   4.804  12.655
  417    HE3  LYS  13           HE1      LYS  13   4.659   3.665  13.710
  418    HZ1  LYS  13           HZ1      LYS  13   6.582   5.247  12.448
  419    HZ2  LYS  13           HZ2      LYS  13   6.178   5.205  14.098
  420    HZ3  LYS  13           HZ3      LYS  13   5.390   6.290  13.055
  421    H    LEU  14           HN       LEU  14   2.653   1.444   7.674
  422    HA   LEU  14           HA       LEU  14   0.528   3.055   8.557
  423    HB2  LEU  14           HB2      LEU  14   1.240   1.820   5.903
  424    HB3  LEU  14           HB1      LEU  14  -0.204   2.813   6.086
  425    HG   LEU  14           HG       LEU  14   2.491   3.827   7.024
  426   HD11  LEU  14          HD11      LEU  14   3.028   3.413   4.774
  427   HD12  LEU  14          HD12      LEU  14   2.444   5.071   4.722
  428   HD13  LEU  14          HD13      LEU  14   1.392   3.748   4.211
  429   HD21  LEU  14          HD21      LEU  14  -0.149   5.079   6.198
  430   HD22  LEU  14          HD22      LEU  14   1.327   6.023   6.369
  431   HD23  LEU  14          HD23      LEU  14   0.654   5.188   7.766
  432    H    LEU  15           HN       LEU  15   0.584  -0.270   7.365
  433    HA   LEU  15           HA       LEU  15  -2.213  -0.662   7.342
  434    HB2  LEU  15           HB2      LEU  15   0.092  -2.593   7.660
  435    HB3  LEU  15           HB1      LEU  15  -1.587  -3.102   7.476
  436    HG   LEU  15           HG       LEU  15  -0.150  -1.301   5.507
  437   HD11  LEU  15          HD11      LEU  15  -0.088  -3.352   4.059
  438   HD12  LEU  15          HD12      LEU  15  -0.590  -4.295   5.461
  439   HD13  LEU  15          HD13      LEU  15   0.957  -3.450   5.478
  440   HD21  LEU  15          HD21      LEU  15  -2.402  -0.941   5.072
  441   HD22  LEU  15          HD22      LEU  15  -2.891  -2.536   5.641
  442   HD23  LEU  15          HD23      LEU  15  -2.128  -2.354   4.059
  443    H    ASP  16           HN       ASP  16   0.235  -1.143   9.838
  444    HA   ASP  16           HA       ASP  16  -1.442  -2.367  11.756
  445    HB2  ASP  16           HB2      ASP  16   1.092  -0.746  12.015
  446    HB3  ASP  16           HB1      ASP  16   0.288  -1.491  13.395
  447    H    ASP  17           HN       ASP  17  -0.742   0.999  11.012
  448    HA   ASP  17           HA       ASP  17  -2.025   2.157  13.251
  449    HB2  ASP  17           HB2      ASP  17  -1.421   3.230  10.491
  450    HB3  ASP  17           HB1      ASP  17  -2.138   4.207  11.772
  451    H    SER  18           HN       SER  18  -3.288   0.441  10.648
  452    HA   SER  18           HA       SER  18  -5.649   1.783  10.048
  453    HB2  SER  18           HB2      SER  18  -6.474  -0.356   9.247
  454    HB3  SER  18           HB1      SER  18  -4.766  -0.206   8.843
  455    HG   SER  18           HG       SER  18  -5.746  -1.476  11.179
  456    H    SER  19           HN       SER  19  -4.808  -0.206  12.744
  457    HA   SER  19           HA       SER  19  -7.529  -0.328  13.756
  458    HB2  SER  19           HB2      SER  19  -4.902  -1.211  14.945
  459    HB3  SER  19           HB1      SER  19  -6.460  -1.422  15.740
  460    HG   SER  19           HG       SER  19  -6.834  -3.050  14.471
  461    H    SER  20           HN       SER  20  -4.903   1.775  13.960
  462    HA   SER  20           HA       SER  20  -5.612   2.968  16.510
  463    HB2  SER  20           HB2      SER  20  -3.258   2.888  15.490
  464    HB3  SER  20           HB1      SER  20  -3.795   4.199  14.444
  465    HG   SER  20           HG       SER  20  -2.816   4.538  16.747
  466    H2   ZBR 100           HA3      TBS 100  -1.886   0.050  -1.288
  467    H4   ZBR 100           HC3      TBS 100   0.985   0.304   1.942
  468    H6   ZBR 100           HB3      TBS 100   2.247  -1.040  -1.983
  469    H7   ZBR 100          HB11      TBS 100  -1.065  -0.182  -3.509
  470    H7A  ZBR 100          HB12      TBS 100  -0.550  -1.854  -3.304
  471    H8   ZBR 100          HA11      TBS 100  -1.135   1.321   2.164
  472    H8A  ZBR 100          HA12      TBS 100  -2.088  -0.130   1.862
  473    H9   ZBR 100          HC11      TBS 100   3.866  -0.452  -0.333
  474    H9A  ZBR 100          HC12      TBS 100   3.304  -1.568   0.911
  Start of MODEL   10
    1    H1   LYS   1           HN       LYS   1  -7.370   5.171  16.882
    2    HA   LYS   1           HA       LYS   1  -9.498   5.711  15.037
    3    HB2  LYS   1           HB2      LYS   1  -8.632   7.105  17.577
    4    HB3  LYS   1           HB1      LYS   1 -10.090   7.508  16.672
    5    HG2  LYS   1           HG2      LYS   1 -10.907   5.193  16.951
    6    HG3  LYS   1           HG1      LYS   1  -9.452   4.796  17.867
    7    HD2  LYS   1           HD2      LYS   1 -10.040   6.496  19.554
    8    HD3  LYS   1           HD1      LYS   1 -11.495   6.898  18.642
    9    HE2  LYS   1           HE2      LYS   1 -12.325   4.599  18.928
   10    HE3  LYS   1           HE1      LYS   1 -10.867   4.176  19.825
   11    HZ1  LYS   1           HZ1      LYS   1 -12.342   4.693  21.493
   12    HZ2  LYS   1           HZ2      LYS   1 -13.086   5.942  20.613
   13    HZ3  LYS   1           HZ3      LYS   1 -11.544   6.176  21.287
   14    H    ASN   2           HN       ASN   2  -6.460   6.334  14.557
   15    HA   ASN   2           HA       ASN   2  -6.187   9.080  14.268
   16    HB2  ASN   2           HB2      ASN   2  -4.305   8.582  12.794
   17    HB3  ASN   2           HB1      ASN   2  -4.313   7.466  14.141
   18   HD21  ASN   2          HD21      ASN   2  -3.119   6.967  11.484
   19   HD22  ASN   2          HD22      ASN   2  -3.942   5.632  10.839
   20    HA   PRO   3           HA       PRO   3  -8.782  10.030  10.811
   21    HB2  PRO   3           HB2      PRO   3  -7.420  12.181   9.745
   22    HB3  PRO   3           HB1      PRO   3  -8.396  12.268  11.224
   23    HG2  PRO   3           HG2      PRO   3  -5.434  11.982  10.926
   24    HG3  PRO   3           HG1      PRO   3  -6.363  12.980  12.062
   25    HD2  PRO   3           HD2      PRO   3  -5.251  10.632  12.788
   26    HD3  PRO   3           HD1      PRO   3  -6.772  11.206  13.498
   27    H    GLU   4           HN       GLU   4  -5.406   9.369  10.324
   28    HA   GLU   4           HA       GLU   4  -5.344   9.345   7.502
   29    HB2  GLU   4           HB2      GLU   4  -3.666   7.896   9.562
   30    HB3  GLU   4           HB1      GLU   4  -3.331   7.853   7.833
   31    HG2  GLU   4           HG2      GLU   4  -1.988   9.636   8.552
   32    HG3  GLU   4           HG1      GLU   4  -3.426  10.473   7.989
   33    H    ALA   5           HN       ALA   5  -6.910   7.326   9.694
   34    HA   ALA   5           HA       ALA   5  -6.721   4.804   8.498
   35    HB1  ALA   5           HB1      ALA   5  -8.958   4.389   9.554
   36    HB2  ALA   5           HB2      ALA   5  -9.015   6.098   9.990
   37    HB3  ALA   5           HB3      ALA   5  -7.762   5.057  10.665
   38    H    GLU   6           HN       GLU   6  -8.606   7.638   7.636
   39    HA   GLU   6           HA       GLU   6 -10.444   6.418   5.874
   40    HB2  GLU   6           HB2      GLU   6  -9.261   9.200   5.944
   41    HB3  GLU   6           HB1      GLU   6 -10.541   8.721   4.828
   42    HG2  GLU   6           HG2      GLU   6 -11.992   8.118   6.698
   43    HG3  GLU   6           HG1      GLU   6 -10.706   8.488   7.846
   44    H    GLU   7           HN       GLU   7  -7.167   7.666   5.382
   45    HA   GLU   7           HA       GLU   7  -7.104   7.335   2.579
   46    HB2  GLU   7           HB2      GLU   7  -5.486   8.715   3.926
   47    HB3  GLU   7           HB1      GLU   7  -4.745   7.201   4.447
   48    HG2  GLU   7           HG2      GLU   7  -3.515   8.060   2.529
   49    HG3  GLU   7           HG1      GLU   7  -4.376   6.597   2.052
   50    H    ILE   8           HN       ILE   8  -6.417   5.208   5.272
   51    HA   ILE   8           HA       ILE   8  -5.179   3.085   3.841
   52    HB   ILE   8           HB       ILE   8  -6.962   2.889   6.290
   53   HG12  ILE   8          HG12      ILE   8  -5.188   4.542   6.638
   54   HG13  ILE   8          HG11      ILE   8  -4.816   3.081   7.546
   55   HG21  ILE   8          HG21      ILE   8  -4.895   1.091   5.010
   56   HG22  ILE   8          HG22      ILE   8  -6.551   0.695   5.468
   57   HG23  ILE   8          HG23      ILE   8  -5.327   0.939   6.703
   58   HD11  ILE   8          HD11      ILE   8  -2.768   3.509   6.519
   59   HD12  ILE   8          HD12      ILE   8  -3.516   4.152   5.064
   60   HD13  ILE   8          HD13      ILE   8  -3.486   2.417   5.342
   61    H    THR   9           HN       THR   9  -8.571   3.867   4.472
   62    HA   THR   9           HA       THR   9  -9.728   1.505   3.433
   63    HB   THR   9           HB       THR   9 -10.798   4.338   3.416
   64    HG1  THR   9           HG1      THR   9 -10.906   2.177   5.228
   65   HG21  THR   9          HG21      THR   9 -13.013   3.008   3.408
   66   HG22  THR   9          HG22      THR   9 -12.043   1.650   2.836
   67   HG23  THR   9          HG23      THR   9 -12.133   3.134   1.885
   68    H    ARG  10           HN       ARG  10  -8.726   4.539   1.877
   69    HA   ARG  10           HA       ARG  10  -9.691   3.951  -0.732
   70    HB2  ARG  10           HB2      ARG  10  -7.431   5.686   0.269
   71    HB3  ARG  10           HB1      ARG  10  -7.860   5.579  -1.436
   72    HG2  ARG  10           HG2      ARG  10 -10.073   6.408  -1.017
   73    HG3  ARG  10           HG1      ARG  10  -9.852   6.280   0.729
   74    HD2  ARG  10           HD2      ARG  10  -9.593   8.615  -0.124
   75    HD3  ARG  10           HD1      ARG  10  -8.164   8.020   0.694
   76    HE   ARG  10           HE       ARG  10  -7.014   8.018  -1.343
   77   HH11  ARG  10          HH11      ARG  10  -6.836   8.649  -3.516
   78   HH12  ARG  10          HH12      ARG  10  -8.249   9.113  -4.403
   79   HH21  ARG  10          HH21      ARG  10 -10.409   8.604  -1.739
   80   HH22  ARG  10          HH22      ARG  10 -10.274   9.087  -3.395
   81    H    CYS  11           HN       CYS  11  -6.638   3.205   0.911
   82    HA   CYS  11           HA       CYS  11  -5.179   2.193  -1.249
   83    HB2  CYS  11           HB2      CYS  11  -4.374   2.565   1.128
   84    HB3  CYS  11           HB1      CYS  11  -5.149   1.039   1.543
   85    H    LYS  12           HN       LYS  12  -7.489   0.583   0.912
   86    HA   LYS  12           HA       LYS  12  -7.262  -2.009  -0.192
   87    HB2  LYS  12           HB2      LYS  12  -9.555  -0.636   1.234
   88    HB3  LYS  12           HB1      LYS  12  -9.536  -2.352   0.824
   89    HG2  LYS  12           HG2      LYS  12  -7.472  -2.655   2.136
   90    HG3  LYS  12           HG1      LYS  12  -7.479  -0.938   2.544
   91    HD2  LYS  12           HD2      LYS  12  -9.695  -1.226   3.630
   92    HD3  LYS  12           HD1      LYS  12  -9.621  -2.954   3.278
   93    HE2  LYS  12           HE2      LYS  12  -7.605  -1.424   4.951
   94    HE3  LYS  12           HE1      LYS  12  -8.876  -2.467   5.590
   95    HZ1  LYS  12           HZ1      LYS  12  -7.915  -4.326   4.403
   96    HZ2  LYS  12           HZ2      LYS  12  -6.756  -3.624   5.428
   97    HZ3  LYS  12           HZ3      LYS  12  -6.706  -3.328   3.756
   98    H    LYS  13           HN       LYS  13  -9.372   0.733  -0.975
   99    HA   LYS  13           HA       LYS  13 -10.971  -0.578  -2.903
  100    HB2  LYS  13           HB2      LYS  13 -11.563   1.599  -1.898
  101    HB3  LYS  13           HB1      LYS  13 -10.221   2.349  -2.762
  102    HG2  LYS  13           HG2      LYS  13 -11.216   1.710  -4.913
  103    HG3  LYS  13           HG1      LYS  13 -12.538   0.896  -4.075
  104    HD2  LYS  13           HD2      LYS  13 -13.224   3.034  -3.067
  105    HD3  LYS  13           HD1      LYS  13 -11.890   3.853  -3.883
  106    HE2  LYS  13           HE2      LYS  13 -13.957   4.163  -5.160
  107    HE3  LYS  13           HE1      LYS  13 -12.835   3.155  -6.074
  108    HZ1  LYS  13           HZ1      LYS  13 -14.975   2.151  -6.156
  109    HZ2  LYS  13           HZ2      LYS  13 -15.160   2.247  -4.470
  110    HZ3  LYS  13           HZ3      LYS  13 -14.006   1.196  -5.143
  111    H    LEU  14           HN       LEU  14  -7.897   1.159  -3.135
  112    HA   LEU  14           HA       LEU  14  -7.696   1.179  -5.945
  113    HB2  LEU  14           HB2      LEU  14  -5.665   1.248  -3.711
  114    HB3  LEU  14           HB1      LEU  14  -5.166   1.294  -5.402
  115    HG   LEU  14           HG       LEU  14  -7.301   3.210  -4.455
  116   HD11  LEU  14          HD11      LEU  14  -4.348   3.322  -3.851
  117   HD12  LEU  14          HD12      LEU  14  -5.721   3.781  -2.844
  118   HD13  LEU  14          HD13      LEU  14  -5.229   4.820  -4.172
  119   HD21  LEU  14          HD21      LEU  14  -6.306   4.590  -6.251
  120   HD22  LEU  14          HD22      LEU  14  -6.748   3.009  -6.879
  121   HD23  LEU  14          HD23      LEU  14  -5.064   3.367  -6.510
  122    H    LEU  15           HN       LEU  15  -6.642  -1.185  -3.531
  123    HA   LEU  15           HA       LEU  15  -5.346  -2.935  -5.349
  124    HB2  LEU  15           HB2      LEU  15  -6.602  -3.439  -2.643
  125    HB3  LEU  15           HB1      LEU  15  -5.637  -4.622  -3.519
  126    HG   LEU  15           HG       LEU  15  -4.650  -1.852  -2.784
  127   HD11  LEU  15          HD11      LEU  15  -4.099  -4.516  -1.449
  128   HD12  LEU  15          HD12      LEU  15  -5.073  -3.212  -0.766
  129   HD13  LEU  15          HD13      LEU  15  -3.344  -2.979  -1.030
  130   HD21  LEU  15          HD21      LEU  15  -3.455  -4.247  -4.169
  131   HD22  LEU  15          HD22      LEU  15  -2.410  -3.237  -3.175
  132   HD23  LEU  15          HD23      LEU  15  -3.270  -2.533  -4.532
  133    H    ASP  16           HN       ASP  16  -8.653  -2.740  -4.153
  134    HA   ASP  16           HA       ASP  16  -9.613  -5.132  -5.313
  135    HB2  ASP  16           HB2      ASP  16 -10.986  -2.558  -4.537
  136    HB3  ASP  16           HB1      ASP  16 -11.860  -3.953  -5.167
  137    H    ASP  17           HN       ASP  17  -9.253  -1.858  -6.552
  138    HA   ASP  17           HA       ASP  17 -10.702  -2.194  -8.956
  139    HB2  ASP  17           HB2      ASP  17  -8.478  -0.307  -8.182
  140    HB3  ASP  17           HB1      ASP  17  -9.298  -0.238  -9.742
  141    H    SER  18           HN       SER  18  -7.849  -3.617  -7.927
  142    HA   SER  18           HA       SER  18  -6.244  -3.677 -10.191
  143    HB2  SER  18           HB2      SER  18  -5.562  -4.559  -7.978
  144    HB3  SER  18           HB1      SER  18  -6.671  -5.902  -8.197
  145    HG   SER  18           HG       SER  18  -5.403  -6.724  -9.728
  146    H    SER  19           HN       SER  19  -9.110  -5.469  -9.417
  147    HA   SER  19           HA       SER  19  -8.857  -7.297 -11.634
  148    HB2  SER  19           HB2      SER  19 -11.043  -8.116 -10.982
  149    HB3  SER  19           HB1      SER  19 -10.074  -7.881  -9.530
  150    HG   SER  19           HG       SER  19 -12.325  -6.554 -10.418
  151    H    SER  20           HN       SER  20  -9.857  -4.118 -11.283
  152    HA   SER  20           HA       SER  20 -11.790  -4.096 -13.447
  153    HB2  SER  20           HB2      SER  20 -10.446  -1.761 -12.077
  154    HB3  SER  20           HB1      SER  20 -11.861  -1.693 -13.116
  155    HG   SER  20           HG       SER  20 -11.592  -2.968 -10.595
  156    H1   LYS   1           HN       LYS   1 -11.489  -3.106 -15.474
  157    HA   LYS   1           HA       LYS   1  -8.883  -3.493 -16.610
  158    HB2  LYS   1           HB2      LYS   1 -11.440  -2.365 -17.763
  159    HB3  LYS   1           HB1      LYS   1  -9.973  -2.649 -18.702
  160    HG2  LYS   1           HG2      LYS   1 -10.041  -5.040 -18.080
  161    HG3  LYS   1           HG1      LYS   1 -11.516  -4.754 -17.157
  162    HD2  LYS   1           HD2      LYS   1 -12.659  -3.999 -19.212
  163    HD3  LYS   1           HD1      LYS   1 -11.185  -4.294 -20.136
  164    HE2  LYS   1           HE2      LYS   1 -11.267  -6.679 -19.524
  165    HE3  LYS   1           HE1      LYS   1 -12.734  -6.392 -18.588
  166    HZ1  LYS   1           HZ1      LYS   1 -13.544  -7.106 -20.610
  167    HZ2  LYS   1           HZ2      LYS   1 -12.350  -6.296 -21.507
  168    HZ3  LYS   1           HZ3      LYS   1 -13.613  -5.421 -20.783
  169    H    ASN   2           HN       ASN   2  -9.694  -1.228 -14.593
  170    HA   ASN   2           HA       ASN   2  -9.335   1.212 -15.864
  171    HB2  ASN   2           HB2      ASN   2  -8.844   2.118 -13.648
  172    HB3  ASN   2           HB1      ASN   2 -10.148   0.958 -13.542
  173   HD21  ASN   2          HD21      ASN   2  -8.313   1.693 -11.348
  174   HD22  ASN   2          HD22      ASN   2  -7.493   0.272 -10.921
  175    HA   PRO   3           HA       PRO   3  -5.041   1.224 -16.929
  176    HB2  PRO   3           HB2      PRO   3  -4.498   3.926 -16.764
  177    HB3  PRO   3           HB1      PRO   3  -5.405   3.184 -18.095
  178    HG2  PRO   3           HG2      PRO   3  -6.426   4.620 -15.680
  179    HG3  PRO   3           HG1      PRO   3  -6.974   4.716 -17.365
  180    HD2  PRO   3           HD2      PRO   3  -8.290   3.269 -15.511
  181    HD3  PRO   3           HD1      PRO   3  -8.226   2.771 -17.213
  182    H    GLU   4           HN       GLU   4  -6.099   2.613 -13.927
  183    HA   GLU   4           HA       GLU   4  -3.587   3.161 -12.762
  184    HB2  GLU   4           HB2      GLU   4  -6.272   2.505 -11.533
  185    HB3  GLU   4           HB1      GLU   4  -4.862   2.976 -10.589
  186    HG2  GLU   4           HG2      GLU   4  -5.940   5.032 -10.920
  187    HG3  GLU   4           HG1      GLU   4  -4.755   5.036 -12.215
  188    H    ALA   5           HN       ALA   5  -5.049   0.245 -13.598
  189    HA   ALA   5           HA       ALA   5  -4.249  -1.488 -11.551
  190    HB1  ALA   5           HB1      ALA   5  -4.287  -3.246 -13.334
  191    HB2  ALA   5           HB2      ALA   5  -4.503  -1.968 -14.530
  192    HB3  ALA   5           HB3      ALA   5  -5.739  -2.247 -13.303
  193    H    GLU   6           HN       GLU   6  -2.449  -0.043 -14.199
  194    HA   GLU   6           HA       GLU   6  -0.171  -1.709 -14.139
  195    HB2  GLU   6           HB2      GLU   6  -0.525   1.195 -14.901
  196    HB3  GLU   6           HB1      GLU   6   0.991   0.318 -15.114
  197    HG2  GLU   6           HG2      GLU   6  -0.113  -1.315 -16.553
  198    HG3  GLU   6           HG1      GLU   6  -1.673  -0.542 -16.278
  199    H    GLU   7           HN       GLU   7  -1.032   1.185 -12.290
  200    HA   GLU   7           HA       GLU   7   1.443   1.479 -10.961
  201    HB2  GLU   7           HB2      GLU   7  -0.362   3.230 -11.107
  202    HB3  GLU   7           HB1      GLU   7  -1.258   2.299  -9.906
  203    HG2  GLU   7           HG2      GLU   7   0.014   4.035  -8.766
  204    HG3  GLU   7           HG1      GLU   7   0.702   2.462  -8.366
  205    H    ILE   8           HN       ILE   8  -1.444  -0.391 -10.299
  206    HA   ILE   8           HA       ILE   8  -0.840  -1.191  -7.635
  207    HB   ILE   8           HB       ILE   8  -2.309  -2.776  -9.769
  208   HG12  ILE   8          HG12      ILE   8  -3.241  -0.515  -9.556
  209   HG13  ILE   8          HG11      ILE   8  -4.337  -1.682  -8.823
  210   HG21  ILE   8          HG21      ILE   8  -2.156  -2.891  -6.752
  211   HG22  ILE   8          HG22      ILE   8  -1.924  -4.200  -7.909
  212   HG23  ILE   8          HG23      ILE   8  -3.532  -3.549  -7.624
  213   HD11  ILE   8          HD11      ILE   8  -4.256  -0.038  -7.174
  214   HD12  ILE   8          HD12      ILE   8  -2.573   0.352  -7.500
  215   HD13  ILE   8          HD13      ILE   8  -2.980  -1.108  -6.611
  216    H    THR   9           HN       THR   9   0.099  -2.495 -10.788
  217    HA   THR   9           HA       THR   9   1.348  -4.868  -9.887
  218    HB   THR   9           HB       THR   9   2.016  -3.122 -12.268
  219    HG1  THR   9           HG1      THR   9   0.271  -5.286 -11.799
  220   HG21  THR   9          HG21      THR   9   2.898  -5.381 -13.122
  221   HG22  THR   9          HG22      THR   9   2.875  -5.894 -11.436
  222   HG23  THR   9          HG23      THR   9   3.886  -4.536 -11.933
  223    H    ARG  10           HN       ARG  10   2.550  -1.546 -10.281
  224    HA   ARG  10           HA       ARG  10   5.269  -2.061  -9.632
  225    HB2  ARG  10           HB2      ARG  10   3.535   0.398  -9.381
  226    HB3  ARG  10           HB1      ARG  10   5.245   0.400  -8.956
  227    HG2  ARG  10           HG2      ARG  10   5.882  -0.208 -11.191
  228    HG3  ARG  10           HG1      ARG  10   4.205  -0.516 -11.646
  229    HD2  ARG  10           HD2      ARG  10   5.053   1.693 -12.453
  230    HD3  ARG  10           HD1      ARG  10   3.655   1.834 -11.403
  231    HE   ARG  10           HE       ARG  10   5.002   2.833  -9.771
  232   HH11  ARG  10          HH11      ARG  10   6.933   3.848  -9.146
  233   HH12  ARG  10          HH12      ARG  10   8.373   3.622 -10.082
  234   HH21  ARG  10          HH21      ARG  10   6.854   1.537 -12.400
  235   HH22  ARG  10          HH22      ARG  10   8.328   2.313 -11.926
  236    H    CYS  11           HN       CYS  11   2.429  -1.342  -7.638
  237    HA   CYS  11           HA       CYS  11   3.678  -0.967  -5.162
  238    HB2  CYS  11           HB2      CYS  11   1.235  -0.645  -5.709
  239    HB3  CYS  11           HB1      CYS  11   1.050  -2.391  -5.582
  240    H    LYS  12           HN       LYS  12   2.605  -3.959  -6.751
  241    HA   LYS  12           HA       LYS  12   3.292  -5.731  -4.650
  242    HB2  LYS  12           HB2      LYS  12   3.096  -6.154  -7.643
  243    HB3  LYS  12           HB1      LYS  12   3.321  -7.457  -6.475
  244    HG2  LYS  12           HG2      LYS  12   1.234  -6.839  -5.344
  245    HG3  LYS  12           HG1      LYS  12   1.009  -5.496  -6.466
  246    HD2  LYS  12           HD2      LYS  12   0.949  -7.114  -8.353
  247    HD3  LYS  12           HD1      LYS  12   1.090  -8.439  -7.196
  248    HE2  LYS  12           HE2      LYS  12  -1.145  -6.388  -7.232
  249    HE3  LYS  12           HE1      LYS  12  -1.271  -8.038  -7.842
  250    HZ1  LYS  12           HZ1      LYS  12  -0.750  -8.859  -5.634
  251    HZ2  LYS  12           HZ2      LYS  12  -2.122  -7.858  -5.590
  252    HZ3  LYS  12           HZ3      LYS  12  -0.622  -7.273  -5.048
  253    H    LYS  13           HN       LYS  13   5.110  -4.491  -7.433
  254    HA   LYS  13           HA       LYS  13   7.431  -6.070  -7.086
  255    HB2  LYS  13           HB2      LYS  13   6.937  -4.806  -9.150
  256    HB3  LYS  13           HB1      LYS  13   7.210  -3.299  -8.276
  257    HG2  LYS  13           HG2      LYS  13   9.525  -3.980  -7.790
  258    HG3  LYS  13           HG1      LYS  13   9.256  -5.510  -8.624
  259    HD2  LYS  13           HD2      LYS  13   8.815  -4.308 -10.720
  260    HD3  LYS  13           HD1      LYS  13   9.037  -2.766  -9.893
  261    HE2  LYS  13           HE2      LYS  13  11.098  -3.384 -11.066
  262    HE3  LYS  13           HE1      LYS  13  11.362  -3.429  -9.324
  263    HZ1  LYS  13           HZ1      LYS  13  12.284  -5.391 -10.276
  264    HZ2  LYS  13           HZ2      LYS  13  10.849  -5.737 -11.116
  265    HZ3  LYS  13           HZ3      LYS  13  10.891  -5.844  -9.420
  266    H    LEU  14           HN       LEU  14   6.458  -2.928  -5.777
  267    HA   LEU  14           HA       LEU  14   8.905  -2.270  -4.540
  268    HB2  LEU  14           HB2      LEU  14   6.029  -1.530  -3.996
  269    HB3  LEU  14           HB1      LEU  14   7.338  -0.901  -2.995
  270    HG   LEU  14           HG       LEU  14   7.543  -0.675  -6.001
  271   HD11  LEU  14          HD11      LEU  14   5.760   0.915  -4.161
  272   HD12  LEU  14          HD12      LEU  14   5.468   0.362  -5.808
  273   HD13  LEU  14          HD13      LEU  14   6.544   1.722  -5.523
  274   HD21  LEU  14          HD21      LEU  14   8.854   1.327  -5.367
  275   HD22  LEU  14          HD22      LEU  14   9.486  -0.096  -4.550
  276   HD23  LEU  14          HD23      LEU  14   8.472   1.045  -3.670
  277    H    LEU  15           HN       LEU  15   6.088  -4.074  -3.377
  278    HA   LEU  15           HA       LEU  15   7.033  -4.466  -0.731
  279    HB2  LEU  15           HB2      LEU  15   5.089  -6.052  -2.420
  280    HB3  LEU  15           HB1      LEU  15   5.378  -6.356  -0.710
  281    HG   LEU  15           HG       LEU  15   4.515  -3.671  -1.822
  282   HD11  LEU  15          HD11      LEU  15   2.850  -5.788  -0.436
  283   HD12  LEU  15          HD12      LEU  15   2.780  -5.419  -2.161
  284   HD13  LEU  15          HD13      LEU  15   2.286  -4.207  -0.976
  285   HD21  LEU  15          HD21      LEU  15   5.081  -4.765   0.926
  286   HD22  LEU  15          HD22      LEU  15   3.801  -3.570   0.749
  287   HD23  LEU  15          HD23      LEU  15   5.437  -3.176   0.253
  288    H    ASP  16           HN       ASP  16   7.384  -6.324  -3.707
  289    HA   ASP  16           HA       ASP  16   8.649  -8.589  -2.586
  290    HB2  ASP  16           HB2      ASP  16   8.734  -7.375  -5.347
  291    HB3  ASP  16           HB1      ASP  16   9.563  -8.876  -4.938
  292    H    ASP  17           HN       ASP  17   9.880  -5.495  -3.729
  293    HA   ASP  17           HA       ASP  17  12.635  -6.117  -3.633
  294    HB2  ASP  17           HB2      ASP  17  11.149  -3.499  -3.422
  295    HB3  ASP  17           HB1      ASP  17  12.907  -3.607  -3.443
  296    H    SER  18           HN       SER  18  10.373  -5.904  -1.171
  297    HA   SER  18           HA       SER  18  11.716  -4.646   0.908
  298    HB2  SER  18           HB2      SER  18   9.362  -5.410   1.036
  299    HB3  SER  18           HB1      SER  18   9.930  -7.071   1.092
  300    HG   SER  18           HG       SER  18  10.753  -6.736   3.069
  301    H    SER  19           HN       SER  19  12.106  -7.822  -0.429
  302    HA   SER  19           HA       SER  19  13.844  -8.762   1.669
  303    HB2  SER  19           HB2      SER  19  14.131 -10.744   0.310
  304    HB3  SER  19           HB1      SER  19  12.429 -10.292   0.278
  305    HG   SER  19           HG       SER  19  14.327 -10.275  -1.726
  306    H    SER  20           HN       SER  20  14.212  -6.783  -1.016
  307    HA   SER  20           HA       SER  20  16.989  -7.405  -1.565
  308    HB2  SER  20           HB2      SER  20  15.373  -5.011  -2.453
  309    HB3  SER  20           HB1      SER  20  16.916  -5.536  -3.109
  310    HG   SER  20           HG       SER  20  14.456  -6.959  -3.139
  311    H1   LYS   1           HN       LYS   1  18.766  -6.059  -1.112
  312    HA   LYS   1           HA       LYS   1  18.650  -4.767   1.445
  313    HB2  LYS   1           HB2      LYS   1  20.871  -5.001  -0.593
  314    HB3  LYS   1           HB1      LYS   1  21.065  -4.287   1.008
  315    HG2  LYS   1           HG2      LYS   1  20.345  -6.407   2.046
  316    HG3  LYS   1           HG1      LYS   1  20.153  -7.124   0.447
  317    HD2  LYS   1           HD2      LYS   1  22.550  -6.756  -0.011
  318    HD3  LYS   1           HD1      LYS   1  22.745  -6.045   1.592
  319    HE2  LYS   1           HE2      LYS   1  22.035  -8.163   2.629
  320    HE3  LYS   1           HE1      LYS   1  21.822  -8.879   1.031
  321    HZ1  LYS   1           HZ1      LYS   1  23.933  -9.552   1.592
  322    HZ2  LYS   1           HZ2      LYS   1  24.307  -8.107   2.403
  323    HZ3  LYS   1           HZ3      LYS   1  24.261  -8.143   0.706
  324    H    ASN   2           HN       ASN   2  17.352  -3.700  -1.203
  325    HA   ASN   2           HA       ASN   2  18.541  -1.267  -1.814
  326    HB2  ASN   2           HB2      ASN   2  16.407  -0.658  -2.834
  327    HB3  ASN   2           HB1      ASN   2  16.764  -2.338  -3.168
  328   HD21  ASN   2          HD21      ASN   2  14.071  -1.128  -3.104
  329   HD22  ASN   2          HD22      ASN   2  13.224  -1.924  -1.870
  330    HA   PRO   3           HA       PRO   3  17.678   1.235   1.734
  331    HB2  PRO   3           HB2      PRO   3  17.517   3.726   0.557
  332    HB3  PRO   3           HB1      PRO   3  19.043   2.863   0.828
  333    HG2  PRO   3           HG2      PRO   3  17.408   3.073  -1.667
  334    HG3  PRO   3           HG1      PRO   3  19.169   3.158  -1.461
  335    HD2  PRO   3           HD2      PRO   3  17.936   0.929  -2.339
  336    HD3  PRO   3           HD1      PRO   3  19.407   0.855  -1.349
  337    H    GLU   4           HN       GLU   4  15.530   1.268  -0.993
  338    HA   GLU   4           HA       GLU   4  13.460   2.864   0.078
  339    HB2  GLU   4           HB2      GLU   4  13.437   0.670  -2.003
  340    HB3  GLU   4           HB1      GLU   4  12.025   1.647  -1.607
  341    HG2  GLU   4           HG2      GLU   4  12.938   2.836  -3.407
  342    HG3  GLU   4           HG1      GLU   4  13.629   3.691  -2.037
  343    H    ALA   5           HN       ALA   5  14.590  -0.183   0.959
  344    HA   ALA   5           HA       ALA   5  12.260  -1.543   1.702
  345    HB1  ALA   5           HB1      ALA   5  13.742  -2.700   3.363
  346    HB2  ALA   5           HB2      ALA   5  15.021  -1.559   2.944
  347    HB3  ALA   5           HB3      ALA   5  14.398  -2.672   1.726
  348    H    GLU   6           HN       GLU   6  14.008   1.076   3.255
  349    HA   GLU   6           HA       GLU   6  12.854   0.910   5.827
  350    HB2  GLU   6           HB2      GLU   6  13.929   3.253   4.247
  351    HB3  GLU   6           HB1      GLU   6  13.408   3.379   5.927
  352    HG2  GLU   6           HG2      GLU   6  15.039   1.690   6.596
  353    HG3  GLU   6           HG1      GLU   6  15.519   1.451   4.916
  354    H    GLU   7           HN       GLU   7  11.791   2.521   2.857
  355    HA   GLU   7           HA       GLU   7   9.568   3.849   3.979
  356    HB2  GLU   7           HB2      GLU   7  10.606   4.370   1.747
  357    HB3  GLU   7           HB1      GLU   7   9.836   2.907   1.130
  358    HG2  GLU   7           HG2      GLU   7   8.407   4.822   0.646
  359    HG3  GLU   7           HG1      GLU   7   7.623   3.803   1.852
  360    H    ILE   8           HN       ILE   8  10.037   0.647   2.645
  361    HA   ILE   8           HA       ILE   8   7.311  -0.158   2.481
  362    HB   ILE   8           HB       ILE   8   9.732  -1.874   3.120
  363   HG12  ILE   8          HG12      ILE   8  10.104  -0.548   1.089
  364   HG13  ILE   8          HG11      ILE   8   9.809  -2.229   0.657
  365   HG21  ILE   8          HG21      ILE   8   6.936  -2.432   2.117
  366   HG22  ILE   8          HG22      ILE   8   7.769  -3.164   3.488
  367   HG23  ILE   8          HG23      ILE   8   8.257  -3.560   1.845
  368   HD11  ILE   8          HD11      ILE   8   8.408  -1.125  -0.842
  369   HD12  ILE   8          HD12      ILE   8   8.027   0.157   0.299
  370   HD13  ILE   8          HD13      ILE   8   7.283  -1.425   0.475
  371    H    THR   9           HN       THR   9   9.647  -0.184   5.137
  372    HA   THR   9           HA       THR   9   8.108  -1.641   7.009
  373    HB   THR   9           HB       THR   9  10.114   0.578   7.470
  374    HG1  THR   9           HG1      THR   9  10.255  -2.229   7.232
  375   HG21  THR   9          HG21      THR   9  10.317  -0.681   9.710
  376   HG22  THR   9          HG22      THR   9   8.753  -1.389   9.311
  377   HG23  THR   9          HG23      THR   9   8.911   0.360   9.494
  378    H    ARG  10           HN       ARG  10   8.221   1.818   6.203
  379    HA   ARG  10           HA       ARG  10   6.437   2.724   8.224
  380    HB2  ARG  10           HB2      ARG  10   7.143   3.787   5.486
  381    HB3  ARG  10           HB1      ARG  10   6.032   4.625   6.566
  382    HG2  ARG  10           HG2      ARG  10   7.725   4.870   8.249
  383    HG3  ARG  10           HG1      ARG  10   8.824   3.797   7.381
  384    HD2  ARG  10           HD2      ARG  10   9.376   6.212   7.074
  385    HD3  ARG  10           HD1      ARG  10   9.026   5.394   5.565
  386    HE   ARG  10           HE       ARG  10   7.064   6.652   5.354
  387   HH11  ARG  10          HH11      ARG  10   5.774   8.423   5.953
  388   HH12  ARG  10          HH12      ARG  10   6.004   9.179   7.493
  389   HH21  ARG  10          HH21      ARG  10   8.567   7.051   8.453
  390   HH22  ARG  10          HH22      ARG  10   7.586   8.402   8.910
  391    H    CYS  11           HN       CYS  11   5.901   1.468   4.950
  392    HA   CYS  11           HA       CYS  11   3.166   1.993   4.683
  393    HB2  CYS  11           HB2      CYS  11   4.721   1.052   2.933
  394    HB3  CYS  11           HB1      CYS  11   4.557  -0.512   3.727
  395    H    LYS  12           HN       LYS  12   4.820  -0.774   6.186
  396    HA   LYS  12           HA       LYS  12   2.494  -2.244   6.857
  397    HB2  LYS  12           HB2      LYS  12   5.248  -2.163   8.113
  398    HB3  LYS  12           HB1      LYS  12   3.996  -3.321   8.566
  399    HG2  LYS  12           HG2      LYS  12   3.889  -4.143   6.258
  400    HG3  LYS  12           HG1      LYS  12   5.108  -2.964   5.768
  401    HD2  LYS  12           HD2      LYS  12   6.705  -3.994   7.378
  402    HD3  LYS  12           HD1      LYS  12   5.491  -5.217   7.763
  403    HE2  LYS  12           HE2      LYS  12   6.657  -4.711   5.008
  404    HE3  LYS  12           HE1      LYS  12   7.099  -6.046   6.074
  405    HZ1  LYS  12           HZ1      LYS  12   4.821  -6.818   6.012
  406    HZ2  LYS  12           HZ2      LYS  12   5.446  -6.710   4.436
  407    HZ3  LYS  12           HZ3      LYS  12   4.376  -5.523   5.012
  408    H    LYS  13           HN       LYS  13   4.329   0.250   8.586
  409    HA   LYS  13           HA       LYS  13   2.902   0.128  11.027
  410    HB2  LYS  13           HB2      LYS  13   5.075   1.286  10.762
  411    HB3  LYS  13           HB1      LYS  13   4.277   2.516   9.780
  412    HG2  LYS  13           HG2      LYS  13   2.814   3.108  11.658
  413    HG3  LYS  13           HG1      LYS  13   3.546   1.841  12.644
  414    HD2  LYS  13           HD2      LYS  13   5.728   2.959  12.487
  415    HD3  LYS  13           HD1      LYS  13   5.023   4.213  11.467
  416    HE2  LYS  13           HE2      LYS  13   5.156   5.001  13.784
  417    HE3  LYS  13           HE1      LYS  13   3.468   4.809  13.310
  418    HZ1  LYS  13           HZ1      LYS  13   3.752   3.834  15.445
  419    HZ2  LYS  13           HZ2      LYS  13   5.101   2.936  14.932
  420    HZ3  LYS  13           HZ3      LYS  13   3.553   2.567  14.336
  421    H    LEU  14           HN       LEU  14   2.391   1.970   8.043
  422    HA   LEU  14           HA       LEU  14   0.285   3.600   8.970
  423    HB2  LEU  14           HB2      LEU  14   1.083   2.571   6.246
  424    HB3  LEU  14           HB1      LEU  14  -0.329   3.607   6.449
  425    HG   LEU  14           HG       LEU  14   2.293   4.463   7.677
  426   HD11  LEU  14          HD11      LEU  14   1.572   4.450   4.749
  427   HD12  LEU  14          HD12      LEU  14   3.127   4.156   5.527
  428   HD13  LEU  14          HD13      LEU  14   2.509   5.796   5.406
  429   HD21  LEU  14          HD21      LEU  14   1.324   6.692   7.239
  430   HD22  LEU  14          HD22      LEU  14   0.177   5.708   8.140
  431   HD23  LEU  14          HD23      LEU  14  -0.040   5.944   6.406
  432    H    LEU  15           HN       LEU  15   0.284   0.394   7.460
  433    HA   LEU  15           HA       LEU  15  -2.534   0.110   7.320
  434    HB2  LEU  15           HB2      LEU  15  -0.320  -1.948   7.467
  435    HB3  LEU  15           HB1      LEU  15  -2.009  -2.339   7.158
  436    HG   LEU  15           HG       LEU  15  -0.394  -0.396   5.483
  437   HD11  LEU  15          HD11      LEU  15  -1.116  -3.282   4.914
  438   HD12  LEU  15          HD12      LEU  15   0.501  -2.700   5.318
  439   HD13  LEU  15          HD13      LEU  15  -0.273  -2.190   3.816
  440   HD21  LEU  15          HD21      LEU  15  -3.209  -1.462   5.398
  441   HD22  LEU  15          HD22      LEU  15  -2.392  -1.134   3.874
  442   HD23  LEU  15          HD23      LEU  15  -2.609   0.156   5.044
  443    H    ASP  16           HN       ASP  16  -0.160  -0.713   9.795
  444    HA   ASP  16           HA       ASP  16  -1.903  -2.099  11.536
  445    HB2  ASP  16           HB2      ASP  16   0.653  -0.568  12.017
  446    HB3  ASP  16           HB1      ASP  16  -0.197  -1.433  13.297
  447    H    ASP  17           HN       ASP  17  -1.138   1.315  11.154
  448    HA   ASP  17           HA       ASP  17  -2.443   2.270  13.471
  449    HB2  ASP  17           HB2      ASP  17  -1.797   3.582  10.829
  450    HB3  ASP  17           HB1      ASP  17  -2.533   4.446  12.178
  451    H    SER  18           HN       SER  18  -3.691   0.778  10.743
  452    HA   SER  18           HA       SER  18  -6.033   2.163  10.200
  453    HB2  SER  18           HB2      SER  18  -5.219   0.265   8.855
  454    HB3  SER  18           HB1      SER  18  -5.620  -0.824  10.169
  455    HG   SER  18           HG       SER  18  -7.728  -0.497   9.820
  456    H    SER  19           HN       SER  19  -5.252   0.002  12.792
  457    HA   SER  19           HA       SER  19  -7.959  -0.225  13.749
  458    HB2  SER  19           HB2      SER  19  -7.014  -1.449  15.614
  459    HB3  SER  19           HB1      SER  19  -6.227  -1.991  14.134
  460    HG   SER  19           HG       SER  19  -5.200  -0.686  16.303
  461    H    SER  20           HN       SER  20  -5.550   2.097  13.968
  462    HA   SER  20           HA       SER  20  -6.313   3.182  16.548
  463    HB2  SER  20           HB2      SER  20  -4.603   4.435  14.394
  464    HB3  SER  20           HB1      SER  20  -4.733   4.959  16.067
  465    HG   SER  20           HG       SER  20  -3.739   2.481  15.095
  466    H2   ZBR 100           HA3      TBS 100  -1.419   1.130  -2.089
  467    H4   ZBR 100           HC3      TBS 100   0.365   1.803   1.789
  468    H6   ZBR 100           HB3      TBS 100   2.782   0.332  -1.477
  469    H7   ZBR 100          HB11      TBS 100   1.489   0.924  -3.891
  470    H7A  ZBR 100          HB12      TBS 100  -0.151   0.269  -3.848
  471    H8   ZBR 100          HA11      TBS 100  -2.305   2.868  -0.063
  472    H8A  ZBR 100          HA12      TBS 100  -1.931   2.144   1.505
  473    H9   ZBR 100          HC11      TBS 100   3.193   2.038   1.409
  474    H9A  ZBR 100          HC12      TBS 100   3.729   0.534   0.653
  Start of MODEL   11
    1    H1   LYS   1           HN       LYS   1  -7.408   5.435  16.453
    2    HA   LYS   1           HA       LYS   1  -9.579   5.783  14.547
    3    HB2  LYS   1           HB2      LYS   1  -9.006   7.019  17.244
    4    HB3  LYS   1           HB1      LYS   1 -10.420   7.411  16.266
    5    HG2  LYS   1           HG2      LYS   1 -11.088   5.032  16.279
    6    HG3  LYS   1           HG1      LYS   1  -9.680   4.646  17.270
    7    HD2  LYS   1           HD2      LYS   1 -10.511   6.146  19.045
    8    HD3  LYS   1           HD1      LYS   1 -11.920   6.534  18.056
    9    HE2  LYS   1           HE2      LYS   1 -12.601   4.168  18.079
   10    HE3  LYS   1           HE1      LYS   1 -11.186   3.764  19.051
   11    HZ1  LYS   1           HZ1      LYS   1 -13.341   4.131  20.286
   12    HZ2  LYS   1           HZ2      LYS   1 -13.174   5.780  19.914
   13    HZ3  LYS   1           HZ3      LYS   1 -11.996   4.995  20.853
   14    H    ASN   2           HN       ASN   2  -6.574   6.750  14.383
   15    HA   ASN   2           HA       ASN   2  -6.652   9.552  14.207
   16    HB2  ASN   2           HB2      ASN   2  -4.568   9.287  12.840
   17    HB3  ASN   2           HB1      ASN   2  -4.533   8.378  14.342
   18   HD21  ASN   2          HD21      ASN   2  -2.863   7.581  12.219
   19   HD22  ASN   2          HD22      ASN   2  -3.439   6.122  11.571
   20    HA   PRO   3           HA       PRO   3  -8.820  10.350  10.456
   21    HB2  PRO   3           HB2      PRO   3  -7.311  12.448   9.450
   22    HB3  PRO   3           HB1      PRO   3  -8.508  12.609  10.748
   23    HG2  PRO   3           HG2      PRO   3  -5.538  12.347  10.932
   24    HG3  PRO   3           HG1      PRO   3  -6.638  13.392  11.851
   25    HD2  PRO   3           HD2      PRO   3  -5.647  11.141  12.908
   26    HD3  PRO   3           HD1      PRO   3  -7.296  11.663  13.285
   27    H    GLU   4           HN       GLU   4  -5.443   9.590  10.421
   28    HA   GLU   4           HA       GLU   4  -5.013   9.474   7.624
   29    HB2  GLU   4           HB2      GLU   4  -3.676   7.913   9.847
   30    HB3  GLU   4           HB1      GLU   4  -3.073   8.062   8.195
   31    HG2  GLU   4           HG2      GLU   4  -3.596  10.431  10.010
   32    HG3  GLU   4           HG1      GLU   4  -2.016   9.671   9.821
   33    H    ALA   5           HN       ALA   5  -6.939   7.597   9.657
   34    HA   ALA   5           HA       ALA   5  -6.700   5.017   8.596
   35    HB1  ALA   5           HB1      ALA   5  -9.329   6.219   9.444
   36    HB2  ALA   5           HB2      ALA   5  -8.075   5.810  10.615
   37    HB3  ALA   5           HB3      ALA   5  -8.781   4.550   9.603
   38    H    GLU   6           HN       GLU   6  -8.114   7.898   7.281
   39    HA   GLU   6           HA       GLU   6  -9.899   6.791   5.411
   40    HB2  GLU   6           HB2      GLU   6  -8.256   9.332   5.344
   41    HB3  GLU   6           HB1      GLU   6  -9.482   8.932   4.139
   42    HG2  GLU   6           HG2      GLU   6 -11.198   8.810   5.875
   43    HG3  GLU   6           HG1      GLU   6  -9.989   9.107   7.122
   44    H    GLU   7           HN       GLU   7  -6.413   7.351   5.280
   45    HA   GLU   7           HA       GLU   7  -6.052   6.744   2.538
   46    HB2  GLU   7           HB2      GLU   7  -4.210   6.655   4.926
   47    HB3  GLU   7           HB1      GLU   7  -3.662   6.228   3.304
   48    HG2  GLU   7           HG2      GLU   7  -5.009   8.855   3.987
   49    HG3  GLU   7           HG1      GLU   7  -3.261   8.639   3.915
   50    H    ILE   8           HN       ILE   8  -6.140   4.755   5.441
   51    HA   ILE   8           HA       ILE   8  -5.230   2.334   4.298
   52    HB   ILE   8           HB       ILE   8  -6.969   2.996   6.666
   53   HG12  ILE   8          HG12      ILE   8  -5.048   2.148   7.899
   54   HG13  ILE   8          HG11      ILE   8  -4.278   1.632   6.400
   55   HG21  ILE   8          HG21      ILE   8  -7.911   0.924   6.008
   56   HG22  ILE   8          HG22      ILE   8  -6.689   0.489   7.191
   57   HG23  ILE   8          HG23      ILE   8  -6.351   0.294   5.476
   58   HD11  ILE   8          HD11      ILE   8  -3.924   3.863   5.680
   59   HD12  ILE   8          HD12      ILE   8  -3.501   3.876   7.392
   60   HD13  ILE   8          HD13      ILE   8  -5.058   4.511   6.868
   61    H    THR   9           HN       THR   9  -8.499   3.695   4.649
   62    HA   THR   9           HA       THR   9  -9.922   1.539   3.513
   63    HB   THR   9           HB       THR   9 -10.563   4.498   3.481
   64    HG1  THR   9           HG1      THR   9 -11.244   2.367   5.222
   65   HG21  THR   9          HG21      THR   9 -11.933   3.442   1.836
   66   HG22  THR   9          HG22      THR   9 -12.934   3.571   3.284
   67   HG23  THR   9          HG23      THR   9 -12.191   2.028   2.860
   68    H    ARG  10           HN       ARG  10  -8.418   4.407   2.059
   69    HA   ARG  10           HA       ARG  10  -9.284   3.972  -0.599
   70    HB2  ARG  10           HB2      ARG  10  -8.205   6.072   0.333
   71    HB3  ARG  10           HB1      ARG  10  -6.658   5.229   0.224
   72    HG2  ARG  10           HG2      ARG  10  -7.276   4.775  -2.231
   73    HG3  ARG  10           HG1      ARG  10  -8.539   5.982  -2.018
   74    HD2  ARG  10           HD2      ARG  10  -5.564   6.392  -1.627
   75    HD3  ARG  10           HD1      ARG  10  -6.554   7.061  -2.921
   76    HE   ARG  10           HE       ARG  10  -6.389   8.021  -0.193
   77   HH11  ARG  10          HH11      ARG  10  -7.562   9.923   0.233
   78   HH12  ARG  10          HH12      ARG  10  -8.738  10.481  -0.910
   79   HH21  ARG  10          HH21      ARG  10  -8.212   7.868  -3.128
   80   HH22  ARG  10          HH22      ARG  10  -9.106   9.318  -2.812
   81    H    CYS  11           HN       CYS  11  -6.456   2.833   1.216
   82    HA   CYS  11           HA       CYS  11  -4.992   1.673  -0.849
   83    HB2  CYS  11           HB2      CYS  11  -4.424   1.899   1.665
   84    HB3  CYS  11           HB1      CYS  11  -5.265   0.361   1.848
   85    H    LYS  12           HN       LYS  12  -7.562   0.234   1.153
   86    HA   LYS  12           HA       LYS  12  -7.549  -2.306  -0.073
   87    HB2  LYS  12           HB2      LYS  12  -8.676  -1.805   2.079
   88    HB3  LYS  12           HB1      LYS  12  -9.885  -0.866   1.202
   89    HG2  LYS  12           HG2      LYS  12 -10.532  -2.861  -0.083
   90    HG3  LYS  12           HG1      LYS  12  -9.299  -3.806   0.753
   91    HD2  LYS  12           HD2      LYS  12 -10.422  -3.360   2.908
   92    HD3  LYS  12           HD1      LYS  12 -11.660  -2.428   2.066
   93    HE2  LYS  12           HE2      LYS  12 -12.293  -4.426   0.769
   94    HE3  LYS  12           HE1      LYS  12 -11.049  -5.361   1.598
   95    HZ1  LYS  12           HZ1      LYS  12 -12.990  -3.911   3.235
   96    HZ2  LYS  12           HZ2      LYS  12 -12.219  -5.398   3.526
   97    HZ3  LYS  12           HZ3      LYS  12 -13.523  -5.311   2.440
   98    H    LYS  13           HN       LYS  13  -9.402   0.637  -0.778
   99    HA   LYS  13           HA       LYS  13 -10.997  -0.443  -2.823
  100    HB2  LYS  13           HB2      LYS  13 -11.490   1.716  -1.761
  101    HB3  LYS  13           HB1      LYS  13 -10.028   2.402  -2.467
  102    HG2  LYS  13           HG2      LYS  13 -11.940   3.018  -3.847
  103    HG3  LYS  13           HG1      LYS  13 -10.937   1.888  -4.742
  104    HD2  LYS  13           HD2      LYS  13 -12.431   0.092  -4.411
  105    HD3  LYS  13           HD1      LYS  13 -13.243   0.901  -3.067
  106    HE2  LYS  13           HE2      LYS  13 -14.622   0.951  -5.110
  107    HE3  LYS  13           HE1      LYS  13 -14.140   2.578  -4.631
  108    HZ1  LYS  13           HZ1      LYS  13 -13.875   1.873  -7.072
  109    HZ2  LYS  13           HZ2      LYS  13 -12.498   1.038  -6.530
  110    HZ3  LYS  13           HZ3      LYS  13 -12.608   2.721  -6.329
  111    H    LEU  14           HN       LEU  14  -7.829   1.132  -2.886
  112    HA   LEU  14           HA       LEU  14  -7.511   1.216  -5.687
  113    HB2  LEU  14           HB2      LEU  14  -5.494   1.056  -3.434
  114    HB3  LEU  14           HB1      LEU  14  -5.045   1.290  -5.119
  115    HG   LEU  14           HG       LEU  14  -7.070   3.085  -3.780
  116   HD11  LEU  14          HD11      LEU  14  -5.200   3.413  -2.376
  117   HD12  LEU  14          HD12      LEU  14  -5.027   4.677  -3.589
  118   HD13  LEU  14          HD13      LEU  14  -4.054   3.210  -3.699
  119   HD21  LEU  14          HD21      LEU  14  -6.067   4.660  -5.550
  120   HD22  LEU  14          HD22      LEU  14  -7.061   3.342  -6.147
  121   HD23  LEU  14          HD23      LEU  14  -5.305   3.224  -6.233
  122    H    LEU  15           HN       LEU  15  -6.684  -1.261  -3.297
  123    HA   LEU  15           HA       LEU  15  -5.397  -3.028  -5.104
  124    HB2  LEU  15           HB2      LEU  15  -6.769  -3.505  -2.454
  125    HB3  LEU  15           HB1      LEU  15  -5.880  -4.747  -3.326
  126    HG   LEU  15           HG       LEU  15  -4.679  -2.074  -2.552
  127   HD11  LEU  15          HD11      LEU  15  -5.303  -3.354  -0.534
  128   HD12  LEU  15          HD12      LEU  15  -3.551  -3.299  -0.733
  129   HD13  LEU  15          HD13      LEU  15  -4.443  -4.760  -1.162
  130   HD21  LEU  15          HD21      LEU  15  -3.328  -2.933  -4.250
  131   HD22  LEU  15          HD22      LEU  15  -3.678  -4.610  -3.833
  132   HD23  LEU  15          HD23      LEU  15  -2.577  -3.662  -2.842
  133    H    ASP  16           HN       ASP  16  -8.744  -2.681  -4.049
  134    HA   ASP  16           HA       ASP  16  -9.776  -5.004  -5.272
  135    HB2  ASP  16           HB2      ASP  16 -11.036  -2.353  -4.567
  136    HB3  ASP  16           HB1      ASP  16 -11.956  -3.697  -5.241
  137    H    ASP  17           HN       ASP  17  -9.150  -1.762  -6.496
  138    HA   ASP  17           HA       ASP  17 -10.510  -2.008  -8.961
  139    HB2  ASP  17           HB2      ASP  17  -8.182  -0.296  -8.089
  140    HB3  ASP  17           HB1      ASP  17  -8.911  -0.175  -9.690
  141    H    SER  18           HN       SER  18  -7.825  -3.646  -7.803
  142    HA   SER  18           HA       SER  18  -6.115  -3.835  -9.982
  143    HB2  SER  18           HB2      SER  18  -5.598  -4.773  -7.762
  144    HB3  SER  18           HB1      SER  18  -6.833  -6.003  -8.007
  145    HG   SER  18           HG       SER  18  -4.719  -6.727  -8.564
  146    H    SER  19           HN       SER  19  -9.161  -5.409  -9.372
  147    HA   SER  19           HA       SER  19  -8.928  -7.233 -11.593
  148    HB2  SER  19           HB2      SER  19 -11.208  -7.875 -11.062
  149    HB3  SER  19           HB1      SER  19 -10.286  -7.748  -9.567
  150    HG   SER  19           HG       SER  19 -11.694  -6.317  -8.977
  151    H    SER  20           HN       SER  20  -9.613  -3.974 -11.299
  152    HA   SER  20           HA       SER  20 -11.496  -3.774 -13.492
  153    HB2  SER  20           HB2      SER  20  -9.912  -1.506 -12.300
  154    HB3  SER  20           HB1      SER  20 -11.476  -1.442 -13.108
  155    HG   SER  20           HG       SER  20 -11.401  -3.149 -10.967
  156    H1   LYS   1           HN       LYS   1 -11.071  -2.892 -15.535
  157    HA   LYS   1           HA       LYS   1  -8.388  -3.414 -16.526
  158    HB2  LYS   1           HB2      LYS   1 -10.959  -2.612 -17.895
  159    HB3  LYS   1           HB1      LYS   1  -9.434  -2.861 -18.745
  160    HG2  LYS   1           HG2      LYS   1  -9.330  -5.173 -17.890
  161    HG3  LYS   1           HG1      LYS   1 -10.855  -4.927 -17.038
  162    HD2  LYS   1           HD2      LYS   1 -11.992  -4.491 -19.181
  163    HD3  LYS   1           HD1      LYS   1 -10.470  -4.730 -20.039
  164    HE2  LYS   1           HE2      LYS   1 -10.348  -7.042 -19.214
  165    HE3  LYS   1           HE1      LYS   1 -11.853  -6.813 -18.322
  166    HZ1  LYS   1           HZ1      LYS   1 -12.055  -7.905 -20.559
  167    HZ2  LYS   1           HZ2      LYS   1 -11.648  -6.406 -21.250
  168    HZ3  LYS   1           HZ3      LYS   1 -13.055  -6.559 -20.311
  169    H    ASN   2           HN       ASN   2  -9.461  -0.953 -14.859
  170    HA   ASN   2           HA       ASN   2  -9.053   1.327 -16.444
  171    HB2  ASN   2           HB2      ASN   2  -8.742   2.506 -14.258
  172    HB3  ASN   2           HB1      ASN   2 -10.169   1.485 -14.292
  173   HD21  ASN   2          HD21      ASN   2  -9.075   2.138 -11.802
  174   HD22  ASN   2          HD22      ASN   2  -8.319   0.774 -11.133
  175    HA   PRO   3           HA       PRO   3  -4.685   1.526 -16.990
  176    HB2  PRO   3           HB2      PRO   3  -4.272   4.253 -16.681
  177    HB3  PRO   3           HB1      PRO   3  -4.907   3.496 -18.153
  178    HG2  PRO   3           HG2      PRO   3  -6.377   4.848 -15.933
  179    HG3  PRO   3           HG1      PRO   3  -6.650   4.930 -17.684
  180    HD2  PRO   3           HD2      PRO   3  -8.195   3.423 -16.100
  181    HD3  PRO   3           HD1      PRO   3  -7.788   2.892 -17.738
  182    H    GLU   4           HN       GLU   4  -6.164   2.712 -14.095
  183    HA   GLU   4           HA       GLU   4  -3.844   3.392 -12.614
  184    HB2  GLU   4           HB2      GLU   4  -6.532   2.382 -11.649
  185    HB3  GLU   4           HB1      GLU   4  -5.298   3.134 -10.637
  186    HG2  GLU   4           HG2      GLU   4  -6.577   4.464 -13.039
  187    HG3  GLU   4           HG1      GLU   4  -7.071   4.742 -11.370
  188    H    ALA   5           HN       ALA   5  -4.991   0.414 -13.742
  189    HA   ALA   5           HA       ALA   5  -4.315  -1.369 -11.696
  190    HB1  ALA   5           HB1      ALA   5  -3.865  -1.959 -14.617
  191    HB2  ALA   5           HB2      ALA   5  -5.487  -1.846 -13.930
  192    HB3  ALA   5           HB3      ALA   5  -4.359  -3.066 -13.337
  193    H    GLU   6           HN       GLU   6  -2.316   0.482 -13.844
  194    HA   GLU   6           HA       GLU   6   0.057  -1.027 -13.768
  195    HB2  GLU   6           HB2      GLU   6  -0.416   1.953 -14.004
  196    HB3  GLU   6           HB1      GLU   6   1.173   1.205 -14.177
  197    HG2  GLU   6           HG2      GLU   6   0.367  -0.161 -16.033
  198    HG3  GLU   6           HG1      GLU   6  -1.262   0.478 -15.829
  199    H    GLU   7           HN       GLU   7  -1.289   1.346 -11.521
  200    HA   GLU   7           HA       GLU   7   0.971   1.570  -9.833
  201    HB2  GLU   7           HB2      GLU   7  -1.978   2.035  -9.400
  202    HB3  GLU   7           HB1      GLU   7  -0.795   2.285  -8.114
  203    HG2  GLU   7           HG2      GLU   7  -0.619   3.590 -10.844
  204    HG3  GLU   7           HG1      GLU   7  -1.328   4.366  -9.429
  205    H    ILE   8           HN       ILE   8  -1.757  -0.660  -9.901
  206    HA   ILE   8           HA       ILE   8  -1.299  -1.932  -7.419
  207    HB   ILE   8           HB       ILE   8  -2.629  -2.781  -9.985
  208   HG12  ILE   8          HG12      ILE   8  -4.627  -2.685  -8.591
  209   HG13  ILE   8          HG11      ILE   8  -3.647  -2.396  -7.157
  210   HG21  ILE   8          HG21      ILE   8  -1.792  -4.865  -9.241
  211   HG22  ILE   8          HG22      ILE   8  -3.408  -4.787  -8.555
  212   HG23  ILE   8          HG23      ILE   8  -2.011  -4.440  -7.543
  213   HD11  ILE   8          HD11      ILE   8  -2.985  -0.241  -7.911
  214   HD12  ILE   8          HD12      ILE   8  -4.713  -0.332  -8.243
  215   HD13  ILE   8          HD13      ILE   8  -3.554  -0.559  -9.553
  216    H    THR   9           HN       THR   9  -0.101  -2.653 -10.690
  217    HA   THR   9           HA       THR   9   1.374  -4.970 -10.042
  218    HB   THR   9           HB       THR   9   1.903  -2.889 -12.177
  219    HG1  THR   9           HG1      THR   9   0.462  -5.329 -12.136
  220   HG21  THR   9          HG21      THR   9   3.890  -4.177 -11.936
  221   HG22  THR   9          HG22      THR   9   3.018  -4.914 -13.280
  222   HG23  THR   9          HG23      THR   9   2.983  -5.667 -11.687
  223    H    ARG  10           HN       ARG  10   2.252  -1.530 -10.028
  224    HA   ARG  10           HA       ARG  10   4.980  -1.843  -9.359
  225    HB2  ARG  10           HB2      ARG  10   3.845   0.280 -10.141
  226    HB3  ARG  10           HB1      ARG  10   3.194   0.446  -8.510
  227    HG2  ARG  10           HG2      ARG  10   5.626   0.217  -7.702
  228    HG3  ARG  10           HG1      ARG  10   6.089   0.478  -9.381
  229    HD2  ARG  10           HD2      ARG  10   4.469   2.351  -7.637
  230    HD3  ARG  10           HD1      ARG  10   6.109   2.613  -8.222
  231    HE   ARG  10           HE       ARG  10   3.660   2.956  -9.727
  232   HH11  ARG  10          HH11      ARG  10   3.927   3.788 -11.828
  233   HH12  ARG  10          HH12      ARG  10   5.504   3.824 -12.544
  234   HH21  ARG  10          HH21      ARG  10   7.073   2.407  -9.796
  235   HH22  ARG  10          HH22      ARG  10   7.285   3.042 -11.393
  236    H    CYS  11           HN       CYS  11   2.047  -1.600  -7.379
  237    HA   CYS  11           HA       CYS  11   3.192  -1.368  -4.849
  238    HB2  CYS  11           HB2      CYS  11   0.703  -1.351  -5.550
  239    HB3  CYS  11           HB1      CYS  11   0.782  -3.101  -5.366
  240    H    LYS  12           HN       LYS  12   2.387  -4.324  -6.672
  241    HA   LYS  12           HA       LYS  12   3.297  -6.168  -4.741
  242    HB2  LYS  12           HB2      LYS  12   1.881  -6.766  -6.692
  243    HB3  LYS  12           HB1      LYS  12   3.265  -6.492  -7.750
  244    HG2  LYS  12           HG2      LYS  12   4.538  -8.235  -6.566
  245    HG3  LYS  12           HG1      LYS  12   3.173  -8.498  -5.480
  246    HD2  LYS  12           HD2      LYS  12   1.767  -9.146  -7.400
  247    HD3  LYS  12           HD1      LYS  12   3.133  -8.889  -8.486
  248    HE2  LYS  12           HE2      LYS  12   4.415 -10.625  -7.296
  249    HE3  LYS  12           HE1      LYS  12   3.057 -10.882  -6.201
  250    HZ1  LYS  12           HZ1      LYS  12   2.568 -11.048  -9.083
  251    HZ2  LYS  12           HZ2      LYS  12   1.825 -11.889  -7.807
  252    HZ3  LYS  12           HZ3      LYS  12   3.375 -12.341  -8.337
  253    H    LYS  13           HN       LYS  13   4.943  -4.623  -7.481
  254    HA   LYS  13           HA       LYS  13   7.393  -5.975  -7.219
  255    HB2  LYS  13           HB2      LYS  13   6.804  -4.670  -9.218
  256    HB3  LYS  13           HB1      LYS  13   6.864  -3.185  -8.270
  257    HG2  LYS  13           HG2      LYS  13   8.971  -3.454  -9.468
  258    HG3  LYS  13           HG1      LYS  13   9.263  -3.663  -7.748
  259    HD2  LYS  13           HD2      LYS  13   9.459  -6.013  -7.937
  260    HD3  LYS  13           HD1      LYS  13   8.679  -6.034  -9.521
  261    HE2  LYS  13           HE2      LYS  13  11.117  -6.357  -9.712
  262    HE3  LYS  13           HE1      LYS  13  10.614  -4.850 -10.479
  263    HZ1  LYS  13           HZ1      LYS  13  12.622  -4.826  -8.901
  264    HZ2  LYS  13           HZ2      LYS  13  11.465  -4.877  -7.658
  265    HZ3  LYS  13           HZ3      LYS  13  11.471  -3.589  -8.766
  266    H    LEU  14           HN       LEU  14   6.196  -2.964  -5.794
  267    HA   LEU  14           HA       LEU  14   8.585  -2.184  -4.513
  268    HB2  LEU  14           HB2      LEU  14   5.678  -1.657  -3.857
  269    HB3  LEU  14           HB1      LEU  14   7.012  -0.905  -2.992
  270    HG   LEU  14           HG       LEU  14   6.848  -0.774  -6.005
  271   HD11  LEU  14          HD11      LEU  14   4.792   0.226  -5.461
  272   HD12  LEU  14          HD12      LEU  14   5.890   1.602  -5.482
  273   HD13  LEU  14          HD13      LEU  14   5.400   0.890  -3.945
  274   HD21  LEU  14          HD21      LEU  14   8.094   1.404  -5.460
  275   HD22  LEU  14          HD22      LEU  14   8.972  -0.088  -5.158
  276   HD23  LEU  14          HD23      LEU  14   8.241   0.788  -3.815
  277    H    LEU  15           HN       LEU  15   5.895  -4.222  -3.443
  278    HA   LEU  15           HA       LEU  15   6.836  -4.628  -0.798
  279    HB2  LEU  15           HB2      LEU  15   5.007  -6.265  -2.563
  280    HB3  LEU  15           HB1      LEU  15   5.323  -6.647  -0.875
  281    HG   LEU  15           HG       LEU  15   4.309  -3.945  -1.803
  282   HD11  LEU  15          HD11      LEU  15   2.680  -5.748  -2.336
  283   HD12  LEU  15          HD12      LEU  15   2.092  -4.683  -1.059
  284   HD13  LEU  15          HD13      LEU  15   2.737  -6.273  -0.653
  285   HD21  LEU  15          HD21      LEU  15   5.171  -3.608   0.333
  286   HD22  LEU  15          HD22      LEU  15   4.856  -5.265   0.847
  287   HD23  LEU  15          HD23      LEU  15   3.537  -4.108   0.738
  288    H    ASP  16           HN       ASP  16   7.357  -6.357  -3.829
  289    HA   ASP  16           HA       ASP  16   8.734  -8.580  -2.773
  290    HB2  ASP  16           HB2      ASP  16   8.837  -7.230  -5.471
  291    HB3  ASP  16           HB1      ASP  16   9.733  -8.703  -5.104
  292    H    ASP  17           HN       ASP  17   9.797  -5.351  -3.688
  293    HA   ASP  17           HA       ASP  17  12.584  -5.807  -3.567
  294    HB2  ASP  17           HB2      ASP  17  10.917  -3.318  -3.190
  295    HB3  ASP  17           HB1      ASP  17  12.680  -3.303  -3.164
  296    H    SER  18           HN       SER  18  10.268  -5.936  -1.147
  297    HA   SER  18           HA       SER  18  11.479  -4.748   1.054
  298    HB2  SER  18           HB2      SER  18   9.190  -5.668   1.089
  299    HB3  SER  18           HB1      SER  18   9.855  -7.294   0.988
  300    HG   SER  18           HG       SER  18   9.371  -6.582   3.152
  301    H    SER  19           HN       SER  19  12.120  -7.806  -0.491
  302    HA   SER  19           HA       SER  19  13.885  -8.747   1.584
  303    HB2  SER  19           HB2      SER  19  14.344 -10.605   0.084
  304    HB3  SER  19           HB1      SER  19  12.611 -10.295   0.110
  305    HG   SER  19           HG       SER  19  12.777 -10.013  -1.957
  306    H    SER  20           HN       SER  20  14.159  -6.510  -0.886
  307    HA   SER  20           HA       SER  20  16.957  -6.946  -1.498
  308    HB2  SER  20           HB2      SER  20  15.373  -4.454  -2.101
  309    HB3  SER  20           HB1      SER  20  16.779  -5.088  -2.952
  310    HG   SER  20           HG       SER  20  14.676  -6.844  -2.771
  311    H1   LYS   1           HN       LYS   1  18.686  -5.658  -0.848
  312    HA   LYS   1           HA       LYS   1  18.386  -4.440   1.768
  313    HB2  LYS   1           HB2      LYS   1  20.786  -4.889  -0.015
  314    HB3  LYS   1           HB1      LYS   1  20.871  -4.141   1.581
  315    HG2  LYS   1           HG2      LYS   1  19.880  -6.164   2.589
  316    HG3  LYS   1           HG1      LYS   1  19.794  -6.915   0.995
  317    HD2  LYS   1           HD2      LYS   1  22.241  -6.767   0.780
  318    HD3  LYS   1           HD1      LYS   1  22.340  -5.999   2.364
  319    HE2  LYS   1           HE2      LYS   1  21.354  -8.005   3.404
  320    HE3  LYS   1           HE1      LYS   1  21.247  -8.776   1.822
  321    HZ1  LYS   1           HZ1      LYS   1  23.252  -9.337   3.229
  322    HZ2  LYS   1           HZ2      LYS   1  23.806  -7.764   2.906
  323    HZ3  LYS   1           HZ3      LYS   1  23.562  -8.860   1.631
  324    H    ASN   2           HN       ASN   2  17.533  -3.304  -1.055
  325    HA   ASN   2           HA       ASN   2  18.962  -0.916  -1.421
  326    HB2  ASN   2           HB2      ASN   2  16.960  -0.189  -2.733
  327    HB3  ASN   2           HB1      ASN   2  17.517  -1.795  -3.168
  328   HD21  ASN   2          HD21      ASN   2  14.854  -1.091  -3.719
  329   HD22  ASN   2          HD22      ASN   2  13.819  -1.932  -2.670
  330    HA   PRO   3           HA       PRO   3  17.597   1.698   1.849
  331    HB2  PRO   3           HB2      PRO   3  17.364   4.107   0.494
  332    HB3  PRO   3           HB1      PRO   3  18.900   3.410   1.040
  333    HG2  PRO   3           HG2      PRO   3  17.637   3.325  -1.664
  334    HG3  PRO   3           HG1      PRO   3  19.337   3.568  -1.220
  335    HD2  PRO   3           HD2      PRO   3  18.453   1.205  -2.115
  336    HD3  PRO   3           HD1      PRO   3  19.711   1.286  -0.875
  337    H    GLU   4           HN       GLU   4  15.721   1.343  -1.034
  338    HA   GLU   4           HA       GLU   4  13.446   2.880  -0.318
  339    HB2  GLU   4           HB2      GLU   4  13.640   0.429  -2.087
  340    HB3  GLU   4           HB1      GLU   4  12.273   1.541  -2.018
  341    HG2  GLU   4           HG2      GLU   4  15.101   2.364  -2.726
  342    HG3  GLU   4           HG1      GLU   4  13.842   2.025  -3.911
  343    H    ALA   5           HN       ALA   5  14.724   0.031   0.979
  344    HA   ALA   5           HA       ALA   5  12.457  -1.461   1.657
  345    HB1  ALA   5           HB1      ALA   5  14.841  -1.156   3.475
  346    HB2  ALA   5           HB2      ALA   5  14.934  -2.062   1.964
  347    HB3  ALA   5           HB3      ALA   5  13.819  -2.573   3.231
  348    H    GLU   6           HN       GLU   6  13.667   1.536   2.918
  349    HA   GLU   6           HA       GLU   6  12.458   1.551   5.458
  350    HB2  GLU   6           HB2      GLU   6  13.115   3.793   3.536
  351    HB3  GLU   6           HB1      GLU   6  12.521   4.064   5.176
  352    HG2  GLU   6           HG2      GLU   6  14.425   2.868   6.111
  353    HG3  GLU   6           HG1      GLU   6  14.993   2.448   4.496
  354    H    GLU   7           HN       GLU   7  11.202   2.344   2.255
  355    HA   GLU   7           HA       GLU   7   8.733   3.442   3.104
  356    HB2  GLU   7           HB2      GLU   7   9.650   2.173   0.528
  357    HB3  GLU   7           HB1      GLU   7   8.003   2.769   0.735
  358    HG2  GLU   7           HG2      GLU   7  10.486   4.444   1.207
  359    HG3  GLU   7           HG1      GLU   7   9.557   4.455  -0.293
  360    H    ILE   8           HN       ILE   8   9.779   0.156   2.395
  361    HA   ILE   8           HA       ILE   8   7.246  -1.099   2.469
  362    HB   ILE   8           HB       ILE   8  10.060  -2.045   2.992
  363   HG12  ILE   8          HG12      ILE   8   9.677  -3.281   0.927
  364   HG13  ILE   8          HG11      ILE   8   7.984  -2.794   0.913
  365   HG21  ILE   8          HG21      ILE   8   8.849  -3.445   4.473
  366   HG22  ILE   8          HG22      ILE   8   8.950  -4.372   2.987
  367   HG23  ILE   8          HG23      ILE   8   7.461  -3.529   3.387
  368   HD11  ILE   8          HD11      ILE   8   8.526  -0.525   0.476
  369   HD12  ILE   8          HD12      ILE   8   9.588  -1.451  -0.584
  370   HD13  ILE   8          HD13      ILE   8  10.222  -0.766   0.910
  371    H    THR   9           HN       THR   9   9.629  -0.436   5.027
  372    HA   THR   9           HA       THR   9   8.245  -1.675   7.151
  373    HB   THR   9           HB       THR   9  10.108   0.712   7.189
  374    HG1  THR   9           HG1      THR   9  10.486  -2.074   7.555
  375   HG21  THR   9          HG21      THR   9   8.905   0.692   9.256
  376   HG22  THR   9          HG22      THR   9  10.456  -0.083   9.583
  377   HG23  THR   9          HG23      THR   9   9.006  -1.065   9.373
  378    H    ARG  10           HN       ARG  10   8.113   1.626   5.851
  379    HA   ARG  10           HA       ARG  10   6.319   2.704   7.753
  380    HB2  ARG  10           HB2      ARG  10   7.671   3.990   6.040
  381    HB3  ARG  10           HB1      ARG  10   6.489   3.481   4.834
  382    HG2  ARG  10           HG2      ARG  10   4.710   4.443   6.425
  383    HG3  ARG  10           HG1      ARG  10   6.048   5.216   7.268
  384    HD2  ARG  10           HD2      ARG  10   5.302   5.567   4.355
  385    HD3  ARG  10           HD1      ARG  10   5.146   6.771   5.631
  386    HE   ARG  10           HE       ARG  10   7.573   6.027   4.242
  387   HH11  ARG  10          HH11      ARG  10   9.415   7.246   4.790
  388   HH12  ARG  10          HH12      ARG  10   9.390   8.249   6.202
  389   HH21  ARG  10          HH21      ARG  10   6.140   7.406   7.070
  390   HH22  ARG  10          HH22      ARG  10   7.537   8.339   7.493
  391    H    CYS  11           HN       CYS  11   5.812   0.965   4.703
  392    HA   CYS  11           HA       CYS  11   3.061   1.298   4.410
  393    HB2  CYS  11           HB2      CYS  11   4.757   0.110   2.864
  394    HB3  CYS  11           HB1      CYS  11   4.435  -1.323   3.838
  395    H    LYS  12           HN       LYS  12   4.826  -1.223   6.209
  396    HA   LYS  12           HA       LYS  12   2.558  -2.615   7.146
  397    HB2  LYS  12           HB2      LYS  12   4.877  -3.502   7.219
  398    HB3  LYS  12           HB1      LYS  12   5.256  -2.339   8.491
  399    HG2  LYS  12           HG2      LYS  12   3.517  -3.318   9.928
  400    HG3  LYS  12           HG1      LYS  12   3.096  -4.461   8.653
  401    HD2  LYS  12           HD2      LYS  12   5.378  -5.398   8.739
  402    HD3  LYS  12           HD1      LYS  12   5.795  -4.261  10.022
  403    HE2  LYS  12           HE2      LYS  12   4.021  -5.228  11.449
  404    HE3  LYS  12           HE1      LYS  12   3.627  -6.377  10.170
  405    HZ1  LYS  12           HZ1      LYS  12   6.414  -6.231  11.016
  406    HZ2  LYS  12           HZ2      LYS  12   5.493  -7.576  10.534
  407    HZ3  LYS  12           HZ3      LYS  12   5.321  -6.941  12.101
  408    H    LYS  13           HN       LYS  13   4.433   0.053   8.550
  409    HA   LYS  13           HA       LYS  13   3.041   0.206  10.987
  410    HB2  LYS  13           HB2      LYS  13   5.194   1.338  10.607
  411    HB3  LYS  13           HB1      LYS  13   4.420   2.417   9.447
  412    HG2  LYS  13           HG2      LYS  13   4.576   3.548  11.599
  413    HG3  LYS  13           HG1      LYS  13   2.887   3.200  11.265
  414    HD2  LYS  13           HD2      LYS  13   2.819   1.405  12.803
  415    HD3  LYS  13           HD1      LYS  13   4.579   1.276  12.858
  416    HE2  LYS  13           HE2      LYS  13   3.680   2.346  14.894
  417    HE3  LYS  13           HE1      LYS  13   4.699   3.460  13.981
  418    HZ1  LYS  13           HZ1      LYS  13   2.440   4.286  14.806
  419    HZ2  LYS  13           HZ2      LYS  13   1.783   3.363  13.541
  420    HZ3  LYS  13           HZ3      LYS  13   2.871   4.623  13.201
  421    H    LEU  14           HN       LEU  14   2.506   1.774   7.858
  422    HA   LEU  14           HA       LEU  14   0.388   3.460   8.647
  423    HB2  LEU  14           HB2      LEU  14   1.094   2.213   5.982
  424    HB3  LEU  14           HB1      LEU  14  -0.208   3.378   6.181
  425    HG   LEU  14           HG       LEU  14   2.578   3.977   7.185
  426   HD11  LEU  14          HD11      LEU  14   3.051   3.588   4.914
  427   HD12  LEU  14          HD12      LEU  14   2.708   5.316   4.948
  428   HD13  LEU  14          HD13      LEU  14   1.479   4.185   4.382
  429   HD21  LEU  14          HD21      LEU  14   1.702   6.333   6.637
  430   HD22  LEU  14          HD22      LEU  14   0.949   5.520   8.001
  431   HD23  LEU  14          HD23      LEU  14   0.117   5.584   6.448
  432    H    LEU  15           HN       LEU  15   0.418   0.141   7.413
  433    HA   LEU  15           HA       LEU  15  -2.395  -0.175   7.280
  434    HB2  LEU  15           HB2      LEU  15  -0.151  -2.177   7.564
  435    HB3  LEU  15           HB1      LEU  15  -1.835  -2.635   7.346
  436    HG   LEU  15           HG       LEU  15  -0.366  -0.779   5.452
  437   HD11  LEU  15          HD11      LEU  15   0.682  -3.039   5.500
  438   HD12  LEU  15          HD12      LEU  15  -0.121  -2.707   3.965
  439   HD13  LEU  15          HD13      LEU  15  -0.895  -3.753   5.157
  440   HD21  LEU  15          HD21      LEU  15  -2.644  -0.453   5.067
  441   HD22  LEU  15          HD22      LEU  15  -3.075  -2.096   5.537
  442   HD23  LEU  15          HD23      LEU  15  -2.324  -1.791   3.977
  443    H    ASP  16           HN       ASP  16  -0.030  -0.751   9.829
  444    HA   ASP  16           HA       ASP  16  -1.742  -2.045  11.659
  445    HB2  ASP  16           HB2      ASP  16   0.742  -0.372  12.038
  446    HB3  ASP  16           HB1      ASP  16  -0.090  -1.161  13.378
  447    H    ASP  17           HN       ASP  17  -1.120   1.360  10.999
  448    HA   ASP  17           HA       ASP  17  -2.475   2.449  13.223
  449    HB2  ASP  17           HB2      ASP  17  -1.904   3.537  10.466
  450    HB3  ASP  17           HB1      ASP  17  -2.692   4.487  11.724
  451    H    SER  18           HN       SER  18  -3.659   0.647  10.657
  452    HA   SER  18           HA       SER  18  -6.067   1.858   9.989
  453    HB2  SER  18           HB2      SER  18  -5.189  -0.129   8.835
  454    HB3  SER  18           HB1      SER  18  -5.494  -1.093  10.275
  455    HG   SER  18           HG       SER  18  -7.181  -1.168   8.658
  456    H    SER  19           HN       SER  19  -5.196  -0.015  12.795
  457    HA   SER  19           HA       SER  19  -7.896  -0.221  13.782
  458    HB2  SER  19           HB2      SER  19  -6.902  -1.238  15.746
  459    HB3  SER  19           HB1      SER  19  -6.126  -1.903  14.312
  460    HG   SER  19           HG       SER  19  -4.340  -1.197  15.144
  461    H    SER  20           HN       SER  20  -5.592   2.210  13.708
  462    HA   SER  20           HA       SER  20  -6.279   3.477  16.217
  463    HB2  SER  20           HB2      SER  20  -4.854   4.782  13.908
  464    HB3  SER  20           HB1      SER  20  -4.738   5.167  15.623
  465    HG   SER  20           HG       SER  20  -4.156   2.560  15.068
  466    H2   ZBR 100           HA3      TBS 100  -1.490   0.726  -2.029
  467    H4   ZBR 100           HC3      TBS 100   0.187   1.411   1.887
  468    H6   ZBR 100           HB3      TBS 100   2.683  -0.090  -1.290
  469    H7   ZBR 100          HB11      TBS 100   1.617   0.292  -3.688
  470    H7A  ZBR 100          HB12      TBS 100  -0.130   0.047  -3.800
  471    H8   ZBR 100          HA11      TBS 100  -2.576   2.269  -0.191
  472    H8A  ZBR 100          HA12      TBS 100  -2.043   1.993   1.472
  473    H9   ZBR 100          HC11      TBS 100   2.824   1.578   1.842
  474    H9A  ZBR 100          HC12      TBS 100   3.650   0.439   0.773
  Start of MODEL   12
    1    H1   LYS   1           HN       LYS   1  -7.603   5.567  16.699
    2    HA   LYS   1           HA       LYS   1  -9.621   5.955  14.689
    3    HB2  LYS   1           HB2      LYS   1  -9.022   7.411  17.271
    4    HB3  LYS   1           HB1      LYS   1 -10.396   7.786  16.230
    5    HG2  LYS   1           HG2      LYS   1 -11.207   5.471  16.448
    6    HG3  LYS   1           HG1      LYS   1  -9.831   5.083  17.482
    7    HD2  LYS   1           HD2      LYS   1 -10.577   6.779  19.115
    8    HD3  LYS   1           HD1      LYS   1 -11.956   7.160  18.084
    9    HE2  LYS   1           HE2      LYS   1 -12.777   4.851  18.304
   10    HE3  LYS   1           HE1      LYS   1 -11.390   4.446  19.314
   11    HZ1  LYS   1           HZ1      LYS   1 -12.364   5.337  21.080
   12    HZ2  LYS   1           HZ2      LYS   1 -13.793   5.447  20.167
   13    HZ3  LYS   1           HZ3      LYS   1 -12.734   6.773  20.257
   14    H    ASN   2           HN       ASN   2  -6.603   6.689  14.417
   15    HA   ASN   2           HA       ASN   2  -6.392   9.454  14.074
   16    HB2  ASN   2           HB2      ASN   2  -4.481   8.862  12.519
   17    HB3  ASN   2           HB1      ASN   2  -4.389   8.134  14.118
   18   HD21  ASN   2          HD21      ASN   2  -3.153   7.078  11.659
   19   HD22  ASN   2          HD22      ASN   2  -3.852   5.556  11.387
   20    HA   PRO   3           HA       PRO   3  -8.708  10.332  10.408
   21    HB2  PRO   3           HB2      PRO   3  -7.169  12.339   9.284
   22    HB3  PRO   3           HB1      PRO   3  -8.235  12.578  10.681
   23    HG2  PRO   3           HG2      PRO   3  -5.281  12.124  10.617
   24    HG3  PRO   3           HG1      PRO   3  -6.224  13.259  11.600
   25    HD2  PRO   3           HD2      PRO   3  -5.314  10.939  12.628
   26    HD3  PRO   3           HD1      PRO   3  -6.879  11.613  13.121
   27    H    GLU   4           HN       GLU   4  -5.421   9.316  10.236
   28    HA   GLU   4           HA       GLU   4  -5.097   9.138   7.431
   29    HB2  GLU   4           HB2      GLU   4  -3.802   7.601   9.689
   30    HB3  GLU   4           HB1      GLU   4  -3.311   7.468   8.000
   31    HG2  GLU   4           HG2      GLU   4  -2.820   9.864   7.921
   32    HG3  GLU   4           HG1      GLU   4  -3.378  10.054   9.583
   33    H    ALA   5           HN       ALA   5  -7.113   7.455   9.536
   34    HA   ALA   5           HA       ALA   5  -7.123   4.851   8.526
   35    HB1  ALA   5           HB1      ALA   5  -9.235   4.600   9.577
   36    HB2  ALA   5           HB2      ALA   5  -9.622   6.311   9.387
   37    HB3  ALA   5           HB3      ALA   5  -8.394   5.809  10.550
   38    H    GLU   6           HN       GLU   6  -8.530   7.817   7.253
   39    HA   GLU   6           HA       GLU   6 -10.267   6.667   5.350
   40    HB2  GLU   6           HB2      GLU   6  -8.775   9.302   5.422
   41    HB3  GLU   6           HB1      GLU   6  -9.929   8.891   4.153
   42    HG2  GLU   6           HG2      GLU   6 -11.216  10.082   5.744
   43    HG3  GLU   6           HG1      GLU   6 -11.583   8.395   6.080
   44    H    GLU   7           HN       GLU   7  -6.827   7.482   5.244
   45    HA   GLU   7           HA       GLU   7  -6.441   6.922   2.493
   46    HB2  GLU   7           HB2      GLU   7  -4.797   8.193   3.803
   47    HB3  GLU   7           HB1      GLU   7  -4.461   6.768   4.784
   48    HG2  GLU   7           HG2      GLU   7  -2.749   7.012   3.045
   49    HG3  GLU   7           HG1      GLU   7  -3.698   5.564   2.742
   50    H    ILE   8           HN       ILE   8  -6.312   4.953   5.409
   51    HA   ILE   8           HA       ILE   8  -5.234   2.608   4.238
   52    HB   ILE   8           HB       ILE   8  -7.201   2.774   6.540
   53   HG12  ILE   8          HG12      ILE   8  -5.360   4.295   6.974
   54   HG13  ILE   8          HG11      ILE   8  -5.123   2.858   7.957
   55   HG21  ILE   8          HG21      ILE   8  -6.670   0.585   7.034
   56   HG22  ILE   8          HG22      ILE   8  -5.004   0.746   6.487
   57   HG23  ILE   8          HG23      ILE   8  -6.293   0.493   5.320
   58   HD11  ILE   8          HD11      ILE   8  -3.631   3.731   5.495
   59   HD12  ILE   8          HD12      ILE   8  -3.669   2.027   5.953
   60   HD13  ILE   8          HD13      ILE   8  -2.992   3.223   7.058
   61    H    THR   9           HN       THR   9  -8.575   3.748   4.631
   62    HA   THR   9           HA       THR   9  -9.869   1.451   3.649
   63    HB   THR   9           HB       THR   9 -10.697   4.362   3.502
   64    HG1  THR   9           HG1      THR   9 -10.688   3.902   5.580
   65   HG21  THR   9          HG21      THR   9 -12.194   1.788   2.976
   66   HG22  THR   9          HG22      THR   9 -12.020   3.182   1.909
   67   HG23  THR   9          HG23      THR   9 -13.014   3.302   3.361
   68    H    ARG  10           HN       ARG  10  -8.630   4.341   2.002
   69    HA   ARG  10           HA       ARG  10  -9.534   3.648  -0.587
   70    HB2  ARG  10           HB2      ARG  10  -7.264   5.404   0.357
   71    HB3  ARG  10           HB1      ARG  10  -7.694   5.220  -1.343
   72    HG2  ARG  10           HG2      ARG  10 -10.053   5.908  -0.729
   73    HG3  ARG  10           HG1      ARG  10  -9.446   6.294   0.882
   74    HD2  ARG  10           HD2      ARG  10  -8.320   7.466  -1.671
   75    HD3  ARG  10           HD1      ARG  10  -9.532   8.266  -0.677
   76    HE   ARG  10           HE       ARG  10  -6.703   7.913  -0.036
   77   HH11  ARG  10          HH11      ARG  10  -6.026   9.091   1.811
   78   HH12  ARG  10          HH12      ARG  10  -7.204   9.786   2.867
   79   HH21  ARG  10          HH21      ARG  10  -9.917   8.677   1.027
   80   HH22  ARG  10          HH22      ARG  10  -9.398   9.558   2.424
   81    H    CYS  11           HN       CYS  11  -6.578   2.907   1.200
   82    HA   CYS  11           HA       CYS  11  -5.039   1.801  -0.836
   83    HB2  CYS  11           HB2      CYS  11  -4.390   2.187   1.588
   84    HB3  CYS  11           HB1      CYS  11  -5.226   0.681   1.959
   85    H    LYS  12           HN       LYS  12  -7.454   0.209   1.245
   86    HA   LYS  12           HA       LYS  12  -7.238  -2.349   0.043
   87    HB2  LYS  12           HB2      LYS  12  -9.459  -0.998   1.572
   88    HB3  LYS  12           HB1      LYS  12  -9.539  -2.680   1.050
   89    HG2  LYS  12           HG2      LYS  12  -7.412  -3.129   2.269
   90    HG3  LYS  12           HG1      LYS  12  -7.422  -1.467   2.853
   91    HD2  LYS  12           HD2      LYS  12  -9.727  -3.367   3.330
   92    HD3  LYS  12           HD1      LYS  12  -8.376  -3.225   4.452
   93    HE2  LYS  12           HE2      LYS  12  -8.862  -0.729   4.545
   94    HE3  LYS  12           HE1      LYS  12 -10.346  -1.063   3.656
   95    HZ1  LYS  12           HZ1      LYS  12 -11.299  -1.615   5.548
   96    HZ2  LYS  12           HZ2      LYS  12  -9.849  -1.369   6.399
   97    HZ3  LYS  12           HZ3      LYS  12 -10.201  -2.893   5.738
   98    H    LYS  13           HN       LYS  13  -9.345   0.424  -0.582
   99    HA   LYS  13           HA       LYS  13 -10.956  -0.810  -2.555
  100    HB2  LYS  13           HB2      LYS  13 -11.576   1.290  -1.389
  101    HB3  LYS  13           HB1      LYS  13 -10.299   2.130  -2.272
  102    HG2  LYS  13           HG2      LYS  13 -11.359   1.580  -4.403
  103    HG3  LYS  13           HG1      LYS  13 -12.598   0.636  -3.572
  104    HD2  LYS  13           HD2      LYS  13 -13.332   2.678  -2.375
  105    HD3  LYS  13           HD1      LYS  13 -12.125   3.614  -3.255
  106    HE2  LYS  13           HE2      LYS  13 -14.369   2.034  -4.544
  107    HE3  LYS  13           HE1      LYS  13 -14.374   3.780  -4.300
  108    HZ1  LYS  13           HZ1      LYS  13 -12.228   3.792  -5.586
  109    HZ2  LYS  13           HZ2      LYS  13 -13.626   3.430  -6.481
  110    HZ3  LYS  13           HZ3      LYS  13 -12.565   2.186  -6.016
  111    H    LEU  14           HN       LEU  14  -7.923   0.973  -2.722
  112    HA   LEU  14           HA       LEU  14  -7.755   1.239  -5.519
  113    HB2  LEU  14           HB2      LEU  14  -5.689   1.092  -3.323
  114    HB3  LEU  14           HB1      LEU  14  -5.240   1.345  -5.005
  115    HG   LEU  14           HG       LEU  14  -7.335   3.098  -3.704
  116   HD11  LEU  14          HD11      LEU  14  -5.632   3.562  -2.182
  117   HD12  LEU  14          HD12      LEU  14  -5.245   4.717  -3.448
  118   HD13  LEU  14          HD13      LEU  14  -4.348   3.202  -3.335
  119   HD21  LEU  14          HD21      LEU  14  -7.145   3.371  -6.095
  120   HD22  LEU  14          HD22      LEU  14  -5.383   3.404  -6.010
  121   HD23  LEU  14          HD23      LEU  14  -6.325   4.745  -5.358
  122    H    LEU  15           HN       LEU  15  -6.682  -1.335  -3.334
  123    HA   LEU  15           HA       LEU  15  -5.397  -2.905  -5.311
  124    HB2  LEU  15           HB2      LEU  15  -6.612  -3.615  -2.642
  125    HB3  LEU  15           HB1      LEU  15  -5.715  -4.764  -3.634
  126    HG   LEU  15           HG       LEU  15  -4.613  -2.090  -2.723
  127   HD11  LEU  15          HD11      LEU  15  -5.114  -3.691  -0.847
  128   HD12  LEU  15          HD12      LEU  15  -3.411  -3.265  -1.004
  129   HD13  LEU  15          HD13      LEU  15  -3.988  -4.825  -1.591
  130   HD21  LEU  15          HD21      LEU  15  -3.249  -2.661  -4.518
  131   HD22  LEU  15          HD22      LEU  15  -3.523  -4.392  -4.322
  132   HD23  LEU  15          HD23      LEU  15  -2.420  -3.545  -3.240
  133    H    ASP  16           HN       ASP  16  -8.705  -2.792  -4.106
  134    HA   ASP  16           HA       ASP  16  -9.685  -5.086  -5.415
  135    HB2  ASP  16           HB2      ASP  16 -11.030  -2.540  -4.511
  136    HB3  ASP  16           HB1      ASP  16 -11.918  -3.890  -5.214
  137    H    ASP  17           HN       ASP  17  -9.308  -1.754  -6.480
  138    HA   ASP  17           HA       ASP  17 -10.751  -1.973  -8.904
  139    HB2  ASP  17           HB2      ASP  17  -8.536  -0.119  -8.021
  140    HB3  ASP  17           HB1      ASP  17  -9.335   0.021  -9.587
  141    H    SER  18           HN       SER  18  -7.863  -3.410  -7.933
  142    HA   SER  18           HA       SER  18  -6.310  -3.349 -10.257
  143    HB2  SER  18           HB2      SER  18  -5.239  -5.362  -9.383
  144    HB3  SER  18           HB1      SER  18  -5.507  -4.199  -8.085
  145    HG   SER  18           HG       SER  18  -7.547  -5.406  -7.764
  146    H    SER  19           HN       SER  19  -9.222  -4.979  -9.560
  147    HA   SER  19           HA       SER  19  -8.932  -6.992 -11.621
  148    HB2  SER  19           HB2      SER  19 -11.335  -6.152  -9.992
  149    HB3  SER  19           HB1      SER  19 -11.301  -7.521 -11.101
  150    HG   SER  19           HG       SER  19  -9.938  -7.137  -8.667
  151    H    SER  20           HN       SER  20  -9.894  -3.766 -11.462
  152    HA   SER  20           HA       SER  20 -11.629  -3.800 -13.783
  153    HB2  SER  20           HB2      SER  20 -10.410  -1.461 -12.303
  154    HB3  SER  20           HB1      SER  20 -11.655  -1.362 -13.544
  155    HG   SER  20           HG       SER  20 -11.822  -2.692 -11.039
  156    H1   LYS   1           HN       LYS   1 -11.170  -2.857 -15.795
  157    HA   LYS   1           HA       LYS   1  -8.474  -3.266 -16.704
  158    HB2  LYS   1           HB2      LYS   1 -10.947  -2.224 -18.098
  159    HB3  LYS   1           HB1      LYS   1  -9.398  -2.481 -18.904
  160    HG2  LYS   1           HG2      LYS   1  -9.442  -4.856 -18.254
  161    HG3  LYS   1           HG1      LYS   1 -10.985  -4.608 -17.437
  162    HD2  LYS   1           HD2      LYS   1 -12.012  -3.926 -19.575
  163    HD3  LYS   1           HD1      LYS   1 -10.470  -4.181 -20.394
  164    HE2  LYS   1           HE2      LYS   1 -10.509  -6.558 -19.753
  165    HE3  LYS   1           HE1      LYS   1 -12.040  -6.312 -18.914
  166    HZ1  LYS   1           HZ1      LYS   1 -13.154  -6.423 -20.815
  167    HZ2  LYS   1           HZ2      LYS   1 -11.724  -6.977 -21.546
  168    HZ3  LYS   1           HZ3      LYS   1 -12.118  -5.325 -21.588
  169    H    ASN   2           HN       ASN   2  -9.461  -0.974 -14.830
  170    HA   ASN   2           HA       ASN   2  -9.031   1.467 -16.119
  171    HB2  ASN   2           HB2      ASN   2  -8.482   2.309 -13.790
  172    HB3  ASN   2           HB1      ASN   2 -10.023   1.477 -13.938
  173   HD21  ASN   2          HD21      ASN   2  -8.423   1.727 -11.475
  174   HD22  ASN   2          HD22      ASN   2  -8.008   0.149 -11.011
  175    HA   PRO   3           HA       PRO   3  -4.672   1.619 -16.863
  176    HB2  PRO   3           HB2      PRO   3  -4.161   4.306 -16.445
  177    HB3  PRO   3           HB1      PRO   3  -4.950   3.666 -17.900
  178    HG2  PRO   3           HG2      PRO   3  -6.182   4.897 -15.468
  179    HG3  PRO   3           HG1      PRO   3  -6.580   5.144 -17.181
  180    HD2  PRO   3           HD2      PRO   3  -8.076   3.537 -15.620
  181    HD3  PRO   3           HD1      PRO   3  -7.792   3.154 -17.328
  182    H    GLU   4           HN       GLU   4  -5.999   2.589 -13.836
  183    HA   GLU   4           HA       GLU   4  -3.622   3.140 -12.402
  184    HB2  GLU   4           HB2      GLU   4  -6.333   2.174 -11.479
  185    HB3  GLU   4           HB1      GLU   4  -5.030   2.633 -10.383
  186    HG2  GLU   4           HG2      GLU   4  -4.966   4.880 -11.347
  187    HG3  GLU   4           HG1      GLU   4  -6.209   4.437 -12.516
  188    H    ALA   5           HN       ALA   5  -4.800   0.275 -13.723
  189    HA   ALA   5           HA       ALA   5  -4.084  -1.670 -11.850
  190    HB1  ALA   5           HB1      ALA   5  -4.145  -3.221 -13.650
  191    HB2  ALA   5           HB2      ALA   5  -3.695  -1.991 -14.830
  192    HB3  ALA   5           HB3      ALA   5  -5.300  -1.965 -14.098
  193    H    GLU   6           HN       GLU   6  -2.115   0.226 -14.071
  194    HA   GLU   6           HA       GLU   6   0.252  -1.300 -13.937
  195    HB2  GLU   6           HB2      GLU   6  -0.244   1.653 -14.372
  196    HB3  GLU   6           HB1      GLU   6   1.358   0.926 -14.487
  197    HG2  GLU   6           HG2      GLU   6   0.571   0.909 -16.714
  198    HG3  GLU   6           HG1      GLU   6   0.264  -0.731 -16.159
  199    H    GLU   7           HN       GLU   7  -1.045   1.258 -11.868
  200    HA   GLU   7           HA       GLU   7   1.233   1.517 -10.203
  201    HB2  GLU   7           HB2      GLU   7  -0.536   3.216 -10.243
  202    HB3  GLU   7           HB1      GLU   7  -1.682   2.056  -9.576
  203    HG2  GLU   7           HG2      GLU   7  -0.814   3.507  -7.798
  204    HG3  GLU   7           HG1      GLU   7  -0.276   1.855  -7.535
  205    H    ILE   8           HN       ILE   8  -1.607  -0.562 -10.115
  206    HA   ILE   8           HA       ILE   8  -1.182  -1.672  -7.542
  207    HB   ILE   8           HB       ILE   8  -2.426  -3.033  -9.948
  208   HG12  ILE   8          HG12      ILE   8  -3.470  -0.862  -9.647
  209   HG13  ILE   8          HG11      ILE   8  -4.572  -2.086  -9.037
  210   HG21  ILE   8          HG21      ILE   8  -3.246  -4.631  -8.504
  211   HG22  ILE   8          HG22      ILE   8  -3.466  -3.486  -7.186
  212   HG23  ILE   8          HG23      ILE   8  -1.878  -4.165  -7.505
  213   HD11  ILE   8          HD11      ILE   8  -2.905  -0.109  -7.502
  214   HD12  ILE   8          HD12      ILE   8  -3.432  -1.607  -6.734
  215   HD13  ILE   8          HD13      ILE   8  -4.624  -0.464  -7.350
  216    H    THR   9           HN       THR   9  -0.039  -2.634 -10.766
  217    HA   THR   9           HA       THR   9   1.219  -5.034 -10.011
  218    HB   THR   9           HB       THR   9   1.930  -3.077 -12.213
  219    HG1  THR   9           HG1      THR   9   0.006  -3.832 -12.737
  220   HG21  THR   9          HG21      THR   9   2.844  -5.891 -11.610
  221   HG22  THR   9          HG22      THR   9   3.835  -4.462 -11.899
  222   HG23  THR   9          HG23      THR   9   2.941  -5.198 -13.229
  223    H    ARG  10           HN       ARG  10   2.402  -1.689 -10.119
  224    HA   ARG  10           HA       ARG  10   5.069  -2.266  -9.372
  225    HB2  ARG  10           HB2      ARG  10   3.385   0.229  -9.096
  226    HB3  ARG  10           HB1      ARG  10   5.085   0.164  -8.629
  227    HG2  ARG  10           HG2      ARG  10   5.602  -0.660 -10.967
  228    HG3  ARG  10           HG1      ARG  10   3.923  -0.318 -11.385
  229    HD2  ARG  10           HD2      ARG  10   5.824   1.730 -10.225
  230    HD3  ARG  10           HD1      ARG  10   5.516   1.547 -11.947
  231    HE   ARG  10           HE       ARG  10   3.697   2.666  -9.957
  232   HH11  ARG  10          HH11      ARG  10   1.831   3.646 -10.865
  233   HH12  ARG  10          HH12      ARG  10   1.440   3.373 -12.526
  234   HH21  ARG  10          HH21      ARG  10   4.178   1.343 -13.127
  235   HH22  ARG  10          HH22      ARG  10   2.764   2.079 -13.804
  236    H    CYS  11           HN       CYS  11   2.146  -1.603  -7.498
  237    HA   CYS  11           HA       CYS  11   3.250  -1.296  -4.964
  238    HB2  CYS  11           HB2      CYS  11   0.820  -1.070  -5.648
  239    HB3  CYS  11           HB1      CYS  11   0.719  -2.827  -5.554
  240    H    LYS  12           HN       LYS  12   2.266  -4.303  -6.607
  241    HA   LYS  12           HA       LYS  12   3.058  -6.045  -4.519
  242    HB2  LYS  12           HB2      LYS  12   2.719  -6.449  -7.487
  243    HB3  LYS  12           HB1      LYS  12   3.094  -7.767  -6.378
  244    HG2  LYS  12           HG2      LYS  12   1.063  -7.199  -5.055
  245    HG3  LYS  12           HG1      LYS  12   0.668  -5.950  -6.235
  246    HD2  LYS  12           HD2      LYS  12   1.056  -8.847  -7.013
  247    HD3  LYS  12           HD1      LYS  12  -0.514  -8.202  -6.543
  248    HE2  LYS  12           HE2      LYS  12  -0.208  -6.438  -8.350
  249    HE3  LYS  12           HE1      LYS  12   1.196  -7.352  -8.897
  250    HZ1  LYS  12           HZ1      LYS  12  -0.150  -8.679 -10.000
  251    HZ2  LYS  12           HZ2      LYS  12  -1.510  -7.836  -9.430
  252    HZ3  LYS  12           HZ3      LYS  12  -0.892  -9.153  -8.551
  253    H    LYS  13           HN       LYS  13   4.733  -4.812  -7.378
  254    HA   LYS  13           HA       LYS  13   7.097  -6.337  -7.071
  255    HB2  LYS  13           HB2      LYS  13   6.472  -5.175  -9.171
  256    HB3  LYS  13           HB1      LYS  13   6.795  -3.628  -8.385
  257    HG2  LYS  13           HG2      LYS  13   9.124  -4.262  -8.009
  258    HG3  LYS  13           HG1      LYS  13   8.823  -5.862  -8.687
  259    HD2  LYS  13           HD2      LYS  13   8.217  -4.822 -10.851
  260    HD3  LYS  13           HD1      LYS  13   8.566  -3.232 -10.173
  261    HE2  LYS  13           HE2      LYS  13  10.565  -5.503 -10.386
  262    HE3  LYS  13           HE1      LYS  13  10.479  -4.126 -11.485
  263    HZ1  LYS  13           HZ1      LYS  13  10.706  -2.713  -9.417
  264    HZ2  LYS  13           HZ2      LYS  13  12.091  -3.565  -9.909
  265    HZ3  LYS  13           HZ3      LYS  13  11.159  -4.132  -8.606
  266    H    LEU  14           HN       LEU  14   6.105  -3.190  -5.834
  267    HA   LEU  14           HA       LEU  14   8.580  -2.366  -4.774
  268    HB2  LEU  14           HB2      LEU  14   5.711  -1.762  -4.051
  269    HB3  LEU  14           HB1      LEU  14   7.060  -0.997  -3.220
  270    HG   LEU  14           HG       LEU  14   6.918  -0.953  -6.242
  271   HD11  LEU  14          HD11      LEU  14   4.853   0.064  -5.887
  272   HD12  LEU  14          HD12      LEU  14   5.911   1.461  -5.760
  273   HD13  LEU  14          HD13      LEU  14   5.302   0.683  -4.299
  274   HD21  LEU  14          HD21      LEU  14   9.006  -0.174  -5.291
  275   HD22  LEU  14          HD22      LEU  14   8.154   0.822  -4.108
  276   HD23  LEU  14          HD23      LEU  14   8.106   1.245  -5.820
  277    H    LEU  15           HN       LEU  15   5.945  -4.280  -3.381
  278    HA   LEU  15           HA       LEU  15   7.058  -4.500  -0.787
  279    HB2  LEU  15           HB2      LEU  15   5.102  -6.230  -2.300
  280    HB3  LEU  15           HB1      LEU  15   5.526  -6.499  -0.610
  281    HG   LEU  15           HG       LEU  15   4.453  -3.876  -1.690
  282   HD11  LEU  15          HD11      LEU  15   2.843  -5.806  -1.866
  283   HD12  LEU  15          HD12      LEU  15   2.299  -4.493  -0.824
  284   HD13  LEU  15          HD13      LEU  15   2.946  -5.972  -0.113
  285   HD21  LEU  15          HD21      LEU  15   5.459  -3.275   0.321
  286   HD22  LEU  15          HD22      LEU  15   5.250  -4.874   1.034
  287   HD23  LEU  15          HD23      LEU  15   3.882  -3.769   0.925
  288    H    ASP  16           HN       ASP  16   7.373  -6.429  -3.715
  289    HA   ASP  16           HA       ASP  16   8.786  -8.601  -2.609
  290    HB2  ASP  16           HB2      ASP  16   8.736  -7.422  -5.387
  291    HB3  ASP  16           HB1      ASP  16   9.638  -8.883  -4.986
  292    H    ASP  17           HN       ASP  17   9.845  -5.470  -3.810
  293    HA   ASP  17           HA       ASP  17  12.629  -5.987  -3.795
  294    HB2  ASP  17           HB2      ASP  17  11.040  -3.427  -3.582
  295    HB3  ASP  17           HB1      ASP  17  12.802  -3.459  -3.637
  296    H    SER  18           HN       SER  18  10.423  -5.770  -1.258
  297    HA   SER  18           HA       SER  18  11.867  -4.443   0.734
  298    HB2  SER  18           HB2      SER  18  10.474  -5.677   2.316
  299    HB3  SER  18           HB1      SER  18   9.503  -5.109   0.958
  300    HG   SER  18           HG       SER  18  10.011  -7.268   0.035
  301    H    SER  19           HN       SER  19  12.349  -7.496  -0.710
  302    HA   SER  19           HA       SER  19  13.933  -8.591   1.451
  303    HB2  SER  19           HB2      SER  19  13.535  -9.526  -1.393
  304    HB3  SER  19           HB1      SER  19  14.430 -10.413  -0.163
  305    HG   SER  19           HG       SER  19  11.682  -9.844  -0.341
  306    H    SER  20           HN       SER  20  14.443  -6.511  -1.151
  307    HA   SER  20           HA       SER  20  17.275  -7.050  -1.472
  308    HB2  SER  20           HB2      SER  20  15.622  -4.742  -2.517
  309    HB3  SER  20           HB1      SER  20  17.264  -5.152  -3.006
  310    HG   SER  20           HG       SER  20  14.947  -6.774  -3.280
  311    H1   LYS   1           HN       LYS   1  18.961  -5.650  -0.888
  312    HA   LYS   1           HA       LYS   1  18.590  -4.339   1.642
  313    HB2  LYS   1           HB2      LYS   1  20.983  -4.562  -0.194
  314    HB3  LYS   1           HB1      LYS   1  21.026  -3.778   1.385
  315    HG2  LYS   1           HG2      LYS   1  20.286  -5.866   2.458
  316    HG3  LYS   1           HG1      LYS   1  20.221  -6.658   0.882
  317    HD2  LYS   1           HD2      LYS   1  22.637  -6.256   0.579
  318    HD3  LYS   1           HD1      LYS   1  22.702  -5.470   2.157
  319    HE2  LYS   1           HE2      LYS   1  21.973  -7.551   3.242
  320    HE3  LYS   1           HE1      LYS   1  21.868  -8.345   1.670
  321    HZ1  LYS   1           HZ1      LYS   1  24.045  -8.701   1.661
  322    HZ2  LYS   1           HZ2      LYS   1  24.076  -8.208   3.287
  323    HZ3  LYS   1           HZ3      LYS   1  24.395  -7.087   2.051
  324    H    ASN   2           HN       ASN   2  17.490  -3.357  -1.108
  325    HA   ASN   2           HA       ASN   2  18.646  -0.879  -1.686
  326    HB2  ASN   2           HB2      ASN   2  16.381  -0.338  -2.684
  327    HB3  ASN   2           HB1      ASN   2  17.105  -1.836  -3.256
  328   HD21  ASN   2          HD21      ASN   2  14.224  -1.213  -3.207
  329   HD22  ASN   2          HD22      ASN   2  13.504  -2.357  -2.182
  330    HA   PRO   3           HA       PRO   3  17.464   1.750   1.670
  331    HB2  PRO   3           HB2      PRO   3  17.064   4.147   0.344
  332    HB3  PRO   3           HB1      PRO   3  18.665   3.474   0.710
  333    HG2  PRO   3           HG2      PRO   3  17.103   3.354  -1.838
  334    HG3  PRO   3           HG1      PRO   3  18.834   3.658  -1.589
  335    HD2  PRO   3           HD2      PRO   3  17.935   1.239  -2.370
  336    HD3  PRO   3           HD1      PRO   3  19.328   1.397  -1.284
  337    H    GLU   4           HN       GLU   4  15.372   1.256  -1.024
  338    HA   GLU   4           HA       GLU   4  13.107   2.721  -0.173
  339    HB2  GLU   4           HB2      GLU   4  13.356   0.282  -1.940
  340    HB3  GLU   4           HB1      GLU   4  11.848   1.160  -1.684
  341    HG2  GLU   4           HG2      GLU   4  12.865   3.215  -2.544
  342    HG3  GLU   4           HG1      GLU   4  14.408   2.387  -2.748
  343    H    ALA   5           HN       ALA   5  14.592  -0.004   1.127
  344    HA   ALA   5           HA       ALA   5  12.462  -1.571   2.028
  345    HB1  ALA   5           HB1      ALA   5  13.998  -2.531   3.557
  346    HB2  ALA   5           HB2      ALA   5  14.948  -1.048   3.661
  347    HB3  ALA   5           HB3      ALA   5  14.992  -2.023   2.192
  348    H    GLU   6           HN       GLU   6  13.754   1.474   3.240
  349    HA   GLU   6           HA       GLU   6  12.505   1.476   5.769
  350    HB2  GLU   6           HB2      GLU   6  13.327   3.714   3.902
  351    HB3  GLU   6           HB1      GLU   6  12.694   4.004   5.522
  352    HG2  GLU   6           HG2      GLU   6  15.042   3.983   5.816
  353    HG3  GLU   6           HG1      GLU   6  14.539   2.377   6.328
  354    H    GLU   7           HN       GLU   7  11.383   2.471   2.564
  355    HA   GLU   7           HA       GLU   7   8.927   3.600   3.417
  356    HB2  GLU   7           HB2      GLU   7   9.848   4.036   1.184
  357    HB3  GLU   7           HB1      GLU   7   9.644   2.339   0.757
  358    HG2  GLU   7           HG2      GLU   7   7.782   3.665  -0.134
  359    HG3  GLU   7           HG1      GLU   7   7.190   2.562   1.098
  360    H    ILE   8           HN       ILE   8   9.909   0.343   2.509
  361    HA   ILE   8           HA       ILE   8   7.329  -0.824   2.444
  362    HB   ILE   8           HB       ILE   8   9.928  -2.154   3.258
  363   HG12  ILE   8          HG12      ILE   8  10.267  -1.003   1.149
  364   HG13  ILE   8          HG11      ILE   8  10.092  -2.719   0.810
  365   HG21  ILE   8          HG21      ILE   8   8.864  -4.182   3.008
  366   HG22  ILE   8          HG22      ILE   8   7.852  -3.615   1.685
  367   HG23  ILE   8          HG23      ILE   8   7.413  -3.253   3.347
  368   HD11  ILE   8          HD11      ILE   8   8.152  -0.482   0.290
  369   HD12  ILE   8          HD12      ILE   8   7.566  -2.137   0.467
  370   HD13  ILE   8          HD13      ILE   8   8.716  -1.738  -0.808
  371    H    THR   9           HN       THR   9   9.673  -0.380   5.075
  372    HA   THR   9           HA       THR   9   8.278  -1.807   7.058
  373    HB   THR   9           HB       THR   9  10.106   0.597   7.318
  374    HG1  THR   9           HG1      THR   9  11.345  -0.963   6.556
  375   HG21  THR   9          HG21      THR   9   8.986  -1.345   9.346
  376   HG22  THR   9          HG22      THR   9   8.889   0.417   9.360
  377   HG23  THR   9          HG23      THR   9  10.434  -0.384   9.650
  378    H    ARG  10           HN       ARG  10   8.119   1.593   6.050
  379    HA   ARG  10           HA       ARG  10   6.265   2.425   8.017
  380    HB2  ARG  10           HB2      ARG  10   6.918   3.503   5.271
  381    HB3  ARG  10           HB1      ARG  10   5.768   4.283   6.357
  382    HG2  ARG  10           HG2      ARG  10   7.596   4.328   8.110
  383    HG3  ARG  10           HG1      ARG  10   8.712   3.779   6.860
  384    HD2  ARG  10           HD2      ARG  10   7.007   6.267   6.623
  385    HD3  ARG  10           HD1      ARG  10   8.677   6.276   7.175
  386    HE   ARG  10           HE       ARG  10   7.741   5.834   4.445
  387   HH11  ARG  10          HH11      ARG  10   9.428   5.800   2.888
  388   HH12  ARG  10          HH12      ARG  10  11.073   5.676   3.408
  389   HH21  ARG  10          HH21      ARG  10  10.296   5.604   6.780
  390   HH22  ARG  10          HH22      ARG  10  11.564   5.570   5.601
  391    H    CYS  11           HN       CYS  11   5.873   1.028   4.797
  392    HA   CYS  11           HA       CYS  11   3.141   1.394   4.429
  393    HB2  CYS  11           HB2      CYS  11   4.820   0.383   2.815
  394    HB3  CYS  11           HB1      CYS  11   4.636  -1.125   3.704
  395    H    LYS  12           HN       LYS  12   4.821  -1.280   6.086
  396    HA   LYS  12           HA       LYS  12   2.472  -2.671   6.839
  397    HB2  LYS  12           HB2      LYS  12   5.260  -2.618   7.983
  398    HB3  LYS  12           HB1      LYS  12   4.001  -3.702   8.575
  399    HG2  LYS  12           HG2      LYS  12   3.722  -4.595   6.268
  400    HG3  LYS  12           HG1      LYS  12   5.045  -3.565   5.729
  401    HD2  LYS  12           HD2      LYS  12   5.367  -5.570   7.969
  402    HD3  LYS  12           HD1      LYS  12   5.660  -5.989   6.283
  403    HE2  LYS  12           HE2      LYS  12   7.291  -4.044   6.190
  404    HE3  LYS  12           HE1      LYS  12   7.114  -3.905   7.939
  405    HZ1  LYS  12           HZ1      LYS  12   8.592  -5.501   8.168
  406    HZ2  LYS  12           HZ2      LYS  12   8.708  -5.695   6.484
  407    HZ3  LYS  12           HZ3      LYS  12   7.560  -6.583   7.367
  408    H    LYS  13           HN       LYS  13   4.426  -0.212   8.468
  409    HA   LYS  13           HA       LYS  13   3.022  -0.235  10.924
  410    HB2  LYS  13           HB2      LYS  13   5.269   0.773  10.632
  411    HB3  LYS  13           HB1      LYS  13   4.541   2.067   9.678
  412    HG2  LYS  13           HG2      LYS  13   3.160   2.741  11.577
  413    HG3  LYS  13           HG1      LYS  13   3.777   1.394  12.536
  414    HD2  LYS  13           HD2      LYS  13   6.065   2.325  12.350
  415    HD3  LYS  13           HD1      LYS  13   5.425   3.689  11.433
  416    HE2  LYS  13           HE2      LYS  13   4.589   2.954  14.254
  417    HE3  LYS  13           HE1      LYS  13   5.722   4.241  13.840
  418    HZ1  LYS  13           HZ1      LYS  13   3.879   5.145  12.398
  419    HZ2  LYS  13           HZ2      LYS  13   3.648   5.270  14.076
  420    HZ3  LYS  13           HZ3      LYS  13   2.840   4.065  13.192
  421    H    LEU  14           HN       LEU  14   2.572   1.563   7.929
  422    HA   LEU  14           HA       LEU  14   0.621   3.382   8.829
  423    HB2  LEU  14           HB2      LEU  14   1.249   2.181   6.130
  424    HB3  LEU  14           HB1      LEU  14  -0.025   3.377   6.341
  425    HG   LEU  14           HG       LEU  14   2.760   3.917   7.394
  426   HD11  LEU  14          HD11      LEU  14   3.376   3.550   5.170
  427   HD12  LEU  14          HD12      LEU  14   2.949   5.253   5.117
  428   HD13  LEU  14          HD13      LEU  14   1.805   4.040   4.538
  429   HD21  LEU  14          HD21      LEU  14   1.062   5.501   8.093
  430   HD22  LEU  14          HD22      LEU  14   0.436   5.629   6.450
  431   HD23  LEU  14          HD23      LEU  14   2.028   6.279   6.842
  432    H    LEU  15           HN       LEU  15   0.348   0.120   7.476
  433    HA   LEU  15           HA       LEU  15  -2.483   0.056   7.391
  434    HB2  LEU  15           HB2      LEU  15  -0.414  -2.134   7.554
  435    HB3  LEU  15           HB1      LEU  15  -2.139  -2.444   7.353
  436    HG   LEU  15           HG       LEU  15  -0.515  -0.667   5.507
  437   HD11  LEU  15          HD11      LEU  15   0.217  -3.070   5.501
  438   HD12  LEU  15          HD12      LEU  15  -0.423  -2.509   3.957
  439   HD13  LEU  15          HD13      LEU  15  -1.418  -3.513   5.012
  440   HD21  LEU  15          HD21      LEU  15  -2.724  -0.031   5.112
  441   HD22  LEU  15          HD22      LEU  15  -3.375  -1.604   5.573
  442   HD23  LEU  15          HD23      LEU  15  -2.604  -1.392   4.004
  443    H    ASP  16           HN       ASP  16  -0.129  -0.801   9.866
  444    HA   ASP  16           HA       ASP  16  -1.897  -2.020  11.691
  445    HB2  ASP  16           HB2      ASP  16   0.715  -0.556  12.073
  446    HB3  ASP  16           HB1      ASP  16  -0.143  -1.341  13.398
  447    H    ASP  17           HN       ASP  17  -1.028   1.345  11.147
  448    HA   ASP  17           HA       ASP  17  -2.271   2.429  13.447
  449    HB2  ASP  17           HB2      ASP  17  -1.593   3.620  10.756
  450    HB3  ASP  17           HB1      ASP  17  -2.300   4.561  12.069
  451    H    SER  18           HN       SER  18  -3.594   0.928  10.737
  452    HA   SER  18           HA       SER  18  -5.911   2.418  10.255
  453    HB2  SER  18           HB2      SER  18  -6.830   0.358   9.318
  454    HB3  SER  18           HB1      SER  18  -5.151   0.559   8.821
  455    HG   SER  18           HG       SER  18  -4.690  -0.778  10.760
  456    H    SER  19           HN       SER  19  -5.029   0.459  12.901
  457    HA   SER  19           HA       SER  19  -7.730  -0.013  13.832
  458    HB2  SER  19           HB2      SER  19  -5.055  -0.425  15.174
  459    HB3  SER  19           HB1      SER  19  -6.603  -0.897  15.870
  460    HG   SER  19           HG       SER  19  -5.231  -1.921  13.644
  461    H    SER  20           HN       SER  20  -5.465   2.478  14.031
  462    HA   SER  20           HA       SER  20  -6.441   3.630  16.507
  463    HB2  SER  20           HB2      SER  20  -4.624   4.833  14.407
  464    HB3  SER  20           HB1      SER  20  -4.924   5.479  16.018
  465    HG   SER  20           HG       SER  20  -3.746   2.982  15.345
  466    H2   ZBR 100           HA3      TBS 100  -1.596   0.811  -1.886
  467    H4   ZBR 100           HC3      TBS 100   0.380   1.419   1.903
  468    H6   ZBR 100           HB3      TBS 100   2.608  -0.076  -1.481
  469    H7   ZBR 100          HB11      TBS 100   1.313   0.473  -3.806
  470    H7A  ZBR 100          HB12      TBS 100  -0.403   0.055  -3.751
  471    H8   ZBR 100          HA11      TBS 100  -2.447   2.448   0.064
  472    H8A  ZBR 100          HA12      TBS 100  -1.881   2.001   1.678
  473    H9   ZBR 100          HC11      TBS 100   3.072   1.582   1.573
  474    H9A  ZBR 100          HC12      TBS 100   3.722   0.302   0.543
  Start of MODEL   13
    1    H1   LYS   1           HN       LYS   1  -7.109   4.212  16.280
    2    HA   LYS   1           HA       LYS   1  -9.302   4.546  14.345
    3    HB2  LYS   1           HB2      LYS   1  -9.021   5.273  17.266
    4    HB3  LYS   1           HB1      LYS   1 -10.407   5.739  16.278
    5    HG2  LYS   1           HG2      LYS   1 -10.842   3.366  15.758
    6    HG3  LYS   1           HG1      LYS   1  -9.460   2.896  16.748
    7    HD2  LYS   1           HD2      LYS   1 -10.515   3.855  18.735
    8    HD3  LYS   1           HD1      LYS   1 -11.873   4.424  17.764
    9    HE2  LYS   1           HE2      LYS   1 -12.471   2.330  18.890
   10    HE3  LYS   1           HE1      LYS   1 -12.392   2.076  17.146
   11    HZ1  LYS   1           HZ1      LYS   1 -11.008   0.420  17.629
   12    HZ2  LYS   1           HZ2      LYS   1 -10.786   0.942  19.231
   13    HZ3  LYS   1           HZ3      LYS   1  -9.851   1.610  17.980
   14    H    ASN   2           HN       ASN   2  -6.448   5.834  14.577
   15    HA   ASN   2           HA       ASN   2  -6.849   8.578  14.934
   16    HB2  ASN   2           HB2      ASN   2  -4.725   8.791  13.526
   17    HB3  ASN   2           HB1      ASN   2  -4.611   7.850  15.008
   18   HD21  ASN   2          HD21      ASN   2  -5.785   7.071  11.669
   19   HD22  ASN   2          HD22      ASN   2  -4.830   5.680  11.525
   20    HA   PRO   3           HA       PRO   3  -8.914  10.063  11.302
   21    HB2  PRO   3           HB2      PRO   3  -6.681  12.038  10.960
   22    HB3  PRO   3           HB1      PRO   3  -8.428  12.323  11.077
   23    HG2  PRO   3           HG2      PRO   3  -6.821  12.871  13.115
   24    HG3  PRO   3           HG1      PRO   3  -8.433  12.178  13.381
   25    HD2  PRO   3           HD2      PRO   3  -5.755  10.842  13.540
   26    HD3  PRO   3           HD1      PRO   3  -7.215  10.589  14.519
   27    H    GLU   4           HN       GLU   4  -5.521   9.265  11.142
   28    HA   GLU   4           HA       GLU   4  -5.115   9.418   8.354
   29    HB2  GLU   4           HB2      GLU   4  -3.806   7.690  10.463
   30    HB3  GLU   4           HB1      GLU   4  -3.255   7.781   8.791
   31    HG2  GLU   4           HG2      GLU   4  -2.892  10.192   9.013
   32    HG3  GLU   4           HG1      GLU   4  -3.512  10.151  10.663
   33    H    ALA   5           HN       ALA   5  -7.054   7.347  10.199
   34    HA   ALA   5           HA       ALA   5  -6.884   4.907   8.836
   35    HB1  ALA   5           HB1      ALA   5  -9.191   6.271  10.234
   36    HB2  ALA   5           HB2      ALA   5  -8.155   4.988  10.858
   37    HB3  ALA   5           HB3      ALA   5  -9.309   4.642   9.569
   38    H    GLU   6           HN       GLU   6  -8.415   7.933   7.954
   39    HA   GLU   6           HA       GLU   6 -10.150   6.983   5.939
   40    HB2  GLU   6           HB2      GLU   6  -8.710   9.622   6.287
   41    HB3  GLU   6           HB1      GLU   6  -9.902   9.332   5.020
   42    HG2  GLU   6           HG2      GLU   6 -11.606   8.816   6.688
   43    HG3  GLU   6           HG1      GLU   6 -10.423   8.973   7.985
   44    H    GLU   7           HN       GLU   7  -6.739   7.934   5.882
   45    HA   GLU   7           HA       GLU   7  -6.383   7.682   3.078
   46    HB2  GLU   7           HB2      GLU   7  -4.800   8.908   4.543
   47    HB3  GLU   7           HB1      GLU   7  -4.319   7.378   5.278
   48    HG2  GLU   7           HG2      GLU   7  -2.706   7.971   3.547
   49    HG3  GLU   7           HG1      GLU   7  -3.617   6.563   3.012
   50    H    ILE   8           HN       ILE   8  -6.092   5.451   5.785
   51    HA   ILE   8           HA       ILE   8  -4.897   3.282   4.398
   52    HB   ILE   8           HB       ILE   8  -6.832   3.131   6.726
   53   HG12  ILE   8          HG12      ILE   8  -5.061   4.706   7.261
   54   HG13  ILE   8          HG11      ILE   8  -4.753   3.203   8.117
   55   HG21  ILE   8          HG21      ILE   8  -4.645   1.306   5.696
   56   HG22  ILE   8          HG22      ILE   8  -6.374   0.957   5.754
   57   HG23  ILE   8          HG23      ILE   8  -5.451   1.100   7.249
   58   HD11  ILE   8          HD11      ILE   8  -3.270   2.613   6.047
   59   HD12  ILE   8          HD12      ILE   8  -2.652   3.752   7.242
   60   HD13  ILE   8          HD13      ILE   8  -3.327   4.348   5.729
   61    H    THR   9           HN       THR   9  -8.289   4.179   4.915
   62    HA   THR   9           HA       THR   9  -9.450   1.900   3.740
   63    HB   THR   9           HB       THR   9 -10.460   4.753   3.856
   64    HG1  THR   9           HG1      THR   9 -10.858   4.266   5.838
   65   HG21  THR   9          HG21      THR   9 -12.708   3.546   3.652
   66   HG22  THR   9          HG22      THR   9 -11.788   2.145   3.105
   67   HG23  THR   9          HG23      THR   9 -11.740   3.648   2.183
   68    H    ARG  10           HN       ARG  10  -8.401   4.995   2.340
   69    HA   ARG  10           HA       ARG  10  -9.334   4.526  -0.284
   70    HB2  ARG  10           HB2      ARG  10  -8.505   6.726   0.672
   71    HB3  ARG  10           HB1      ARG  10  -6.867   6.111   0.449
   72    HG2  ARG  10           HG2      ARG  10  -7.399   5.725  -1.972
   73    HG3  ARG  10           HG1      ARG  10  -8.960   6.504  -1.710
   74    HD2  ARG  10           HD2      ARG  10  -7.524   8.220  -2.532
   75    HD3  ARG  10           HD1      ARG  10  -7.661   8.499  -0.800
   76    HE   ARG  10           HE       ARG  10  -5.414   7.865  -0.552
   77   HH11  ARG  10          HH11      ARG  10  -3.354   7.472  -1.428
   78   HH12  ARG  10          HH12      ARG  10  -3.196   7.095  -3.112
   79   HH21  ARG  10          HH21      ARG  10  -6.597   7.300  -3.750
   80   HH22  ARG  10          HH22      ARG  10  -5.032   6.997  -4.424
   81    H    CYS  11           HN       CYS  11  -6.275   3.764   1.332
   82    HA   CYS  11           HA       CYS  11  -4.861   2.796  -0.897
   83    HB2  CYS  11           HB2      CYS  11  -3.888   3.284   1.358
   84    HB3  CYS  11           HB1      CYS  11  -4.643   1.804   1.948
   85    H    LYS  12           HN       LYS  12  -7.062   1.201   1.357
   86    HA   LYS  12           HA       LYS  12  -6.732  -1.438   0.436
   87    HB2  LYS  12           HB2      LYS  12  -7.904  -0.828   2.540
   88    HB3  LYS  12           HB1      LYS  12  -9.232  -0.168   1.585
   89    HG2  LYS  12           HG2      LYS  12  -9.616  -2.375   0.565
   90    HG3  LYS  12           HG1      LYS  12  -8.267  -3.043   1.484
   91    HD2  LYS  12           HD2      LYS  12  -9.427  -2.493   3.590
   92    HD3  LYS  12           HD1      LYS  12 -10.777  -1.823   2.672
   93    HE2  LYS  12           HE2      LYS  12 -11.303  -4.117   3.347
   94    HE3  LYS  12           HE1      LYS  12 -11.111  -4.041   1.595
   95    HZ1  LYS  12           HZ1      LYS  12  -9.877  -5.830   3.095
   96    HZ2  LYS  12           HZ2      LYS  12  -8.713  -4.594   3.152
   97    HZ3  LYS  12           HZ3      LYS  12  -9.210  -5.230   1.656
   98    H    LYS  13           HN       LYS  13  -8.900   1.164  -0.594
   99    HA   LYS  13           HA       LYS  13 -10.403  -0.334  -2.451
  100    HB2  LYS  13           HB2      LYS  13  -9.709   2.614  -2.394
  101    HB3  LYS  13           HB1      LYS  13 -10.926   1.899  -3.448
  102    HG2  LYS  13           HG2      LYS  13 -10.998   1.654  -0.429
  103    HG3  LYS  13           HG1      LYS  13 -11.831   2.933  -1.308
  104    HD2  LYS  13           HD2      LYS  13 -13.060   1.158  -2.600
  105    HD3  LYS  13           HD1      LYS  13 -12.315  -0.054  -1.563
  106    HE2  LYS  13           HE2      LYS  13 -13.305   0.980   0.414
  107    HE3  LYS  13           HE1      LYS  13 -14.054   2.216  -0.599
  108    HZ1  LYS  13           HZ1      LYS  13 -15.738   0.710  -0.496
  109    HZ2  LYS  13           HZ2      LYS  13 -14.701  -0.628  -0.348
  110    HZ3  LYS  13           HZ3      LYS  13 -14.928   0.110  -1.860
  111    H    LEU  14           HN       LEU  14  -7.383   1.450  -2.760
  112    HA   LEU  14           HA       LEU  14  -7.124   1.200  -5.563
  113    HB2  LEU  14           HB2      LEU  14  -5.071   1.491  -3.365
  114    HB3  LEU  14           HB1      LEU  14  -4.674   1.563  -5.081
  115    HG   LEU  14           HG       LEU  14  -6.722   3.355  -3.744
  116   HD11  LEU  14          HD11      LEU  14  -4.788   4.164  -2.760
  117   HD12  LEU  14          HD12      LEU  14  -4.763   5.083  -4.258
  118   HD13  LEU  14          HD13      LEU  14  -3.754   3.649  -4.092
  119   HD21  LEU  14          HD21      LEU  14  -5.565   3.157  -6.519
  120   HD22  LEU  14          HD22      LEU  14  -6.074   4.732  -5.906
  121   HD23  LEU  14          HD23      LEU  14  -7.240   3.419  -6.025
  122    H    LEU  15           HN       LEU  15  -6.088  -0.853  -2.880
  123    HA   LEU  15           HA       LEU  15  -4.658  -2.742  -4.433
  124    HB2  LEU  15           HB2      LEU  15  -6.019  -2.949  -1.745
  125    HB3  LEU  15           HB1      LEU  15  -5.026  -4.235  -2.432
  126    HG   LEU  15           HG       LEU  15  -4.048  -1.389  -2.054
  127   HD11  LEU  15          HD11      LEU  15  -2.950  -2.104  -0.032
  128   HD12  LEU  15          HD12      LEU  15  -3.473  -3.772  -0.277
  129   HD13  LEU  15          HD13      LEU  15  -4.658  -2.521   0.108
  130   HD21  LEU  15          HD21      LEU  15  -1.797  -2.827  -2.078
  131   HD22  LEU  15          HD22      LEU  15  -2.559  -2.332  -3.584
  132   HD23  LEU  15          HD23      LEU  15  -2.796  -3.970  -2.974
  133    H    ASP  16           HN       ASP  16  -8.024  -2.515  -3.430
  134    HA   ASP  16           HA       ASP  16  -8.874  -5.048  -4.331
  135    HB2  ASP  16           HB2      ASP  16 -10.345  -2.446  -3.917
  136    HB3  ASP  16           HB1      ASP  16 -11.157  -3.928  -4.420
  137    H    ASP  17           HN       ASP  17  -8.425  -1.994  -5.962
  138    HA   ASP  17           HA       ASP  17  -9.846  -2.541  -8.331
  139    HB2  ASP  17           HB2      ASP  17  -7.484  -0.735  -7.789
  140    HB3  ASP  17           HB1      ASP  17  -8.306  -0.810  -9.344
  141    H    SER  18           HN       SER  18  -7.155  -4.064  -7.073
  142    HA   SER  18           HA       SER  18  -5.498  -4.513  -9.258
  143    HB2  SER  18           HB2      SER  18  -4.951  -5.216  -6.944
  144    HB3  SER  18           HB1      SER  18  -6.199  -6.449  -7.045
  145    HG   SER  18           HG       SER  18  -4.074  -7.222  -7.548
  146    H    SER  19           HN       SER  19  -8.522  -5.977  -8.395
  147    HA   SER  19           HA       SER  19  -8.363  -8.013 -10.452
  148    HB2  SER  19           HB2      SER  19 -10.680  -7.151  -8.716
  149    HB3  SER  19           HB1      SER  19 -10.678  -8.551  -9.784
  150    HG   SER  19           HG       SER  19  -9.352  -9.576  -8.461
  151    H    SER  20           HN       SER  20  -9.113  -4.771 -10.382
  152    HA   SER  20           HA       SER  20 -11.123  -4.764 -12.468
  153    HB2  SER  20           HB2      SER  20 -10.974  -2.984 -10.706
  154    HB3  SER  20           HB1      SER  20  -9.477  -2.441 -11.456
  155    HG   SER  20           HG       SER  20 -12.087  -2.139 -12.265
  156    H1   LYS   1           HN       LYS   1 -10.839  -3.962 -14.589
  157    HA   LYS   1           HA       LYS   1  -8.145  -4.454 -15.672
  158    HB2  LYS   1           HB2      LYS   1 -10.870  -4.298 -16.971
  159    HB3  LYS   1           HB1      LYS   1  -9.365  -4.457 -17.877
  160    HG2  LYS   1           HG2      LYS   1  -8.840  -6.534 -16.652
  161    HG3  LYS   1           HG1      LYS   1 -10.346  -6.379 -15.746
  162    HD2  LYS   1           HD2      LYS   1 -11.647  -6.558 -17.805
  163    HD3  LYS   1           HD1      LYS   1 -10.168  -6.612 -18.763
  164    HE2  LYS   1           HE2      LYS   1 -11.043  -8.882 -18.434
  165    HE3  LYS   1           HE1      LYS   1  -9.504  -8.696 -17.594
  166    HZ1  LYS   1           HZ1      LYS   1 -10.575  -9.391 -15.794
  167    HZ2  LYS   1           HZ2      LYS   1 -12.098  -9.236 -16.530
  168    HZ3  LYS   1           HZ3      LYS   1 -11.377  -7.896 -15.776
  169    H    ASN   2           HN       ASN   2  -9.528  -1.935 -14.388
  170    HA   ASN   2           HA       ASN   2  -9.539   0.046 -16.362
  171    HB2  ASN   2           HB2      ASN   2  -9.164   1.627 -14.382
  172    HB3  ASN   2           HB1      ASN   2 -10.604   0.618 -14.343
  173   HD21  ASN   2          HD21      ASN   2  -7.136   0.020 -13.475
  174   HD22  ASN   2          HD22      ASN   2  -7.498  -0.602 -11.941
  175    HA   PRO   3           HA       PRO   3  -5.300   0.932 -17.320
  176    HB2  PRO   3           HB2      PRO   3  -5.856   3.802 -16.651
  177    HB3  PRO   3           HB1      PRO   3  -5.189   3.103 -18.139
  178    HG2  PRO   3           HG2      PRO   3  -7.690   3.982 -18.047
  179    HG3  PRO   3           HG1      PRO   3  -7.269   2.516 -18.952
  180    HD2  PRO   3           HD2      PRO   3  -8.647   2.767 -16.303
  181    HD3  PRO   3           HD1      PRO   3  -8.898   1.594 -17.613
  182    H    GLU   4           HN       GLU   4  -6.663   2.095 -14.324
  183    HA   GLU   4           HA       GLU   4  -4.319   2.995 -13.039
  184    HB2  GLU   4           HB2      GLU   4  -6.881   1.838 -11.923
  185    HB3  GLU   4           HB1      GLU   4  -5.607   2.539 -10.926
  186    HG2  GLU   4           HG2      GLU   4  -5.826   4.675 -12.098
  187    HG3  GLU   4           HG1      GLU   4  -7.043   3.985 -13.170
  188    H    ALA   5           HN       ALA   5  -5.264  -0.109 -14.000
  189    HA   ALA   5           HA       ALA   5  -4.248  -1.755 -11.976
  190    HB1  ALA   5           HB1      ALA   5  -4.444  -2.131 -14.969
  191    HB2  ALA   5           HB2      ALA   5  -5.514  -2.775 -13.725
  192    HB3  ALA   5           HB3      ALA   5  -3.874  -3.402 -13.888
  193    H    GLU   6           HN       GLU   6  -2.623   0.103 -14.463
  194    HA   GLU   6           HA       GLU   6  -0.114  -1.190 -14.415
  195    HB2  GLU   6           HB2      GLU   6  -0.901   1.673 -14.995
  196    HB3  GLU   6           HB1      GLU   6   0.740   1.061 -15.208
  197    HG2  GLU   6           HG2      GLU   6  -0.055  -0.614 -16.799
  198    HG3  GLU   6           HG1      GLU   6  -1.724  -0.108 -16.535
  199    H    GLU   7           HN       GLU   7  -1.471   1.425 -12.450
  200    HA   GLU   7           HA       GLU   7   0.888   1.976 -10.975
  201    HB2  GLU   7           HB2      GLU   7  -1.042   3.530 -11.074
  202    HB3  GLU   7           HB1      GLU   7  -1.998   2.380 -10.142
  203    HG2  GLU   7           HG2      GLU   7  -1.098   4.077  -8.638
  204    HG3  GLU   7           HG1      GLU   7  -0.313   2.539  -8.295
  205    H    ILE   8           HN       ILE   8  -1.798  -0.254 -10.525
  206    HA   ILE   8           HA       ILE   8  -1.176  -1.112  -7.893
  207    HB   ILE   8           HB       ILE   8  -2.450  -2.742 -10.107
  208   HG12  ILE   8          HG12      ILE   8  -3.618  -0.621  -9.914
  209   HG13  ILE   8          HG11      ILE   8  -4.593  -1.866  -9.152
  210   HG21  ILE   8          HG21      ILE   8  -2.558  -2.868  -7.083
  211   HG22  ILE   8          HG22      ILE   8  -1.878  -4.081  -8.169
  212   HG23  ILE   8          HG23      ILE   8  -3.613  -3.785  -8.149
  213   HD11  ILE   8          HD11      ILE   8  -3.387  -1.126  -6.956
  214   HD12  ILE   8          HD12      ILE   8  -4.674  -0.111  -7.606
  215   HD13  ILE   8          HD13      ILE   8  -2.990   0.330  -7.869
  216    H    THR   9           HN       THR   9  -0.139  -2.290 -11.073
  217    HA   THR   9           HA       THR   9   1.292  -4.541 -10.176
  218    HB   THR   9           HB       THR   9   1.788  -2.760 -12.577
  219    HG1  THR   9           HG1      THR   9   0.150  -3.774 -13.363
  220   HG21  THR   9          HG21      THR   9   2.848  -4.924 -13.452
  221   HG22  THR   9          HG22      THR   9   2.874  -5.461 -11.772
  222   HG23  THR   9          HG23      THR   9   3.775  -4.022 -12.251
  223    H    ARG  10           HN       ARG  10   2.267  -1.154 -10.627
  224    HA   ARG  10           HA       ARG  10   5.008  -1.495 -10.040
  225    HB2  ARG  10           HB2      ARG  10   3.906   0.562 -11.039
  226    HB3  ARG  10           HB1      ARG  10   3.365   0.964  -9.408
  227    HG2  ARG  10           HG2      ARG  10   5.752   0.868  -8.649
  228    HG3  ARG  10           HG1      ARG  10   6.236   0.624 -10.327
  229    HD2  ARG  10           HD2      ARG  10   6.448   2.966  -9.944
  230    HD3  ARG  10           HD1      ARG  10   4.961   2.769 -10.862
  231    HE   ARG  10           HE       ARG  10   3.738   3.394  -8.960
  232   HH11  ARG  10          HH11      ARG  10   3.623   4.346  -6.897
  233   HH12  ARG  10          HH12      ARG  10   5.051   4.453  -5.922
  234   HH21  ARG  10          HH21      ARG  10   7.094   2.937  -8.278
  235   HH22  ARG  10          HH22      ARG  10   7.015   3.655  -6.705
  236    H    CYS  11           HN       CYS  11   2.197  -0.826  -7.987
  237    HA   CYS  11           HA       CYS  11   3.547  -0.430  -5.553
  238    HB2  CYS  11           HB2      CYS  11   1.124   0.037  -5.989
  239    HB3  CYS  11           HB1      CYS  11   0.830  -1.700  -5.918
  240    H    LYS  12           HN       LYS  12   2.371  -3.368  -7.122
  241    HA   LYS  12           HA       LYS  12   2.911  -5.170  -5.029
  242    HB2  LYS  12           HB2      LYS  12   1.552  -5.729  -7.028
  243    HB3  LYS  12           HB1      LYS  12   3.016  -5.694  -8.011
  244    HG2  LYS  12           HG2      LYS  12   3.988  -7.503  -6.655
  245    HG3  LYS  12           HG1      LYS  12   2.546  -7.526  -5.639
  246    HD2  LYS  12           HD2      LYS  12   1.172  -8.118  -7.602
  247    HD3  LYS  12           HD1      LYS  12   2.615  -8.099  -8.616
  248    HE2  LYS  12           HE2      LYS  12   2.117 -10.400  -7.963
  249    HE3  LYS  12           HE1      LYS  12   3.608  -9.877  -7.178
  250    HZ1  LYS  12           HZ1      LYS  12   1.630 -11.009  -5.856
  251    HZ2  LYS  12           HZ2      LYS  12   1.117  -9.394  -5.744
  252    HZ3  LYS  12           HZ3      LYS  12   2.644  -9.846  -5.150
  253    H    LYS  13           HN       LYS  13   4.914  -3.987  -7.695
  254    HA   LYS  13           HA       LYS  13   7.149  -5.639  -7.227
  255    HB2  LYS  13           HB2      LYS  13   6.962  -2.860  -8.419
  256    HB3  LYS  13           HB1      LYS  13   8.396  -3.880  -8.496
  257    HG2  LYS  13           HG2      LYS  13   5.695  -4.736  -9.567
  258    HG3  LYS  13           HG1      LYS  13   6.919  -3.952 -10.563
  259    HD2  LYS  13           HD2      LYS  13   8.512  -5.801  -9.946
  260    HD3  LYS  13           HD1      LYS  13   7.185  -6.610  -9.121
  261    HE2  LYS  13           HE2      LYS  13   5.899  -6.691 -11.193
  262    HE3  LYS  13           HE1      LYS  13   7.207  -5.867 -12.045
  263    HZ1  LYS  13           HZ1      LYS  13   7.769  -8.017 -12.455
  264    HZ2  LYS  13           HZ2      LYS  13   7.088  -8.602 -11.012
  265    HZ3  LYS  13           HZ3      LYS  13   8.592  -7.811 -10.986
  266    H    LEU  14           HN       LEU  14   6.227  -2.501  -5.921
  267    HA   LEU  14           HA       LEU  14   8.627  -2.000  -4.516
  268    HB2  LEU  14           HB2      LEU  14   5.779  -1.115  -4.031
  269    HB3  LEU  14           HB1      LEU  14   7.154  -0.500  -3.116
  270    HG   LEU  14           HG       LEU  14   6.949  -0.378  -6.139
  271   HD11  LEU  14          HD11      LEU  14   5.259   1.103  -5.548
  272   HD12  LEU  14          HD12      LEU  14   6.646   2.180  -5.503
  273   HD13  LEU  14          HD13      LEU  14   6.003   1.516  -4.004
  274   HD21  LEU  14          HD21      LEU  14   8.916   0.649  -4.099
  275   HD22  LEU  14          HD22      LEU  14   8.683   1.540  -5.604
  276   HD23  LEU  14          HD23      LEU  14   9.228  -0.132  -5.651
  277    H    LEU  15           HN       LEU  15   5.649  -3.677  -3.623
  278    HA   LEU  15           HA       LEU  15   6.331  -4.153  -0.917
  279    HB2  LEU  15           HB2      LEU  15   4.478  -5.595  -2.817
  280    HB3  LEU  15           HB1      LEU  15   4.603  -5.984  -1.102
  281    HG   LEU  15           HG       LEU  15   3.989  -3.204  -2.150
  282   HD11  LEU  15          HD11      LEU  15   1.656  -3.633  -1.682
  283   HD12  LEU  15          HD12      LEU  15   2.030  -5.239  -1.056
  284   HD13  LEU  15          HD13      LEU  15   2.240  -4.889  -2.773
  285   HD21  LEU  15          HD21      LEU  15   2.981  -3.169   0.318
  286   HD22  LEU  15          HD22      LEU  15   4.696  -2.876   0.055
  287   HD23  LEU  15          HD23      LEU  15   4.145  -4.466   0.584
  288    H    ASP  16           HN       ASP  16   6.888  -5.959  -3.883
  289    HA   ASP  16           HA       ASP  16   7.918  -8.313  -2.723
  290    HB2  ASP  16           HB2      ASP  16   8.350  -7.033  -5.421
  291    HB3  ASP  16           HB1      ASP  16   9.050  -8.590  -4.978
  292    H    ASP  17           HN       ASP  17   9.376  -5.233  -3.496
  293    HA   ASP  17           HA       ASP  17  12.090  -5.963  -3.295
  294    HB2  ASP  17           HB2      ASP  17  10.684  -3.329  -2.819
  295    HB3  ASP  17           HB1      ASP  17  12.434  -3.512  -2.766
  296    H    SER  18           HN       SER  18   9.696  -6.019  -0.963
  297    HA   SER  18           HA       SER  18  10.918  -5.057   1.339
  298    HB2  SER  18           HB2      SER  18   8.559  -5.819   1.228
  299    HB3  SER  18           HB1      SER  18   9.125  -7.479   1.093
  300    HG   SER  18           HG       SER  18   8.616  -6.900   3.252
  301    H    SER  19           HN       SER  19  11.372  -8.044  -0.368
  302    HA   SER  19           HA       SER  19  13.032  -9.222   1.695
  303    HB2  SER  19           HB2      SER  19  12.526 -10.083  -1.158
  304    HB3  SER  19           HB1      SER  19  13.420 -11.018   0.036
  305    HG   SER  19           HG       SER  19  11.605 -11.466   1.061
  306    H    SER  20           HN       SER  20  13.473  -6.985  -0.742
  307    HA   SER  20           HA       SER  20  16.233  -7.600  -1.365
  308    HB2  SER  20           HB2      SER  20  14.705  -6.450  -2.983
  309    HB3  SER  20           HB1      SER  20  14.707  -5.049  -1.919
  310    HG   SER  20           HG       SER  20  16.604  -5.928  -3.670
  311    H1   LYS   1           HN       LYS   1  18.042  -6.339  -0.775
  312    HA   LYS   1           HA       LYS   1  17.783  -5.070   1.867
  313    HB2  LYS   1           HB2      LYS   1  20.162  -6.116   0.324
  314    HB3  LYS   1           HB1      LYS   1  20.300  -5.238   1.850
  315    HG2  LYS   1           HG2      LYS   1  18.868  -6.916   2.952
  316    HG3  LYS   1           HG1      LYS   1  18.725  -7.796   1.430
  317    HD2  LYS   1           HD2      LYS   1  21.136  -8.192   1.391
  318    HD3  LYS   1           HD1      LYS   1  21.338  -7.237   2.859
  319    HE2  LYS   1           HE2      LYS   1  21.312  -9.631   3.405
  320    HE3  LYS   1           HE1      LYS   1  19.894  -8.835   4.085
  321    HZ1  LYS   1           HZ1      LYS   1  18.714 -10.367   3.019
  322    HZ2  LYS   1           HZ2      LYS   1  20.049 -10.890   2.107
  323    HZ3  LYS   1           HZ3      LYS   1  19.117  -9.571   1.576
  324    H    ASN   2           HN       ASN   2  17.363  -4.012  -1.059
  325    HA   ASN   2           HA       ASN   2  19.241  -1.976  -1.438
  326    HB2  ASN   2           HB2      ASN   2  17.387  -0.901  -2.833
  327    HB3  ASN   2           HB1      ASN   2  17.915  -2.510  -3.311
  328   HD21  ASN   2          HD21      ASN   2  15.615  -1.321  -0.774
  329   HD22  ASN   2          HD22      ASN   2  14.350  -2.332  -1.272
  330    HA   PRO   3           HA       PRO   3  18.305   1.209   1.503
  331    HB2  PRO   3           HB2      PRO   3  18.105   3.132  -0.791
  332    HB3  PRO   3           HB1      PRO   3  19.118   3.216   0.664
  333    HG2  PRO   3           HG2      PRO   3  20.163   2.586  -1.696
  334    HG3  PRO   3           HG1      PRO   3  20.719   1.798  -0.206
  335    HD2  PRO   3           HD2      PRO   3  18.944   0.715  -2.366
  336    HD3  PRO   3           HD1      PRO   3  20.169  -0.105  -1.376
  337    H    GLU   4           HN       GLU   4  16.267   0.797  -1.299
  338    HA   GLU   4           HA       GLU   4  14.143   2.522  -0.614
  339    HB2  GLU   4           HB2      GLU   4  14.186  -0.032  -2.231
  340    HB3  GLU   4           HB1      GLU   4  12.775   1.014  -2.093
  341    HG2  GLU   4           HG2      GLU   4  14.052   2.892  -3.022
  342    HG3  GLU   4           HG1      GLU   4  15.493   1.881  -3.116
  343    H    ALA   5           HN       ALA   5  15.251  -0.318   0.853
  344    HA   ALA   5           HA       ALA   5  12.905  -1.549   1.755
  345    HB1  ALA   5           HB1      ALA   5  15.659  -1.322   2.980
  346    HB2  ALA   5           HB2      ALA   5  14.977  -2.687   2.095
  347    HB3  ALA   5           HB3      ALA   5  14.374  -2.288   3.704
  348    H    GLU   6           HN       GLU   6  14.530   1.367   2.824
  349    HA   GLU   6           HA       GLU   6  13.334   1.637   5.366
  350    HB2  GLU   6           HB2      GLU   6  14.333   3.689   3.377
  351    HB3  GLU   6           HB1      GLU   6  13.793   4.101   5.005
  352    HG2  GLU   6           HG2      GLU   6  15.490   2.641   5.978
  353    HG3  GLU   6           HG1      GLU   6  15.989   2.108   4.373
  354    H    GLU   7           HN       GLU   7  12.282   2.630   2.132
  355    HA   GLU   7           HA       GLU   7   9.957   4.028   2.965
  356    HB2  GLU   7           HB2      GLU   7  10.963   4.283   0.710
  357    HB3  GLU   7           HB1      GLU   7  10.477   2.633   0.323
  358    HG2  GLU   7           HG2      GLU   7   8.815   4.173  -0.573
  359    HG3  GLU   7           HG1      GLU   7   8.093   3.285   0.763
  360    H    ILE   8           HN       ILE   8  10.618   0.673   2.128
  361    HA   ILE   8           HA       ILE   8   7.942  -0.267   2.069
  362    HB   ILE   8           HB       ILE   8  10.408  -1.802   2.932
  363   HG12  ILE   8          HG12      ILE   8  10.853  -0.736   0.798
  364   HG13  ILE   8          HG11      ILE   8  10.528  -2.439   0.512
  365   HG21  ILE   8          HG21      ILE   8   7.744  -2.626   1.748
  366   HG22  ILE   8          HG22      ILE   8   8.338  -3.001   3.367
  367   HG23  ILE   8          HG23      ILE   8   9.119  -3.706   1.954
  368   HD11  ILE   8          HD11      ILE   8   8.068  -1.652   0.120
  369   HD12  ILE   8          HD12      ILE   8   9.264  -1.375  -1.145
  370   HD13  ILE   8          HD13      ILE   8   8.793  -0.056  -0.080
  371    H    THR   9           HN       THR   9  10.292   0.013   4.709
  372    HA   THR   9           HA       THR   9   8.755  -1.249   6.698
  373    HB   THR   9           HB       THR   9  10.785   0.985   6.942
  374    HG1  THR   9           HG1      THR   9  12.153  -0.553   6.649
  375   HG21  THR   9          HG21      THR   9  11.001  -0.022   9.295
  376   HG22  THR   9          HG22      THR   9   9.445  -0.792   8.983
  377   HG23  THR   9          HG23      THR   9   9.575   0.967   8.984
  378    H    ARG  10           HN       ARG  10   8.901   2.138   5.633
  379    HA   ARG  10           HA       ARG  10   7.162   3.195   7.591
  380    HB2  ARG  10           HB2      ARG  10   8.643   4.501   5.995
  381    HB3  ARG  10           HB1      ARG  10   7.431   4.196   4.751
  382    HG2  ARG  10           HG2      ARG  10   5.708   5.230   6.251
  383    HG3  ARG  10           HG1      ARG  10   6.999   5.648   7.378
  384    HD2  ARG  10           HD2      ARG  10   6.669   7.594   6.042
  385    HD3  ARG  10           HD1      ARG  10   8.133   6.835   5.426
  386    HE   ARG  10           HE       ARG  10   6.985   6.286   3.456
  387   HH11  ARG  10          HH11      ARG  10   5.223   6.553   2.043
  388   HH12  ARG  10          HH12      ARG  10   3.729   7.187   2.647
  389   HH21  ARG  10          HH21      ARG  10   4.889   7.548   5.894
  390   HH22  ARG  10          HH22      ARG  10   3.540   7.750   4.828
  391    H    CYS  11           HN       CYS  11   6.575   1.808   4.383
  392    HA   CYS  11           HA       CYS  11   3.822   2.333   4.200
  393    HB2  CYS  11           HB2      CYS  11   5.305   1.502   2.351
  394    HB3  CYS  11           HB1      CYS  11   5.256  -0.089   3.106
  395    H    LYS  12           HN       LYS  12   5.598  -0.358   5.641
  396    HA   LYS  12           HA       LYS  12   3.392  -1.994   6.264
  397    HB2  LYS  12           HB2      LYS  12   5.757  -2.747   6.361
  398    HB3  LYS  12           HB1      LYS  12   6.001  -1.731   7.783
  399    HG2  LYS  12           HG2      LYS  12   4.269  -2.986   8.998
  400    HG3  LYS  12           HG1      LYS  12   3.981  -3.986   7.573
  401    HD2  LYS  12           HD2      LYS  12   6.311  -4.791   7.664
  402    HD3  LYS  12           HD1      LYS  12   6.600  -3.792   9.089
  403    HE2  LYS  12           HE2      LYS  12   6.111  -6.085   9.785
  404    HE3  LYS  12           HE1      LYS  12   4.794  -5.023  10.282
  405    HZ1  LYS  12           HZ1      LYS  12   4.390  -7.279   8.978
  406    HZ2  LYS  12           HZ2      LYS  12   4.579  -6.242   7.645
  407    HZ3  LYS  12           HZ3      LYS  12   3.374  -5.932   8.801
  408    H    LYS  13           HN       LYS  13   4.969   0.623   8.046
  409    HA   LYS  13           HA       LYS  13   3.497   0.368  10.438
  410    HB2  LYS  13           HB2      LYS  13   4.787   2.794   9.162
  411    HB3  LYS  13           HB1      LYS  13   4.182   2.742  10.817
  412    HG2  LYS  13           HG2      LYS  13   6.278   0.828   9.757
  413    HG3  LYS  13           HG1      LYS  13   6.679   2.334  10.577
  414    HD2  LYS  13           HD2      LYS  13   5.344   1.540  12.556
  415    HD3  LYS  13           HD1      LYS  13   5.132  -0.004  11.739
  416    HE2  LYS  13           HE2      LYS  13   7.545  -0.330  11.645
  417    HE3  LYS  13           HE1      LYS  13   7.797   1.227  12.438
  418    HZ1  LYS  13           HZ1      LYS  13   7.813  -0.136  14.241
  419    HZ2  LYS  13           HZ2      LYS  13   6.772  -1.282  13.539
  420    HZ3  LYS  13           HZ3      LYS  13   6.146   0.169  14.163
  421    H    LEU  14           HN       LEU  14   2.878   2.157   7.471
  422    HA   LEU  14           HA       LEU  14   0.596   3.553   8.384
  423    HB2  LEU  14           HB2      LEU  14   1.444   2.649   5.628
  424    HB3  LEU  14           HB1      LEU  14   0.051   3.691   5.921
  425    HG   LEU  14           HG       LEU  14   2.866   4.325   6.857
  426   HD11  LEU  14          HD11      LEU  14   3.146   4.518   4.563
  427   HD12  LEU  14          HD12      LEU  14   2.537   6.126   4.931
  428   HD13  LEU  14          HD13      LEU  14   1.453   4.908   4.271
  429   HD21  LEU  14          HD21      LEU  14   0.223   5.762   6.956
  430   HD22  LEU  14          HD22      LEU  14   1.703   6.709   6.804
  431   HD23  LEU  14          HD23      LEU  14   1.479   5.648   8.190
  432    H    LEU  15           HN       LEU  15   1.003   0.394   6.852
  433    HA   LEU  15           HA       LEU  15  -1.752  -0.205   6.583
  434    HB2  LEU  15           HB2      LEU  15   0.690  -1.970   6.796
  435    HB3  LEU  15           HB1      LEU  15  -0.927  -2.585   6.449
  436    HG   LEU  15           HG       LEU  15   0.424  -0.415   4.818
  437   HD11  LEU  15          HD11      LEU  15   1.008  -2.101   3.194
  438   HD12  LEU  15          HD12      LEU  15   0.190  -3.353   4.130
  439   HD13  LEU  15          HD13      LEU  15   1.658  -2.600   4.756
  440   HD21  LEU  15          HD21      LEU  15  -1.348  -1.450   3.116
  441   HD22  LEU  15          HD22      LEU  15  -1.844  -0.236   4.290
  442   HD23  LEU  15          HD23      LEU  15  -2.163  -1.943   4.601
  443    H    ASP  16           HN       ASP  16   0.584  -0.762   9.156
  444    HA   ASP  16           HA       ASP  16  -1.030  -2.379  10.808
  445    HB2  ASP  16           HB2      ASP  16   1.285  -0.541  11.418
  446    HB3  ASP  16           HB1      ASP  16   0.501  -1.530  12.648
  447    H    ASP  17           HN       ASP  17  -0.799   1.082  10.395
  448    HA   ASP  17           HA       ASP  17  -2.194   1.898  12.702
  449    HB2  ASP  17           HB2      ASP  17  -1.869   3.199   9.995
  450    HB3  ASP  17           HB1      ASP  17  -2.692   3.975  11.342
  451    H    SER  18           HN       SER  18  -3.254   0.074  10.114
  452    HA   SER  18           HA       SER  18  -5.806   1.025   9.563
  453    HB2  SER  18           HB2      SER  18  -4.737  -0.830   8.329
  454    HB3  SER  18           HB1      SER  18  -4.908  -1.855   9.748
  455    HG   SER  18           HG       SER  18  -6.621  -2.138   8.250
  456    H    SER  19           HN       SER  19  -4.626  -0.820  12.257
  457    HA   SER  19           HA       SER  19  -7.263  -1.329  13.343
  458    HB2  SER  19           HB2      SER  19  -4.525  -1.694  14.571
  459    HB3  SER  19           HB1      SER  19  -6.038  -2.238  15.289
  460    HG   SER  19           HG       SER  19  -6.154  -3.812  13.871
  461    H    SER  20           HN       SER  20  -5.155   1.259  13.314
  462    HA   SER  20           HA       SER  20  -5.828   2.361  15.907
  463    HB2  SER  20           HB2      SER  20  -3.656   2.831  14.742
  464    HB3  SER  20           HB1      SER  20  -4.556   3.763  13.551
  465    HG   SER  20           HG       SER  20  -3.804   4.422  16.078
  466    H2   ZBR 100           HA3      TBS 100  -1.265   1.792  -2.092
  467    H4   ZBR 100           HC3      TBS 100   0.896   2.358   1.600
  468    H6   ZBR 100           HB3      TBS 100   2.947   0.877  -1.899
  469    H7   ZBR 100          HB11      TBS 100   1.479   1.518  -4.166
  470    H7A  ZBR 100          HB12      TBS 100  -0.187   0.956  -3.992
  471    H8   ZBR 100          HA11      TBS 100  -1.960   3.475  -0.052
  472    H8A  ZBR 100          HA12      TBS 100  -1.381   2.889   1.510
  473    H9   ZBR 100          HC11      TBS 100   3.619   2.536   1.049
  474    H9A  ZBR 100          HC12      TBS 100   4.136   1.142   0.097
  Start of MODEL   14
    1    H1   LYS   1           HN       LYS   1  -7.309   4.962  16.830
    2    HA   LYS   1           HA       LYS   1  -9.371   5.331  14.852
    3    HB2  LYS   1           HB2      LYS   1  -8.887   6.603  17.552
    4    HB3  LYS   1           HB1      LYS   1 -10.289   6.932  16.534
    5    HG2  LYS   1           HG2      LYS   1 -10.948   4.588  16.602
    6    HG3  LYS   1           HG1      LYS   1  -9.487   4.171  17.494
    7    HD2  LYS   1           HD2      LYS   1 -11.203   4.325  19.143
    8    HD3  LYS   1           HD1      LYS   1 -10.282   5.821  19.282
    9    HE2  LYS   1           HE2      LYS   1 -11.947   7.059  18.061
   10    HE3  LYS   1           HE1      LYS   1 -12.796   5.583  17.609
   11    HZ1  LYS   1           HZ1      LYS   1 -13.820   5.504  19.564
   12    HZ2  LYS   1           HZ2      LYS   1 -13.365   7.132  19.735
   13    HZ3  LYS   1           HZ3      LYS   1 -12.424   5.905  20.439
   14    H    ASN   2           HN       ASN   2  -6.402   6.372  14.738
   15    HA   ASN   2           HA       ASN   2  -6.491   9.154  14.623
   16    HB2  ASN   2           HB2      ASN   2  -4.407   8.985  13.321
   17    HB3  ASN   2           HB1      ASN   2  -4.393   7.839  14.641
   18   HD21  ASN   2          HD21      ASN   2  -2.767   7.439  12.340
   19   HD22  ASN   2          HD22      ASN   2  -3.360   6.092  11.494
   20    HA   PRO   3           HA       PRO   3  -8.776  10.039  10.945
   21    HB2  PRO   3           HB2      PRO   3  -7.404  12.268  10.013
   22    HB3  PRO   3           HB1      PRO   3  -8.553  12.299  11.364
   23    HG2  PRO   3           HG2      PRO   3  -5.567  12.156  11.424
   24    HG3  PRO   3           HG1      PRO   3  -6.669  13.105  12.439
   25    HD2  PRO   3           HD2      PRO   3  -5.553  10.848  13.328
   26    HD3  PRO   3           HD1      PRO   3  -7.198  11.293  13.799
   27    H    GLU   4           HN       GLU   4  -5.342   9.550  10.753
   28    HA   GLU   4           HA       GLU   4  -5.041   9.526   7.946
   29    HB2  GLU   4           HB2      GLU   4  -3.469   8.202  10.160
   30    HB3  GLU   4           HB1      GLU   4  -2.993   8.124   8.465
   31    HG2  GLU   4           HG2      GLU   4  -1.793   9.986   9.241
   32    HG3  GLU   4           HG1      GLU   4  -3.209  10.738   8.525
   33    H    ALA   5           HN       ALA   5  -6.677   7.438  10.012
   34    HA   ALA   5           HA       ALA   5  -6.272   4.925   8.851
   35    HB1  ALA   5           HB1      ALA   5  -8.487   4.349   9.770
   36    HB2  ALA   5           HB2      ALA   5  -8.797   6.058  10.076
   37    HB3  ALA   5           HB3      ALA   5  -7.506   5.227  10.945
   38    H    GLU   6           HN       GLU   6  -8.014   7.708   7.727
   39    HA   GLU   6           HA       GLU   6  -9.786   6.499   5.902
   40    HB2  GLU   6           HB2      GLU   6  -8.388   9.186   5.821
   41    HB3  GLU   6           HB1      GLU   6  -9.680   8.714   4.717
   42    HG2  GLU   6           HG2      GLU   6  -9.942   8.723   7.735
   43    HG3  GLU   6           HG1      GLU   6 -10.490  10.035   6.692
   44    H    GLU   7           HN       GLU   7  -6.369   7.340   5.663
   45    HA   GLU   7           HA       GLU   7  -6.071   6.956   2.887
   46    HB2  GLU   7           HB2      GLU   7  -4.353   8.061   4.266
   47    HB3  GLU   7           HB1      GLU   7  -4.044   6.538   5.101
   48    HG2  GLU   7           HG2      GLU   7  -2.383   6.907   3.322
   49    HG3  GLU   7           HG1      GLU   7  -3.366   5.498   2.954
   50    H    ILE   8           HN       ILE   8  -5.893   4.728   5.621
   51    HA   ILE   8           HA       ILE   8  -4.950   2.456   4.215
   52    HB   ILE   8           HB       ILE   8  -6.537   2.840   6.757
   53   HG12  ILE   8          HG12      ILE   8  -4.493   2.017   7.785
   54   HG13  ILE   8          HG11      ILE   8  -3.814   1.624   6.207
   55   HG21  ILE   8          HG21      ILE   8  -5.904   0.270   5.303
   56   HG22  ILE   8          HG22      ILE   8  -7.433   0.780   6.018
   57   HG23  ILE   8          HG23      ILE   8  -6.094   0.303   7.055
   58   HD11  ILE   8          HD11      ILE   8  -3.588   3.906   5.613
   59   HD12  ILE   8          HD12      ILE   8  -3.055   3.833   7.293
   60   HD13  ILE   8          HD13      ILE   8  -4.665   4.436   6.906
   61    H    THR   9           HN       THR   9  -8.224   3.692   4.841
   62    HA   THR   9           HA       THR   9  -9.656   1.535   3.714
   63    HB   THR   9           HB       THR   9 -10.367   4.477   3.838
   64    HG1  THR   9           HG1      THR   9 -10.113   2.604   5.688
   65   HG21  THR   9          HG21      THR   9 -12.717   3.567   3.683
   66   HG22  THR   9          HG22      THR   9 -12.014   2.010   3.248
   67   HG23  THR   9          HG23      THR   9 -11.774   3.411   2.202
   68    H    ARG  10           HN       ARG  10  -8.339   4.508   2.283
   69    HA   ARG  10           HA       ARG  10  -9.348   4.114  -0.339
   70    HB2  ARG  10           HB2      ARG  10  -8.453   6.275   0.468
   71    HB3  ARG  10           HB1      ARG  10  -6.835   5.570   0.512
   72    HG2  ARG  10           HG2      ARG  10  -6.891   5.162  -1.882
   73    HG3  ARG  10           HG1      ARG  10  -8.566   5.709  -1.974
   74    HD2  ARG  10           HD2      ARG  10  -7.142   7.530  -2.692
   75    HD3  ARG  10           HD1      ARG  10  -7.813   7.943  -1.117
   76    HE   ARG  10           HE       ARG  10  -5.320   6.656  -0.737
   77   HH11  ARG  10          HH11      ARG  10  -3.510   7.935  -0.266
   78   HH12  ARG  10          HH12      ARG  10  -3.523   9.623  -0.636
   79   HH21  ARG  10          HH21      ARG  10  -6.723   9.576  -1.969
   80   HH22  ARG  10          HH22      ARG  10  -5.341  10.553  -1.602
   81    H    CYS  11           HN       CYS  11  -6.344   3.128   1.266
   82    HA   CYS  11           HA       CYS  11  -4.954   2.104  -0.928
   83    HB2  CYS  11           HB2      CYS  11  -4.152   2.353   1.483
   84    HB3  CYS  11           HB1      CYS  11  -4.970   0.829   1.810
   85    H    LYS  12           HN       LYS  12  -7.376   0.567   1.160
   86    HA   LYS  12           HA       LYS  12  -7.276  -2.006  -0.007
   87    HB2  LYS  12           HB2      LYS  12  -9.501  -0.548   1.433
   88    HB3  LYS  12           HB1      LYS  12  -9.582  -2.248   0.970
   89    HG2  LYS  12           HG2      LYS  12  -7.545  -2.706   2.288
   90    HG3  LYS  12           HG1      LYS  12  -7.472  -1.008   2.761
   91    HD2  LYS  12           HD2      LYS  12  -9.695  -1.216   3.829
   92    HD3  LYS  12           HD1      LYS  12  -9.744  -2.920   3.375
   93    HE2  LYS  12           HE2      LYS  12  -7.708  -3.339   4.708
   94    HE3  LYS  12           HE1      LYS  12  -7.660  -1.635   5.163
   95    HZ1  LYS  12           HZ1      LYS  12 -10.020  -2.032   5.999
   96    HZ2  LYS  12           HZ2      LYS  12  -8.741  -2.661   6.924
   97    HZ3  LYS  12           HZ3      LYS  12  -9.648  -3.684   5.914
   98    H    LYS  13           HN       LYS  13  -9.173   0.889  -0.760
   99    HA   LYS  13           HA       LYS  13 -10.870  -0.252  -2.705
  100    HB2  LYS  13           HB2      LYS  13 -11.233   1.981  -1.696
  101    HB3  LYS  13           HB1      LYS  13  -9.827   2.586  -2.572
  102    HG2  LYS  13           HG2      LYS  13 -10.899   2.032  -4.715
  103    HG3  LYS  13           HG1      LYS  13 -12.295   1.379  -3.858
  104    HD2  LYS  13           HD2      LYS  13 -12.715   3.594  -2.859
  105    HD3  LYS  13           HD1      LYS  13 -11.324   4.249  -3.724
  106    HE2  LYS  13           HE2      LYS  13 -12.387   3.665  -5.875
  107    HE3  LYS  13           HE1      LYS  13 -13.780   3.017  -5.008
  108    HZ1  LYS  13           HZ1      LYS  13 -13.569   5.548  -5.858
  109    HZ2  LYS  13           HZ2      LYS  13 -13.024   5.702  -4.256
  110    HZ3  LYS  13           HZ3      LYS  13 -14.563   5.054  -4.575
  111    H    LEU  14           HN       LEU  14  -7.657   1.229  -2.943
  112    HA   LEU  14           HA       LEU  14  -7.445   1.159  -5.755
  113    HB2  LEU  14           HB2      LEU  14  -5.387   1.136  -3.547
  114    HB3  LEU  14           HB1      LEU  14  -4.940   1.185  -5.247
  115    HG   LEU  14           HG       LEU  14  -6.883   3.176  -4.043
  116   HD11  LEU  14          HD11      LEU  14  -4.912   3.548  -2.766
  117   HD12  LEU  14          HD12      LEU  14  -4.818   4.721  -4.077
  118   HD13  LEU  14          HD13      LEU  14  -3.859   3.241  -4.146
  119   HD21  LEU  14          HD21      LEU  14  -5.836   4.519  -6.031
  120   HD22  LEU  14          HD22      LEU  14  -6.999   3.266  -6.413
  121   HD23  LEU  14          HD23      LEU  14  -5.275   2.954  -6.606
  122    H    LEU  15           HN       LEU  15  -6.572  -1.191  -3.277
  123    HA   LEU  15           HA       LEU  15  -5.342  -3.061  -5.008
  124    HB2  LEU  15           HB2      LEU  15  -6.731  -3.424  -2.342
  125    HB3  LEU  15           HB1      LEU  15  -5.811  -4.687  -3.155
  126    HG   LEU  15           HG       LEU  15  -4.677  -1.970  -2.434
  127   HD11  LEU  15          HD11      LEU  15  -5.132  -3.066  -0.359
  128   HD12  LEU  15          HD12      LEU  15  -3.419  -3.333  -0.688
  129   HD13  LEU  15          HD13      LEU  15  -4.584  -4.622  -0.988
  130   HD21  LEU  15          HD21      LEU  15  -3.274  -2.771  -4.113
  131   HD22  LEU  15          HD22      LEU  15  -3.574  -4.464  -3.719
  132   HD23  LEU  15          HD23      LEU  15  -2.512  -3.493  -2.704
  133    H    ASP  16           HN       ASP  16  -8.673  -2.623  -3.959
  134    HA   ASP  16           HA       ASP  16  -9.738  -4.984  -5.079
  135    HB2  ASP  16           HB2      ASP  16 -10.976  -2.300  -4.462
  136    HB3  ASP  16           HB1      ASP  16 -11.908  -3.666  -5.070
  137    H    ASP  17           HN       ASP  17  -9.106  -1.797  -6.426
  138    HA   ASP  17           HA       ASP  17 -10.486  -2.139  -8.871
  139    HB2  ASP  17           HB2      ASP  17  -8.175  -0.368  -8.078
  140    HB3  ASP  17           HB1      ASP  17  -8.918  -0.314  -9.676
  141    H    SER  18           HN       SER  18  -7.734  -3.665  -7.669
  142    HA   SER  18           HA       SER  18  -6.107  -3.927  -9.917
  143    HB2  SER  18           HB2      SER  18  -5.179  -5.890  -8.814
  144    HB3  SER  18           HB1      SER  18  -5.492  -4.647  -7.608
  145    HG   SER  18           HG       SER  18  -6.505  -6.287  -6.713
  146    H    SER  19           HN       SER  19  -9.127  -5.340  -9.162
  147    HA   SER  19           HA       SER  19  -8.925  -7.443 -11.154
  148    HB2  SER  19           HB2      SER  19 -10.233  -7.738  -9.037
  149    HB3  SER  19           HB1      SER  19 -11.373  -6.540  -9.643
  150    HG   SER  19           HG       SER  19 -12.117  -7.952 -11.039
  151    H    SER  20           HN       SER  20  -9.840  -4.197 -11.042
  152    HA   SER  20           HA       SER  20 -11.657  -4.259 -13.291
  153    HB2  SER  20           HB2      SER  20 -11.753  -1.874 -13.078
  154    HB3  SER  20           HB1      SER  20 -11.753  -2.540 -11.448
  155    HG   SER  20           HG       SER  20 -10.043  -1.372 -11.146
  156    H1   LYS   1           HN       LYS   1 -11.247  -3.645 -15.390
  157    HA   LYS   1           HA       LYS   1  -8.554  -4.007 -16.324
  158    HB2  LYS   1           HB2      LYS   1 -11.111  -3.255 -17.751
  159    HB3  LYS   1           HB1      LYS   1  -9.569  -3.543 -18.555
  160    HG2  LYS   1           HG2      LYS   1  -9.500  -5.825 -17.711
  161    HG3  LYS   1           HG1      LYS   1 -10.956  -5.553 -16.759
  162    HD2  LYS   1           HD2      LYS   1 -11.697  -6.689 -18.721
  163    HD3  LYS   1           HD1      LYS   1 -12.122  -4.997 -18.969
  164    HE2  LYS   1           HE2      LYS   1 -10.239  -4.645 -20.420
  165    HE3  LYS   1           HE1      LYS   1  -9.546  -6.211 -20.002
  166    HZ1  LYS   1           HZ1      LYS   1 -10.867  -7.247 -21.438
  167    HZ2  LYS   1           HZ2      LYS   1 -11.124  -5.714 -22.124
  168    HZ3  LYS   1           HZ3      LYS   1 -12.236  -6.345 -21.004
  169    H    ASN   2           HN       ASN   2  -9.670  -1.543 -14.718
  170    HA   ASN   2           HA       ASN   2  -9.375   0.713 -16.325
  171    HB2  ASN   2           HB2      ASN   2  -9.114   1.958 -14.217
  172    HB3  ASN   2           HB1      ASN   2 -10.369   0.750 -14.057
  173   HD21  ASN   2          HD21      ASN   2  -9.004   1.782 -11.775
  174   HD22  ASN   2          HD22      ASN   2  -8.063   0.535 -11.111
  175    HA   PRO   3           HA       PRO   3  -5.029   0.977 -17.077
  176    HB2  PRO   3           HB2      PRO   3  -4.661   3.726 -17.020
  177    HB3  PRO   3           HB1      PRO   3  -5.391   2.850 -18.379
  178    HG2  PRO   3           HG2      PRO   3  -6.724   4.328 -16.147
  179    HG3  PRO   3           HG1      PRO   3  -7.119   4.307 -17.876
  180    HD2  PRO   3           HD2      PRO   3  -8.519   2.877 -16.110
  181    HD3  PRO   3           HD1      PRO   3  -8.218   2.263 -17.739
  182    H    GLU   4           HN       GLU   4  -6.378   2.426 -14.229
  183    HA   GLU   4           HA       GLU   4  -3.979   3.169 -12.928
  184    HB2  GLU   4           HB2      GLU   4  -6.725   2.480 -11.883
  185    HB3  GLU   4           HB1      GLU   4  -5.412   3.013 -10.839
  186    HG2  GLU   4           HG2      GLU   4  -6.519   5.022 -11.334
  187    HG3  GLU   4           HG1      GLU   4  -5.214   5.025 -12.509
  188    H    ALA   5           HN       ALA   5  -5.235   0.155 -13.714
  189    HA   ALA   5           HA       ALA   5  -4.504  -1.442 -11.534
  190    HB1  ALA   5           HB1      ALA   5  -4.399  -3.290 -13.164
  191    HB2  ALA   5           HB2      ALA   5  -4.453  -2.122 -14.484
  192    HB3  ALA   5           HB3      ALA   5  -5.836  -2.296 -13.403
  193    H    GLU   6           HN       GLU   6  -2.589   0.141 -13.958
  194    HA   GLU   6           HA       GLU   6  -0.243  -1.415 -13.848
  195    HB2  GLU   6           HB2      GLU   6  -0.640   1.546 -14.353
  196    HB3  GLU   6           HB1      GLU   6   0.895   0.707 -14.583
  197    HG2  GLU   6           HG2      GLU   6  -1.694  -0.076 -15.949
  198    HG3  GLU   6           HG1      GLU   6  -0.446   0.924 -16.693
  199    H    GLU   7           HN       GLU   7  -1.466   1.149 -11.763
  200    HA   GLU   7           HA       GLU   7   0.882   1.572 -10.261
  201    HB2  GLU   7           HB2      GLU   7  -1.046   3.110 -10.180
  202    HB3  GLU   7           HB1      GLU   7  -2.010   1.856  -9.401
  203    HG2  GLU   7           HG2      GLU   7  -1.111   3.421  -7.729
  204    HG3  GLU   7           HG1      GLU   7  -0.428   1.819  -7.493
  205    H    ILE   8           HN       ILE   8  -1.775  -0.729  -9.922
  206    HA   ILE   8           HA       ILE   8  -1.048  -1.792  -7.399
  207    HB   ILE   8           HB       ILE   8  -2.622  -2.857  -9.747
  208   HG12  ILE   8          HG12      ILE   8  -4.480  -2.647  -8.194
  209   HG13  ILE   8          HG11      ILE   8  -3.377  -2.273  -6.870
  210   HG21  ILE   8          HG21      ILE   8  -1.744  -4.315  -7.255
  211   HG22  ILE   8          HG22      ILE   8  -1.681  -4.868  -8.927
  212   HG23  ILE   8          HG23      ILE   8  -3.228  -4.757  -8.096
  213   HD11  ILE   8          HD11      ILE   8  -2.802  -0.167  -7.807
  214   HD12  ILE   8          HD12      ILE   8  -4.552  -0.283  -7.989
  215   HD13  ILE   8          HD13      ILE   8  -3.501  -0.584  -9.372
  216    H    THR   9           HN       THR   9  -0.123  -2.672 -10.716
  217    HA   THR   9           HA       THR   9   1.389  -4.969 -10.086
  218    HB   THR   9           HB       THR   9   1.752  -2.972 -12.335
  219    HG1  THR   9           HG1      THR   9  -0.132  -4.749 -11.788
  220   HG21  THR   9          HG21      THR   9   2.857  -4.937 -13.460
  221   HG22  THR   9          HG22      THR   9   2.837  -5.763 -11.904
  222   HG23  THR   9          HG23      THR   9   3.768  -4.280 -12.102
  223    H    ARG  10           HN       ARG  10   2.271  -1.532 -10.286
  224    HA   ARG  10           HA       ARG  10   5.046  -1.852  -9.789
  225    HB2  ARG  10           HB2      ARG  10   4.050   0.230 -10.678
  226    HB3  ARG  10           HB1      ARG  10   3.270   0.505  -9.120
  227    HG2  ARG  10           HG2      ARG  10   5.421   0.644  -8.006
  228    HG3  ARG  10           HG1      ARG  10   6.264   0.210  -9.493
  229    HD2  ARG  10           HD2      ARG  10   6.396   2.612  -9.237
  230    HD3  ARG  10           HD1      ARG  10   5.289   2.261 -10.561
  231    HE   ARG  10           HE       ARG  10   3.804   2.476  -8.158
  232   HH11  ARG  10          HH11      ARG  10   2.671   4.397  -7.764
  233   HH12  ARG  10          HH12      ARG  10   3.097   5.842  -8.611
  234   HH21  ARG  10          HH21      ARG  10   5.668   4.355 -10.396
  235   HH22  ARG  10          HH22      ARG  10   4.794   5.821 -10.099
  236    H    CYS  11           HN       CYS  11   2.254  -1.371  -7.653
  237    HA   CYS  11           HA       CYS  11   3.576  -1.024  -5.220
  238    HB2  CYS  11           HB2      CYS  11   1.077  -0.873  -5.704
  239    HB3  CYS  11           HB1      CYS  11   1.039  -2.627  -5.550
  240    H    LYS  12           HN       LYS  12   2.668  -4.008  -6.916
  241    HA   LYS  12           HA       LYS  12   3.523  -5.822  -4.914
  242    HB2  LYS  12           HB2      LYS  12   3.256  -6.127  -7.910
  243    HB3  LYS  12           HB1      LYS  12   3.621  -7.463  -6.818
  244    HG2  LYS  12           HG2      LYS  12   1.538  -7.024  -5.576
  245    HG3  LYS  12           HG1      LYS  12   1.166  -5.688  -6.666
  246    HD2  LYS  12           HD2      LYS  12   1.152  -7.269  -8.577
  247    HD3  LYS  12           HD1      LYS  12   1.477  -8.597  -7.461
  248    HE2  LYS  12           HE2      LYS  12  -0.623  -8.115  -6.260
  249    HE3  LYS  12           HE1      LYS  12  -0.949  -6.782  -7.368
  250    HZ1  LYS  12           HZ1      LYS  12  -0.718  -8.536  -9.182
  251    HZ2  LYS  12           HZ2      LYS  12  -2.136  -8.552  -8.247
  252    HZ3  LYS  12           HZ3      LYS  12  -0.900  -9.677  -7.941
  253    H    LYS  13           HN       LYS  13   5.176  -4.305  -7.649
  254    HA   LYS  13           HA       LYS  13   7.599  -5.745  -7.493
  255    HB2  LYS  13           HB2      LYS  13   6.970  -4.314  -9.414
  256    HB3  LYS  13           HB1      LYS  13   7.180  -2.887  -8.399
  257    HG2  LYS  13           HG2      LYS  13   9.541  -3.460  -8.044
  258    HG3  LYS  13           HG1      LYS  13   9.345  -4.926  -9.004
  259    HD2  LYS  13           HD2      LYS  13   8.738  -3.547 -10.965
  260    HD3  LYS  13           HD1      LYS  13   8.957  -2.088  -9.998
  261    HE2  LYS  13           HE2      LYS  13  11.322  -2.689  -9.620
  262    HE3  LYS  13           HE1      LYS  13  11.103  -4.149 -10.584
  263    HZ1  LYS  13           HZ1      LYS  13  11.910  -1.786 -11.565
  264    HZ2  LYS  13           HZ2      LYS  13  10.241  -1.715 -11.876
  265    HZ3  LYS  13           HZ3      LYS  13  11.168  -3.002 -12.486
  266    H    LEU  14           HN       LEU  14   6.505  -2.769  -5.909
  267    HA   LEU  14           HA       LEU  14   8.940  -2.132  -4.635
  268    HB2  LEU  14           HB2      LEU  14   6.061  -1.513  -3.964
  269    HB3  LEU  14           HB1      LEU  14   7.406  -0.877  -3.027
  270    HG   LEU  14           HG       LEU  14   7.240  -0.540  -6.035
  271   HD11  LEU  14          HD11      LEU  14   5.277   0.572  -5.309
  272   HD12  LEU  14          HD12      LEU  14   6.487   1.851  -5.376
  273   HD13  LEU  14          HD13      LEU  14   6.039   1.140  -3.824
  274   HD21  LEU  14          HD21      LEU  14   8.660   1.535  -5.291
  275   HD22  LEU  14          HD22      LEU  14   9.437  -0.037  -5.302
  276   HD23  LEU  14          HD23      LEU  14   8.877   0.657  -3.781
  277    H    LEU  15           HN       LEU  15   6.204  -4.109  -3.615
  278    HA   LEU  15           HA       LEU  15   7.124  -4.628  -0.990
  279    HB2  LEU  15           HB2      LEU  15   5.307  -6.220  -2.814
  280    HB3  LEU  15           HB1      LEU  15   5.569  -6.587  -1.112
  281    HG   LEU  15           HG       LEU  15   4.596  -3.900  -2.121
  282   HD11  LEU  15          HD11      LEU  15   2.866  -5.471  -2.640
  283   HD12  LEU  15          HD12      LEU  15   2.390  -4.688  -1.132
  284   HD13  LEU  15          HD13      LEU  15   3.081  -6.310  -1.102
  285   HD21  LEU  15          HD21      LEU  15   5.431  -3.459   0.005
  286   HD22  LEU  15          HD22      LEU  15   5.127  -5.091   0.596
  287   HD23  LEU  15          HD23      LEU  15   3.797  -3.949   0.425
  288    H    ASP  16           HN       ASP  16   7.644  -6.265  -4.064
  289    HA   ASP  16           HA       ASP  16   8.982  -8.542  -3.066
  290    HB2  ASP  16           HB2      ASP  16   9.105  -7.129  -5.733
  291    HB3  ASP  16           HB1      ASP  16   9.976  -8.625  -5.398
  292    H    ASP  17           HN       ASP  17  10.084  -5.308  -3.895
  293    HA   ASP  17           HA       ASP  17  12.866  -5.818  -3.771
  294    HB2  ASP  17           HB2      ASP  17  11.243  -3.298  -3.431
  295    HB3  ASP  17           HB1      ASP  17  13.004  -3.310  -3.368
  296    H    SER  18           HN       SER  18  10.519  -5.850  -1.361
  297    HA   SER  18           HA       SER  18  11.827  -4.717   0.824
  298    HB2  SER  18           HB2      SER  18  10.334  -6.053   2.204
  299    HB3  SER  18           HB1      SER  18   9.445  -5.473   0.801
  300    HG   SER  18           HG       SER  18   9.003  -7.555   0.711
  301    H    SER  19           HN       SER  19  12.355  -7.675  -0.823
  302    HA   SER  19           HA       SER  19  13.958  -8.859   1.280
  303    HB2  SER  19           HB2      SER  19  12.614 -10.242  -0.320
  304    HB3  SER  19           HB1      SER  19  13.720  -9.738  -1.594
  305    HG   SER  19           HG       SER  19  15.226 -10.995  -0.789
  306    H    SER  20           HN       SER  20  14.431  -6.715  -1.288
  307    HA   SER  20           HA       SER  20  17.244  -7.258  -1.688
  308    HB2  SER  20           HB2      SER  20  17.225  -5.389  -3.198
  309    HB3  SER  20           HB1      SER  20  15.743  -6.304  -3.467
  310    HG   SER  20           HG       SER  20  14.743  -4.523  -3.016
  311    H1   LYS   1           HN       LYS   1  18.976  -6.096  -0.919
  312    HA   LYS   1           HA       LYS   1  18.609  -4.758   1.595
  313    HB2  LYS   1           HB2      LYS   1  21.050  -5.210  -0.128
  314    HB3  LYS   1           HB1      LYS   1  21.084  -4.437   1.456
  315    HG2  LYS   1           HG2      LYS   1  20.175  -6.434   2.506
  316    HG3  LYS   1           HG1      LYS   1  19.968  -7.206   0.938
  317    HD2  LYS   1           HD2      LYS   1  21.994  -8.112   1.811
  318    HD3  LYS   1           HD1      LYS   1  22.493  -6.909   0.622
  319    HE2  LYS   1           HE2      LYS   1  22.996  -5.298   2.330
  320    HE3  LYS   1           HE1      LYS   1  22.231  -6.284   3.574
  321    HZ1  LYS   1           HZ1      LYS   1  24.035  -7.542   3.775
  322    HZ2  LYS   1           HZ2      LYS   1  24.852  -6.286   2.975
  323    HZ3  LYS   1           HZ3      LYS   1  24.298  -7.636   2.103
  324    H    ASN   2           HN       ASN   2  17.770  -3.663  -1.223
  325    HA   ASN   2           HA       ASN   2  19.205  -1.316  -1.675
  326    HB2  ASN   2           HB2      ASN   2  17.268  -0.601  -3.012
  327    HB3  ASN   2           HB1      ASN   2  17.599  -2.297  -3.289
  328   HD21  ASN   2          HD21      ASN   2  15.019  -1.231  -3.790
  329   HD22  ASN   2          HD22      ASN   2  13.941  -1.864  -2.642
  330    HA   PRO   3           HA       PRO   3  18.000   1.361   1.628
  331    HB2  PRO   3           HB2      PRO   3  17.930   3.803   0.314
  332    HB3  PRO   3           HB1      PRO   3  19.424   2.982   0.806
  333    HG2  PRO   3           HG2      PRO   3  18.081   3.022  -1.865
  334    HG3  PRO   3           HG1      PRO   3  19.805   3.157  -1.471
  335    HD2  PRO   3           HD2      PRO   3  18.751   0.868  -2.362
  336    HD3  PRO   3           HD1      PRO   3  20.053   0.867  -1.165
  337    H    GLU   4           HN       GLU   4  16.107   1.254  -1.276
  338    HA   GLU   4           HA       GLU   4  13.931   2.859  -0.460
  339    HB2  GLU   4           HB2      GLU   4  14.153   0.603  -2.453
  340    HB3  GLU   4           HB1      GLU   4  12.667   1.516  -2.206
  341    HG2  GLU   4           HG2      GLU   4  13.690   2.673  -3.975
  342    HG3  GLU   4           HG1      GLU   4  14.177   3.626  -2.582
  343    H    ALA   5           HN       ALA   5  15.023  -0.121   0.647
  344    HA   ALA   5           HA       ALA   5  12.665  -1.496   1.251
  345    HB1  ALA   5           HB1      ALA   5  13.987  -2.609   3.014
  346    HB2  ALA   5           HB2      ALA   5  15.258  -1.403   2.812
  347    HB3  ALA   5           HB3      ALA   5  14.878  -2.513   1.496
  348    H    GLU   6           HN       GLU   6  14.078   1.338   2.666
  349    HA   GLU   6           HA       GLU   6  12.880   1.288   5.215
  350    HB2  GLU   6           HB2      GLU   6  13.646   3.616   3.435
  351    HB3  GLU   6           HB1      GLU   6  13.157   3.780   5.121
  352    HG2  GLU   6           HG2      GLU   6  15.456   2.043   4.190
  353    HG3  GLU   6           HG1      GLU   6  15.650   3.687   4.796
  354    H    GLU   7           HN       GLU   7  11.666   2.285   2.059
  355    HA   GLU   7           HA       GLU   7   9.306   3.562   2.939
  356    HB2  GLU   7           HB2      GLU   7  10.152   3.791   0.639
  357    HB3  GLU   7           HB1      GLU   7   9.832   2.081   0.348
  358    HG2  GLU   7           HG2      GLU   7   7.999   3.456  -0.539
  359    HG3  GLU   7           HG1      GLU   7   7.416   2.467   0.791
  360    H    ILE   8           HN       ILE   8  10.062   0.192   2.187
  361    HA   ILE   8           HA       ILE   8   7.431  -0.841   2.342
  362    HB   ILE   8           HB       ILE   8  10.180  -2.039   2.713
  363   HG12  ILE   8          HG12      ILE   8   9.617  -3.181   0.644
  364   HG13  ILE   8          HG11      ILE   8   7.960  -2.589   0.722
  365   HG21  ILE   8          HG21      ILE   8   7.489  -3.316   3.213
  366   HG22  ILE   8          HG22      ILE   8   8.931  -3.370   4.224
  367   HG23  ILE   8          HG23      ILE   8   8.881  -4.278   2.716
  368   HD11  ILE   8          HD11      ILE   8   8.633  -0.348   0.303
  369   HD12  ILE   8          HD12      ILE   8   9.564  -1.325  -0.833
  370   HD13  ILE   8          HD13      ILE   8  10.327  -0.715   0.635
  371    H    THR   9           HN       THR   9   9.954  -0.355   4.798
  372    HA   THR   9           HA       THR   9   8.613  -1.578   6.958
  373    HB   THR   9           HB       THR   9  10.566   0.737   6.960
  374    HG1  THR   9           HG1      THR   9  10.810  -1.849   6.401
  375   HG21  THR   9          HG21      THR   9  10.997  -0.081   9.311
  376   HG22  THR   9          HG22      THR   9   9.552  -1.079   9.156
  377   HG23  THR   9          HG23      THR   9   9.423   0.678   9.077
  378    H    ARG  10           HN       ARG  10   8.577   1.753   5.726
  379    HA   ARG  10           HA       ARG  10   6.897   2.856   7.726
  380    HB2  ARG  10           HB2      ARG  10   8.229   4.231   6.164
  381    HB3  ARG  10           HB1      ARG  10   7.196   3.702   4.835
  382    HG2  ARG  10           HG2      ARG  10   5.252   4.715   5.870
  383    HG3  ARG  10           HG1      ARG  10   6.181   5.126   7.312
  384    HD2  ARG  10           HD2      ARG  10   6.016   7.111   5.939
  385    HD3  ARG  10           HD1      ARG  10   7.675   6.527   5.863
  386    HE   ARG  10           HE       ARG  10   6.204   5.396   3.720
  387   HH11  ARG  10          HH11      ARG  10   6.462   6.289   1.654
  388   HH12  ARG  10          HH12      ARG  10   7.104   7.883   1.473
  389   HH21  ARG  10          HH21      ARG  10   7.469   8.407   4.880
  390   HH22  ARG  10          HH22      ARG  10   7.672   9.085   3.299
  391    H    CYS  11           HN       CYS  11   6.231   1.303   4.609
  392    HA   CYS  11           HA       CYS  11   3.488   1.766   4.422
  393    HB2  CYS  11           HB2      CYS  11   5.034   0.652   2.724
  394    HB3  CYS  11           HB1      CYS  11   4.808  -0.832   3.643
  395    H    LYS  12           HN       LYS  12   5.247  -0.806   6.125
  396    HA   LYS  12           HA       LYS  12   2.979  -2.255   7.005
  397    HB2  LYS  12           HB2      LYS  12   5.767  -2.012   8.158
  398    HB3  LYS  12           HB1      LYS  12   4.553  -3.149   8.749
  399    HG2  LYS  12           HG2      LYS  12   4.388  -4.151   6.500
  400    HG3  LYS  12           HG1      LYS  12   5.603  -3.017   5.907
  401    HD2  LYS  12           HD2      LYS  12   7.233  -3.923   7.539
  402    HD3  LYS  12           HD1      LYS  12   6.017  -5.077   8.091
  403    HE2  LYS  12           HE2      LYS  12   5.896  -6.054   5.836
  404    HE3  LYS  12           HE1      LYS  12   7.093  -4.892   5.264
  405    HZ1  LYS  12           HZ1      LYS  12   8.530  -5.817   7.146
  406    HZ2  LYS  12           HZ2      LYS  12   8.336  -6.768   5.752
  407    HZ3  LYS  12           HZ3      LYS  12   7.452  -7.125   7.159
  408    H    LYS  13           HN       LYS  13   4.787   0.450   8.398
  409    HA   LYS  13           HA       LYS  13   3.505   0.524  10.912
  410    HB2  LYS  13           HB2      LYS  13   5.583   1.765  10.388
  411    HB3  LYS  13           HB1      LYS  13   4.657   2.835   9.335
  412    HG2  LYS  13           HG2      LYS  13   3.269   3.539  11.240
  413    HG3  LYS  13           HG1      LYS  13   4.151   2.439  12.300
  414    HD2  LYS  13           HD2      LYS  13   6.240   3.670  11.831
  415    HD3  LYS  13           HD1      LYS  13   5.349   4.776  10.783
  416    HE2  LYS  13           HE2      LYS  13   3.942   5.457  12.693
  417    HE3  LYS  13           HE1      LYS  13   4.830   4.351  13.742
  418    HZ1  LYS  13           HZ1      LYS  13   5.473   6.925  13.362
  419    HZ2  LYS  13           HZ2      LYS  13   6.483   6.170  12.223
  420    HZ3  LYS  13           HZ3      LYS  13   6.570   5.731  13.863
  421    H    LEU  14           HN       LEU  14   2.728   2.051   7.810
  422    HA   LEU  14           HA       LEU  14   0.550   3.601   8.714
  423    HB2  LEU  14           HB2      LEU  14   1.246   2.435   6.016
  424    HB3  LEU  14           HB1      LEU  14  -0.150   3.476   6.263
  425    HG   LEU  14           HG       LEU  14   2.640   4.295   7.121
  426   HD11  LEU  14          HD11      LEU  14   2.882   3.987   4.773
  427   HD12  LEU  14          HD12      LEU  14   2.542   5.704   4.968
  428   HD13  LEU  14          HD13      LEU  14   1.265   4.606   4.443
  429   HD21  LEU  14          HD21      LEU  14   1.462   6.597   6.676
  430   HD22  LEU  14          HD22      LEU  14   1.050   5.726   8.140
  431   HD23  LEU  14          HD23      LEU  14  -0.035   5.675   6.752
  432    H    LEU  15           HN       LEU  15   0.736   0.307   7.468
  433    HA   LEU  15           HA       LEU  15  -2.051  -0.186   7.408
  434    HB2  LEU  15           HB2      LEU  15   0.298  -2.072   7.715
  435    HB3  LEU  15           HB1      LEU  15  -1.363  -2.593   7.444
  436    HG   LEU  15           HG       LEU  15   0.136  -0.705   5.608
  437   HD11  LEU  15          HD11      LEU  15   1.246  -2.820   5.454
  438   HD12  LEU  15          HD12      LEU  15   0.152  -2.728   4.072
  439   HD13  LEU  15          HD13      LEU  15  -0.287  -3.695   5.480
  440   HD21  LEU  15          HD21      LEU  15  -2.104  -0.314   5.129
  441   HD22  LEU  15          HD22      LEU  15  -2.614  -1.932   5.606
  442   HD23  LEU  15          HD23      LEU  15  -1.808  -1.677   4.061
  443    H    ASP  16           HN       ASP  16   0.391  -0.604   9.911
  444    HA   ASP  16           HA       ASP  16  -1.216  -1.968  11.789
  445    HB2  ASP  16           HB2      ASP  16   1.198  -0.181  12.112
  446    HB3  ASP  16           HB1      ASP  16   0.434  -1.017  13.464
  447    H    ASP  17           HN       ASP  17  -0.779   1.446  11.071
  448    HA   ASP  17           HA       ASP  17  -2.130   2.488  13.330
  449    HB2  ASP  17           HB2      ASP  17  -1.631   3.606  10.569
  450    HB3  ASP  17           HB1      ASP  17  -2.431   4.523  11.844
  451    H    SER  18           HN       SER  18  -3.271   0.697  10.709
  452    HA   SER  18           HA       SER  18  -5.751   1.848  10.176
  453    HB2  SER  18           HB2      SER  18  -6.399  -0.334   9.316
  454    HB3  SER  18           HB1      SER  18  -4.721  -0.020   8.881
  455    HG   SER  18           HG       SER  18  -4.496  -1.924   9.787
  456    H    SER  19           HN       SER  19  -4.648   0.078  12.885
  457    HA   SER  19           HA       SER  19  -7.300  -0.503  13.905
  458    HB2  SER  19           HB2      SER  19  -5.356  -2.019  14.331
  459    HB3  SER  19           HB1      SER  19  -4.656  -0.753  15.334
  460    HG   SER  19           HG       SER  19  -6.112  -1.126  16.835
  461    H    SER  20           HN       SER  20  -5.104   2.056  14.011
  462    HA   SER  20           HA       SER  20  -5.986   3.182  16.526
  463    HB2  SER  20           HB2      SER  20  -4.532   5.024  16.029
  464    HB3  SER  20           HB1      SER  20  -3.692   3.549  15.558
  465    HG   SER  20           HG       SER  20  -3.582   4.413  13.655
  466    H2   ZBR 100           HA3      TBS 100  -1.351   0.990  -2.007
  467    H4   ZBR 100           HC3      TBS 100   0.567   1.624   1.824
  468    H6   ZBR 100           HB3      TBS 100   2.873   0.156  -1.541
  469    H7   ZBR 100          HB11      TBS 100   1.490   0.752  -3.908
  470    H7A  ZBR 100          HB12      TBS 100  -0.154   0.109  -3.802
  471    H8   ZBR 100          HA11      TBS 100  -2.185   2.684   0.014
  472    H8A  ZBR 100          HA12      TBS 100  -1.714   2.058   1.599
  473    H9   ZBR 100          HC11      TBS 100   3.337   1.842   1.413
  474    H9A  ZBR 100          HC12      TBS 100   3.916   0.425   0.531
  Start of MODEL   15
    1    H1   LYS   1           HN       LYS   1  -6.989   5.296  16.943
    2    HA   LYS   1           HA       LYS   1  -9.121   5.775  15.092
    3    HB2  LYS   1           HB2      LYS   1  -8.290   7.164  17.646
    4    HB3  LYS   1           HB1      LYS   1  -9.730   7.595  16.724
    5    HG2  LYS   1           HG2      LYS   1 -10.582   5.294  16.962
    6    HG3  LYS   1           HG1      LYS   1  -9.141   4.854  17.880
    7    HD2  LYS   1           HD2      LYS   1  -9.713   6.482  19.615
    8    HD3  LYS   1           HD1      LYS   1 -11.117   7.010  18.687
    9    HE2  LYS   1           HE2      LYS   1 -11.839   5.438  20.411
   10    HE3  LYS   1           HE1      LYS   1 -12.029   4.691  18.825
   11    HZ1  LYS   1           HZ1      LYS   1  -9.715   4.292  20.642
   12    HZ2  LYS   1           HZ2      LYS   1  -9.938   3.549  19.130
   13    HZ3  LYS   1           HZ3      LYS   1 -10.986   3.192  20.421
   14    H    ASN   2           HN       ASN   2  -6.102   6.492  14.627
   15    HA   ASN   2           HA       ASN   2  -5.935   9.254  14.295
   16    HB2  ASN   2           HB2      ASN   2  -4.071   8.723  12.687
   17    HB3  ASN   2           HB1      ASN   2  -3.936   7.888  14.231
   18   HD21  ASN   2          HD21      ASN   2  -2.784   6.987  11.662
   19   HD22  ASN   2          HD22      ASN   2  -3.508   5.494  11.317
   20    HA   PRO   3           HA       PRO   3  -8.446  10.088  10.746
   21    HB2  PRO   3           HB2      PRO   3  -6.973  12.118   9.562
   22    HB3  PRO   3           HB1      PRO   3  -8.004  12.341  10.989
   23    HG2  PRO   3           HG2      PRO   3  -5.044  11.947  10.837
   24    HG3  PRO   3           HG1      PRO   3  -5.982  13.048  11.863
   25    HD2  PRO   3           HD2      PRO   3  -4.977  10.750  12.817
   26    HD3  PRO   3           HD1      PRO   3  -6.532  11.378  13.387
   27    H    GLU   4           HN       GLU   4  -5.114   9.211  10.399
   28    HA   GLU   4           HA       GLU   4  -4.969   9.024   7.575
   29    HB2  GLU   4           HB2      GLU   4  -3.456   7.498   9.705
   30    HB3  GLU   4           HB1      GLU   4  -3.031   7.538   7.997
   31    HG2  GLU   4           HG2      GLU   4  -3.241   9.989   9.766
   32    HG3  GLU   4           HG1      GLU   4  -1.729   9.177   9.365
   33    H    ALA   5           HN       ALA   5  -6.724   7.241   9.850
   34    HA   ALA   5           HA       ALA   5  -6.654   4.634   8.831
   35    HB1  ALA   5           HB1      ALA   5  -8.689   4.266  10.028
   36    HB2  ALA   5           HB2      ALA   5  -9.117   5.975   9.960
   37    HB3  ALA   5           HB3      ALA   5  -7.774   5.442  10.971
   38    H    GLU   6           HN       GLU   6  -8.513   7.479   7.818
   39    HA   GLU   6           HA       GLU   6 -10.240   6.174   6.000
   40    HB2  GLU   6           HB2      GLU   6  -9.159   8.988   6.164
   41    HB3  GLU   6           HB1      GLU   6 -10.281   8.493   4.895
   42    HG2  GLU   6           HG2      GLU   6 -11.583   9.420   6.698
   43    HG3  GLU   6           HG1      GLU   6 -11.834   7.680   6.709
   44    H    GLU   7           HN       GLU   7  -6.956   7.412   5.677
   45    HA   GLU   7           HA       GLU   7  -6.733   7.126   2.877
   46    HB2  GLU   7           HB2      GLU   7  -5.122   8.428   4.220
   47    HB3  GLU   7           HB1      GLU   7  -4.566   6.939   4.986
   48    HG2  GLU   7           HG2      GLU   7  -3.058   7.562   3.154
   49    HG3  GLU   7           HG1      GLU   7  -3.887   6.061   2.763
   50    H    ILE   8           HN       ILE   8  -6.200   4.913   5.566
   51    HA   ILE   8           HA       ILE   8  -5.008   2.793   4.101
   52    HB   ILE   8           HB       ILE   8  -6.817   2.581   6.531
   53   HG12  ILE   8          HG12      ILE   8  -5.054   4.192   6.990
   54   HG13  ILE   8          HG11      ILE   8  -4.651   2.691   7.805
   55   HG21  ILE   8          HG21      ILE   8  -4.475   0.784   5.892
   56   HG22  ILE   8          HG22      ILE   8  -6.025   0.481   5.128
   57   HG23  ILE   8          HG23      ILE   8  -5.893   0.453   6.873
   58   HD11  ILE   8          HD11      ILE   8  -3.313   2.151   5.617
   59   HD12  ILE   8          HD12      ILE   8  -2.621   3.271   6.788
   60   HD13  ILE   8          HD13      ILE   8  -3.413   3.889   5.343
   61    H    THR   9           HN       THR   9  -8.396   3.572   4.782
   62    HA   THR   9           HA       THR   9  -9.541   1.253   3.667
   63    HB   THR   9           HB       THR   9 -10.638   4.072   3.790
   64    HG1  THR   9           HG1      THR   9 -11.513   3.387   5.699
   65   HG21  THR   9          HG21      THR   9 -11.927   1.397   3.221
   66   HG22  THR   9          HG22      THR   9 -11.928   2.831   2.195
   67   HG23  THR   9          HG23      THR   9 -12.846   2.823   3.701
   68    H    ARG  10           HN       ARG  10  -8.640   4.359   2.206
   69    HA   ARG  10           HA       ARG  10  -9.641   3.829  -0.390
   70    HB2  ARG  10           HB2      ARG  10  -8.995   6.084   0.378
   71    HB3  ARG  10           HB1      ARG  10  -7.307   5.576   0.413
   72    HG2  ARG  10           HG2      ARG  10  -7.283   5.200  -1.959
   73    HG3  ARG  10           HG1      ARG  10  -9.030   5.422  -2.072
   74    HD2  ARG  10           HD2      ARG  10  -7.947   7.465  -2.810
   75    HD3  ARG  10           HD1      ARG  10  -8.728   7.768  -1.262
   76    HE   ARG  10           HE       ARG  10  -6.041   6.986  -0.813
   77   HH11  ARG  10          HH11      ARG  10  -4.532   8.603  -0.303
   78   HH12  ARG  10          HH12      ARG  10  -4.874  10.254  -0.680
   79   HH21  ARG  10          HH21      ARG  10  -7.970   9.570  -2.080
   80   HH22  ARG  10          HH22      ARG  10  -6.819  10.804  -1.688
   81    H    CYS  11           HN       CYS  11  -6.500   3.218   1.132
   82    HA   CYS  11           HA       CYS  11  -5.078   2.332  -1.106
   83    HB2  CYS  11           HB2      CYS  11  -4.145   2.741   1.189
   84    HB3  CYS  11           HB1      CYS  11  -4.858   1.211   1.694
   85    H    LYS  12           HN       LYS  12  -7.193   0.563   1.117
   86    HA   LYS  12           HA       LYS  12  -6.847  -2.003  -0.005
   87    HB2  LYS  12           HB2      LYS  12  -7.899  -1.585   2.200
   88    HB3  LYS  12           HB1      LYS  12  -9.294  -0.884   1.380
   89    HG2  LYS  12           HG2      LYS  12  -9.731  -2.999   0.235
   90    HG3  LYS  12           HG1      LYS  12  -8.286  -3.711   0.953
   91    HD2  LYS  12           HD2      LYS  12  -9.248  -3.371   3.208
   92    HD3  LYS  12           HD1      LYS  12 -10.704  -2.695   2.476
   93    HE2  LYS  12           HE2      LYS  12  -9.652  -5.483   1.919
   94    HE3  LYS  12           HE1      LYS  12 -10.939  -5.117   3.068
   95    HZ1  LYS  12           HZ1      LYS  12 -12.405  -4.911   1.432
   96    HZ2  LYS  12           HZ2      LYS  12 -11.241  -5.582   0.392
   97    HZ3  LYS  12           HZ3      LYS  12 -11.390  -3.895   0.530
   98    H    LYS  13           HN       LYS  13  -9.140   0.603  -0.714
   99    HA   LYS  13           HA       LYS  13 -10.742  -0.781  -2.571
  100    HB2  LYS  13           HB2      LYS  13 -11.348   1.410  -1.590
  101    HB3  LYS  13           HB1      LYS  13 -10.062   2.169  -2.528
  102    HG2  LYS  13           HG2      LYS  13 -11.136   1.426  -4.622
  103    HG3  LYS  13           HG1      LYS  13 -12.412   0.643  -3.688
  104    HD2  LYS  13           HD2      LYS  13 -13.076   2.810  -2.746
  105    HD3  LYS  13           HD1      LYS  13 -11.773   3.605  -3.631
  106    HE2  LYS  13           HE2      LYS  13 -13.898   3.855  -4.841
  107    HE3  LYS  13           HE1      LYS  13 -12.780   2.854  -5.767
  108    HZ1  LYS  13           HZ1      LYS  13 -14.286   1.254  -5.750
  109    HZ2  LYS  13           HZ2      LYS  13 -15.334   2.195  -4.798
  110    HZ3  LYS  13           HZ3      LYS  13 -14.195   1.173  -4.059
  111    H    LEU  14           HN       LEU  14  -7.738   1.059  -2.961
  112    HA   LEU  14           HA       LEU  14  -7.642   1.015  -5.773
  113    HB2  LEU  14           HB2      LEU  14  -5.557   1.237  -3.609
  114    HB3  LEU  14           HB1      LEU  14  -5.080   1.193  -5.304
  115    HG   LEU  14           HG       LEU  14  -7.235   3.117  -4.412
  116   HD11  LEU  14          HD11      LEU  14  -5.558   3.749  -2.887
  117   HD12  LEU  14          HD12      LEU  14  -5.256   4.801  -4.265
  118   HD13  LEU  14          HD13      LEU  14  -4.252   3.372  -4.008
  119   HD21  LEU  14          HD21      LEU  14  -6.242   4.426  -6.313
  120   HD22  LEU  14          HD22      LEU  14  -6.845   2.856  -6.823
  121   HD23  LEU  14          HD23      LEU  14  -5.115   3.104  -6.596
  122    H    LEU  15           HN       LEU  15  -6.445  -1.270  -3.354
  123    HA   LEU  15           HA       LEU  15  -5.136  -3.006  -5.175
  124    HB2  LEU  15           HB2      LEU  15  -6.359  -3.516  -2.452
  125    HB3  LEU  15           HB1      LEU  15  -5.356  -4.676  -3.320
  126    HG   LEU  15           HG       LEU  15  -4.457  -1.865  -2.632
  127   HD11  LEU  15          HD11      LEU  15  -3.235  -2.791  -0.784
  128   HD12  LEU  15          HD12      LEU  15  -3.662  -4.437  -1.251
  129   HD13  LEU  15          HD13      LEU  15  -4.901  -3.347  -0.624
  130   HD21  LEU  15          HD21      LEU  15  -2.175  -3.144  -2.993
  131   HD22  LEU  15          HD22      LEU  15  -3.076  -2.571  -4.384
  132   HD23  LEU  15          HD23      LEU  15  -3.168  -4.270  -3.920
  133    H    ASP  16           HN       ASP  16  -8.424  -2.943  -3.871
  134    HA   ASP  16           HA       ASP  16  -9.308  -5.352  -5.074
  135    HB2  ASP  16           HB2      ASP  16 -10.781  -2.904  -4.106
  136    HB3  ASP  16           HB1      ASP  16 -11.605  -4.322  -4.752
  137    H    ASP  17           HN       ASP  17  -9.259  -2.003  -6.161
  138    HA   ASP  17           HA       ASP  17 -10.794  -2.361  -8.510
  139    HB2  ASP  17           HB2      ASP  17  -8.725  -0.303  -7.734
  140    HB3  ASP  17           HB1      ASP  17  -9.620  -0.238  -9.251
  141    H    SER  18           HN       SER  18  -7.749  -3.518  -7.680
  142    HA   SER  18           HA       SER  18  -6.300  -3.305 -10.053
  143    HB2  SER  18           HB2      SER  18  -4.975  -5.158  -9.226
  144    HB3  SER  18           HB1      SER  18  -5.407  -4.117  -7.870
  145    HG   SER  18           HG       SER  18  -6.178  -5.894  -7.057
  146    H    SER  19           HN       SER  19  -9.034  -5.183  -9.284
  147    HA   SER  19           HA       SER  19  -8.669  -7.128 -11.393
  148    HB2  SER  19           HB2      SER  19  -9.898  -7.731  -9.342
  149    HB3  SER  19           HB1      SER  19 -11.117  -6.520  -9.732
  150    HG   SER  19           HG       SER  19 -11.959  -8.239 -10.680
  151    H    SER  20           HN       SER  20  -9.873  -3.985 -11.139
  152    HA   SER  20           HA       SER  20 -11.731  -4.114 -13.344
  153    HB2  SER  20           HB2      SER  20 -11.958  -2.453 -11.498
  154    HB3  SER  20           HB1      SER  20 -10.481  -1.675 -12.060
  155    HG   SER  20           HG       SER  20 -11.688  -0.685 -13.454
  156    H1   LYS   1           HN       LYS   1 -11.455  -3.161 -15.398
  157    HA   LYS   1           HA       LYS   1  -8.843  -3.520 -16.516
  158    HB2  LYS   1           HB2      LYS   1 -11.421  -2.455 -17.680
  159    HB3  LYS   1           HB1      LYS   1  -9.947  -2.688 -18.620
  160    HG2  LYS   1           HG2      LYS   1  -9.934  -5.080 -18.006
  161    HG3  LYS   1           HG1      LYS   1 -11.417  -4.847 -17.078
  162    HD2  LYS   1           HD2      LYS   1 -12.612  -4.167 -19.107
  163    HD3  LYS   1           HD1      LYS   1 -11.130  -4.318 -20.051
  164    HE2  LYS   1           HE2      LYS   1 -12.507  -6.329 -20.328
  165    HE3  LYS   1           HE1      LYS   1 -11.023  -6.729 -19.463
  166    HZ1  LYS   1           HZ1      LYS   1 -13.640  -6.157 -18.184
  167    HZ2  LYS   1           HZ2      LYS   1 -12.212  -6.619 -17.387
  168    HZ3  LYS   1           HZ3      LYS   1 -12.997  -7.706 -18.431
  169    H    ASN   2           HN       ASN   2  -9.705  -1.228 -14.546
  170    HA   ASN   2           HA       ASN   2  -9.321   1.199 -15.863
  171    HB2  ASN   2           HB2      ASN   2  -8.716   2.082 -13.581
  172    HB3  ASN   2           HB1      ASN   2 -10.216   1.163 -13.616
  173   HD21  ASN   2          HD21      ASN   2  -8.440   1.554 -11.271
  174   HD22  ASN   2          HD22      ASN   2  -7.928   0.005 -10.812
  175    HA   PRO   3           HA       PRO   3  -4.995   1.272 -16.787
  176    HB2  PRO   3           HB2      PRO   3  -4.453   3.967 -16.406
  177    HB3  PRO   3           HB1      PRO   3  -5.274   3.311 -17.836
  178    HG2  PRO   3           HG2      PRO   3  -6.446   4.590 -15.402
  179    HG3  PRO   3           HG1      PRO   3  -6.896   4.787 -17.107
  180    HD2  PRO   3           HD2      PRO   3  -8.325   3.239 -15.444
  181    HD3  PRO   3           HD1      PRO   3  -8.123   2.812 -17.152
  182    H    GLU   4           HN       GLU   4  -6.173   2.412 -13.732
  183    HA   GLU   4           HA       GLU   4  -3.707   2.907 -12.433
  184    HB2  GLU   4           HB2      GLU   4  -6.367   2.025 -11.288
  185    HB3  GLU   4           HB1      GLU   4  -5.009   2.631 -10.341
  186    HG2  GLU   4           HG2      GLU   4  -6.374   4.174 -12.565
  187    HG3  GLU   4           HG1      GLU   4  -6.701   4.397 -10.848
  188    H    ALA   5           HN       ALA   5  -5.101   0.039 -13.562
  189    HA   ALA   5           HA       ALA   5  -4.353  -1.853 -11.638
  190    HB1  ALA   5           HB1      ALA   5  -4.572  -3.485 -13.367
  191    HB2  ALA   5           HB2      ALA   5  -4.224  -2.299 -14.624
  192    HB3  ALA   5           HB3      ALA   5  -5.748  -2.224 -13.739
  193    H    GLU   6           HN       GLU   6  -2.482  -0.299 -14.217
  194    HA   GLU   6           HA       GLU   6  -0.171  -1.909 -14.035
  195    HB2  GLU   6           HB2      GLU   6  -0.637   0.939 -14.917
  196    HB3  GLU   6           HB1      GLU   6   0.965   0.204 -14.961
  197    HG2  GLU   6           HG2      GLU   6  -0.033  -0.115 -17.127
  198    HG3  GLU   6           HG1      GLU   6  -0.040  -1.676 -16.319
  199    H    GLU   7           HN       GLU   7  -1.239   0.912 -12.217
  200    HA   GLU   7           HA       GLU   7   1.176   1.375 -10.823
  201    HB2  GLU   7           HB2      GLU   7  -0.668   3.022 -10.905
  202    HB3  GLU   7           HB1      GLU   7  -1.667   1.937  -9.937
  203    HG2  GLU   7           HG2      GLU   7  -0.632   3.636  -8.502
  204    HG3  GLU   7           HG1      GLU   7   0.008   2.047  -8.104
  205    H    ILE   8           HN       ILE   8  -1.603  -0.706 -10.203
  206    HA   ILE   8           HA       ILE   8  -0.917  -1.510  -7.569
  207    HB   ILE   8           HB       ILE   8  -2.328  -3.154  -9.697
  208   HG12  ILE   8          HG12      ILE   8  -3.415  -0.986  -9.524
  209   HG13  ILE   8          HG11      ILE   8  -4.409  -2.167  -8.684
  210   HG21  ILE   8          HG21      ILE   8  -2.894  -3.236  -6.732
  211   HG22  ILE   8          HG22      ILE   8  -1.530  -4.142  -7.364
  212   HG23  ILE   8          HG23      ILE   8  -3.146  -4.478  -7.946
  213   HD11  ILE   8          HD11      ILE   8  -3.039  -1.427  -6.567
  214   HD12  ILE   8          HD12      ILE   8  -4.344  -0.397  -7.151
  215   HD13  ILE   8          HD13      ILE   8  -2.671  -0.001  -7.534
  216    H    THR   9           HN       THR   9  -0.020  -2.816 -10.741
  217    HA   THR   9           HA       THR   9   1.350  -5.101  -9.830
  218    HB   THR   9           HB       THR   9   1.881  -3.388 -12.272
  219    HG1  THR   9           HG1      THR   9   0.497  -4.795 -13.265
  220   HG21  THR   9          HG21      THR   9   2.795  -6.153 -11.463
  221   HG22  THR   9          HG22      THR   9   3.795  -4.773 -11.915
  222   HG23  THR   9          HG23      THR   9   2.820  -5.592 -13.135
  223    H    ARG  10           HN       ARG  10   2.451  -1.766 -10.383
  224    HA   ARG  10           HA       ARG  10   5.190  -2.202  -9.811
  225    HB2  ARG  10           HB2      ARG  10   4.347  -0.162 -10.912
  226    HB3  ARG  10           HB1      ARG  10   3.548   0.307  -9.410
  227    HG2  ARG  10           HG2      ARG  10   5.642   0.509  -8.258
  228    HG3  ARG  10           HG1      ARG  10   6.523  -0.220  -9.602
  229    HD2  ARG  10           HD2      ARG  10   6.826   2.189  -9.690
  230    HD3  ARG  10           HD1      ARG  10   5.810   1.694 -11.039
  231    HE   ARG  10           HE       ARG  10   4.164   2.390  -8.841
  232   HH11  ARG  10          HH11      ARG  10   3.134   4.415  -8.882
  233   HH12  ARG  10          HH12      ARG  10   3.729   5.667  -9.912
  234   HH21  ARG  10          HH21      ARG  10   6.320   3.751 -11.187
  235   HH22  ARG  10          HH22      ARG  10   5.533   5.294 -11.217
  236    H    CYS  11           HN       CYS  11   2.437  -1.326  -7.753
  237    HA   CYS  11           HA       CYS  11   3.793  -0.864  -5.351
  238    HB2  CYS  11           HB2      CYS  11   1.354  -0.477  -5.790
  239    HB3  CYS  11           HB1      CYS  11   1.106  -2.213  -5.634
  240    H    LYS  12           HN       LYS  12   2.600  -3.894  -6.759
  241    HA   LYS  12           HA       LYS  12   3.303  -5.591  -4.610
  242    HB2  LYS  12           HB2      LYS  12   1.795  -6.260  -6.459
  243    HB3  LYS  12           HB1      LYS  12   3.174  -6.259  -7.560
  244    HG2  LYS  12           HG2      LYS  12   4.275  -7.996  -6.244
  245    HG3  LYS  12           HG1      LYS  12   2.972  -7.958  -5.055
  246    HD2  LYS  12           HD2      LYS  12   1.367  -8.649  -6.807
  247    HD3  LYS  12           HD1      LYS  12   2.686  -8.721  -7.977
  248    HE2  LYS  12           HE2      LYS  12   2.584 -10.338  -5.414
  249    HE3  LYS  12           HE1      LYS  12   2.125 -10.957  -7.001
  250    HZ1  LYS  12           HZ1      LYS  12   4.241 -11.248  -7.544
  251    HZ2  LYS  12           HZ2      LYS  12   4.643 -10.934  -5.924
  252    HZ3  LYS  12           HZ3      LYS  12   4.667  -9.677  -7.066
  253    H    LYS  13           HN       LYS  13   5.082  -4.509  -7.473
  254    HA   LYS  13           HA       LYS  13   7.368  -6.124  -7.140
  255    HB2  LYS  13           HB2      LYS  13   6.866  -4.857  -9.207
  256    HB3  LYS  13           HB1      LYS  13   7.202  -3.353  -8.347
  257    HG2  LYS  13           HG2      LYS  13   9.507  -4.104  -7.905
  258    HG3  LYS  13           HG1      LYS  13   9.172  -5.626  -8.731
  259    HD2  LYS  13           HD2      LYS  13   8.729  -4.417 -10.820
  260    HD3  LYS  13           HD1      LYS  13   9.009  -2.879 -10.001
  261    HE2  LYS  13           HE2      LYS  13  11.028  -3.564 -11.217
  262    HE3  LYS  13           HE1      LYS  13  11.325  -3.598  -9.479
  263    HZ1  LYS  13           HZ1      LYS  13  11.898  -5.710  -9.699
  264    HZ2  LYS  13           HZ2      LYS  13  11.473  -5.712 -11.344
  265    HZ3  LYS  13           HZ3      LYS  13  10.310  -6.082 -10.162
  266    H    LEU  14           HN       LEU  14   6.510  -2.944  -5.844
  267    HA   LEU  14           HA       LEU  14   9.001  -2.343  -4.672
  268    HB2  LEU  14           HB2      LEU  14   6.162  -1.498  -4.117
  269    HB3  LEU  14           HB1      LEU  14   7.476  -0.932  -3.088
  270    HG   LEU  14           HG       LEU  14   7.733  -0.683  -6.091
  271   HD11  LEU  14          HD11      LEU  14   5.664   0.405  -5.849
  272   HD12  LEU  14          HD12      LEU  14   6.818   1.722  -5.670
  273   HD13  LEU  14          HD13      LEU  14   6.054   1.018  -4.242
  274   HD21  LEU  14          HD21      LEU  14   9.070   1.316  -5.376
  275   HD22  LEU  14          HD22      LEU  14   9.699  -0.181  -4.699
  276   HD23  LEU  14          HD23      LEU  14   8.739   0.905  -3.696
  277    H    LEU  15           HN       LEU  15   6.182  -4.079  -3.429
  278    HA   LEU  15           HA       LEU  15   7.159  -4.433  -0.792
  279    HB2  LEU  15           HB2      LEU  15   5.212  -6.070  -2.438
  280    HB3  LEU  15           HB1      LEU  15   5.494  -6.304  -0.715
  281    HG   LEU  15           HG       LEU  15   4.632  -3.667  -1.936
  282   HD11  LEU  15          HD11      LEU  15   2.393  -4.162  -1.215
  283   HD12  LEU  15          HD12      LEU  15   2.916  -5.646  -0.419
  284   HD13  LEU  15          HD13      LEU  15   2.941  -5.533  -2.180
  285   HD21  LEU  15          HD21      LEU  15   3.902  -3.418   0.591
  286   HD22  LEU  15          HD22      LEU  15   5.572  -3.134   0.140
  287   HD23  LEU  15          HD23      LEU  15   5.109  -4.671   0.870
  288    H    ASP  16           HN       ASP  16   7.414  -6.398  -3.722
  289    HA   ASP  16           HA       ASP  16   8.741  -8.600  -2.531
  290    HB2  ASP  16           HB2      ASP  16   8.645  -7.586  -5.371
  291    HB3  ASP  16           HB1      ASP  16   9.489  -9.063  -4.907
  292    H    ASP  17           HN       ASP  17   9.889  -5.602  -3.969
  293    HA   ASP  17           HA       ASP  17  12.647  -6.242  -3.987
  294    HB2  ASP  17           HB2      ASP  17  11.179  -3.603  -3.952
  295    HB3  ASP  17           HB1      ASP  17  12.933  -3.727  -4.066
  296    H    SER  18           HN       SER  18  10.521  -5.745  -1.436
  297    HA   SER  18           HA       SER  18  12.037  -4.306   0.411
  298    HB2  SER  18           HB2      SER  18  10.615  -5.290   2.111
  299    HB3  SER  18           HB1      SER  18   9.640  -4.949   0.682
  300    HG   SER  18           HG       SER  18   9.160  -6.986   0.767
  301    H    SER  19           HN       SER  19  12.427  -7.465  -0.803
  302    HA   SER  19           HA       SER  19  14.054  -8.432   1.383
  303    HB2  SER  19           HB2      SER  19  12.717 -10.005   0.036
  304    HB3  SER  19           HB1      SER  19  13.660  -9.573  -1.387
  305    HG   SER  19           HG       SER  19  14.766 -11.254  -0.650
  306    H    SER  20           HN       SER  20  14.528  -6.542  -1.375
  307    HA   SER  20           HA       SER  20  17.314  -7.180  -1.790
  308    HB2  SER  20           HB2      SER  20  15.841  -6.332  -3.617
  309    HB3  SER  20           HB1      SER  20  15.758  -4.782  -2.784
  310    HG   SER  20           HG       SER  20  17.573  -4.354  -3.737
  311    H1   LYS   1           HN       LYS   1  19.089  -5.818  -1.344
  312    HA   LYS   1           HA       LYS   1  18.932  -4.485   1.184
  313    HB2  LYS   1           HB2      LYS   1  21.163  -4.747  -0.839
  314    HB3  LYS   1           HB1      LYS   1  21.349  -3.953   0.726
  315    HG2  LYS   1           HG2      LYS   1  20.667  -6.029   1.869
  316    HG3  LYS   1           HG1      LYS   1  20.478  -6.829   0.308
  317    HD2  LYS   1           HD2      LYS   1  22.859  -6.482  -0.182
  318    HD3  LYS   1           HD1      LYS   1  23.063  -5.636   1.354
  319    HE2  LYS   1           HE2      LYS   1  23.794  -7.957   1.596
  320    HE3  LYS   1           HE1      LYS   1  22.334  -7.695   2.550
  321    HZ1  LYS   1           HZ1      LYS   1  22.412  -8.862  -0.180
  322    HZ2  LYS   1           HZ2      LYS   1  21.024  -8.644   0.775
  323    HZ3  LYS   1           HZ3      LYS   1  22.226  -9.745   1.256
  324    H    ASN   2           HN       ASN   2  17.657  -3.472  -1.497
  325    HA   ASN   2           HA       ASN   2  18.806  -0.999  -2.088
  326    HB2  ASN   2           HB2      ASN   2  16.538  -0.429  -3.030
  327    HB3  ASN   2           HB1      ASN   2  17.179  -1.969  -3.590
  328   HD21  ASN   2          HD21      ASN   2  14.316  -1.195  -3.420
  329   HD22  ASN   2          HD22      ASN   2  13.600  -2.300  -2.352
  330    HA   PRO   3           HA       PRO   3  17.746   1.543   1.376
  331    HB2  PRO   3           HB2      PRO   3  17.323   3.969   0.102
  332    HB3  PRO   3           HB1      PRO   3  18.927   3.286   0.428
  333    HG2  PRO   3           HG2      PRO   3  17.320   3.224  -2.092
  334    HG3  PRO   3           HG1      PRO   3  19.060   3.494  -1.870
  335    HD2  PRO   3           HD2      PRO   3  18.094   1.122  -2.682
  336    HD3  PRO   3           HD1      PRO   3  19.521   1.227  -1.638
  337    H    GLU   4           HN       GLU   4  15.582   1.223  -1.311
  338    HA   GLU   4           HA       GLU   4  13.365   2.668  -0.304
  339    HB2  GLU   4           HB2      GLU   4  13.447   0.298  -2.184
  340    HB3  GLU   4           HB1      GLU   4  12.044   1.328  -1.909
  341    HG2  GLU   4           HG2      GLU   4  14.727   2.330  -2.897
  342    HG3  GLU   4           HG1      GLU   4  13.354   1.975  -3.943
  343    H    ALA   5           HN       ALA   5  14.840  -0.182   0.755
  344    HA   ALA   5           HA       ALA   5  12.683  -1.749   1.621
  345    HB1  ALA   5           HB1      ALA   5  14.243  -2.856   3.043
  346    HB2  ALA   5           HB2      ALA   5  15.287  -1.436   3.121
  347    HB3  ALA   5           HB3      ALA   5  15.159  -2.355   1.622
  348    H    GLU   6           HN       GLU   6  14.266   1.054   3.098
  349    HA   GLU   6           HA       GLU   6  13.011   0.919   5.622
  350    HB2  GLU   6           HB2      GLU   6  14.157   3.197   4.007
  351    HB3  GLU   6           HB1      GLU   6  13.459   3.450   5.607
  352    HG2  GLU   6           HG2      GLU   6  15.824   3.115   5.900
  353    HG3  GLU   6           HG1      GLU   6  15.018   1.659   6.467
  354    H    GLU   7           HN       GLU   7  11.999   2.294   2.541
  355    HA   GLU   7           HA       GLU   7   9.720   3.663   3.490
  356    HB2  GLU   7           HB2      GLU   7  10.686   4.062   1.251
  357    HB3  GLU   7           HB1      GLU   7  10.201   2.439   0.761
  358    HG2  GLU   7           HG2      GLU   7   8.551   4.085  -0.007
  359    HG3  GLU   7           HG1      GLU   7   7.827   3.025   1.194
  360    H    ILE   8           HN       ILE   8  10.261   0.353   2.421
  361    HA   ILE   8           HA       ILE   8   7.553  -0.490   2.349
  362    HB   ILE   8           HB       ILE   8   9.983  -2.153   3.086
  363   HG12  ILE   8          HG12      ILE   8  10.422  -0.975   1.003
  364   HG13  ILE   8          HG11      ILE   8  10.049  -2.648   0.622
  365   HG21  ILE   8          HG21      ILE   8   7.571  -3.133   1.556
  366   HG22  ILE   8          HG22      ILE   8   7.474  -3.013   3.303
  367   HG23  ILE   8          HG23      ILE   8   8.690  -4.035   2.564
  368   HD11  ILE   8          HD11      ILE   8   7.585  -1.759   0.369
  369   HD12  ILE   8          HD12      ILE   8   8.739  -1.488  -0.933
  370   HD13  ILE   8          HD13      ILE   8   8.371  -0.191   0.199
  371    H    THR   9           HN       THR   9   9.933  -0.414   4.973
  372    HA   THR   9           HA       THR   9   8.395  -1.753   6.916
  373    HB   THR   9           HB       THR   9  10.451   0.443   7.276
  374    HG1  THR   9           HG1      THR   9  11.870  -1.240   7.441
  375   HG21  THR   9          HG21      THR   9   9.173  -1.520   9.186
  376   HG22  THR   9          HG22      THR   9   9.228   0.237   9.318
  377   HG23  THR   9          HG23      THR   9  10.699  -0.710   9.537
  378    H    ARG  10           HN       ARG  10   8.595   1.682   6.028
  379    HA   ARG  10           HA       ARG  10   6.868   2.667   8.044
  380    HB2  ARG  10           HB2      ARG  10   8.343   4.115   6.693
  381    HB3  ARG  10           HB1      ARG  10   7.356   3.774   5.271
  382    HG2  ARG  10           HG2      ARG  10   5.431   4.820   6.248
  383    HG3  ARG  10           HG1      ARG  10   6.227   4.962   7.817
  384    HD2  ARG  10           HD2      ARG  10   6.311   7.121   6.707
  385    HD3  ARG  10           HD1      ARG  10   7.935   6.445   6.755
  386    HE   ARG  10           HE       ARG  10   6.686   5.701   4.322
  387   HH11  ARG  10          HH11      ARG  10   7.275   6.821   2.438
  388   HH12  ARG  10          HH12      ARG  10   8.031   8.371   2.555
  389   HH21  ARG  10          HH21      ARG  10   7.980   8.430   6.020
  390   HH22  ARG  10          HH22      ARG  10   8.429   9.284   4.581
  391    H    CYS  11           HN       CYS  11   6.267   1.486   4.756
  392    HA   CYS  11           HA       CYS  11   3.544   2.093   4.545
  393    HB2  CYS  11           HB2      CYS  11   5.024   1.195   2.726
  394    HB3  CYS  11           HB1      CYS  11   4.892  -0.392   3.477
  395    H    LYS  12           HN       LYS  12   5.160  -0.740   5.946
  396    HA   LYS  12           HA       LYS  12   2.828  -2.201   6.590
  397    HB2  LYS  12           HB2      LYS  12   5.107  -3.172   6.588
  398    HB3  LYS  12           HB1      LYS  12   5.497  -2.214   8.017
  399    HG2  LYS  12           HG2      LYS  12   3.730  -3.329   9.289
  400    HG3  LYS  12           HG1      LYS  12   3.243  -4.236   7.858
  401    HD2  LYS  12           HD2      LYS  12   5.476  -5.293   7.773
  402    HD3  LYS  12           HD1      LYS  12   5.945  -4.403   9.222
  403    HE2  LYS  12           HE2      LYS  12   3.593  -6.309   9.087
  404    HE3  LYS  12           HE1      LYS  12   5.188  -6.746   9.702
  405    HZ1  LYS  12           HZ1      LYS  12   4.764  -5.747  11.621
  406    HZ2  LYS  12           HZ2      LYS  12   3.146  -5.601  11.125
  407    HZ3  LYS  12           HZ3      LYS  12   4.236  -4.325  10.863
  408    H    LYS  13           HN       LYS  13   4.687   0.220   8.381
  409    HA   LYS  13           HA       LYS  13   3.307   0.036  10.830
  410    HB2  LYS  13           HB2      LYS  13   5.450   1.241  10.545
  411    HB3  LYS  13           HB1      LYS  13   4.613   2.476   9.603
  412    HG2  LYS  13           HG2      LYS  13   3.167   2.984  11.539
  413    HG3  LYS  13           HG1      LYS  13   3.985   1.735  12.476
  414    HD2  LYS  13           HD2      LYS  13   6.109   2.939  12.275
  415    HD3  LYS  13           HD1      LYS  13   5.332   4.169  11.276
  416    HE2  LYS  13           HE2      LYS  13   5.504   4.944  13.602
  417    HE3  LYS  13           HE1      LYS  13   3.814   4.723  13.150
  418    HZ1  LYS  13           HZ1      LYS  13   3.600   3.308  14.815
  419    HZ2  LYS  13           HZ2      LYS  13   5.238   3.492  15.228
  420    HZ3  LYS  13           HZ3      LYS  13   4.766   2.290  14.122
  421    H    LEU  14           HN       LEU  14   2.686   1.926   7.902
  422    HA   LEU  14           HA       LEU  14   0.581   3.499   8.917
  423    HB2  LEU  14           HB2      LEU  14   1.357   2.564   6.159
  424    HB3  LEU  14           HB1      LEU  14  -0.102   3.522   6.399
  425    HG   LEU  14           HG       LEU  14   2.506   4.475   7.595
  426   HD11  LEU  14          HD11      LEU  14   3.261   4.236   5.392
  427   HD12  LEU  14          HD12      LEU  14   2.628   5.879   5.384
  428   HD13  LEU  14          HD13      LEU  14   1.676   4.561   4.694
  429   HD21  LEU  14          HD21      LEU  14   1.406   6.679   7.184
  430   HD22  LEU  14          HD22      LEU  14   0.410   5.639   8.194
  431   HD23  LEU  14          HD23      LEU  14   0.022   5.841   6.487
  432    H    LEU  15           HN       LEU  15   0.601   0.317   7.372
  433    HA   LEU  15           HA       LEU  15  -2.213  -0.005   7.261
  434    HB2  LEU  15           HB2      LEU  15   0.027  -2.040   7.401
  435    HB3  LEU  15           HB1      LEU  15  -1.657  -2.440   7.075
  436    HG   LEU  15           HG       LEU  15  -0.053  -0.468   5.427
  437   HD11  LEU  15          HD11      LEU  15   0.247  -2.208   3.793
  438   HD12  LEU  15          HD12      LEU  15  -0.765  -3.321   4.711
  439   HD13  LEU  15          HD13      LEU  15   0.812  -2.843   5.339
  440   HD21  LEU  15          HD21      LEU  15  -1.996  -1.185   3.780
  441   HD22  LEU  15          HD22      LEU  15  -2.296   0.034   5.006
  442   HD23  LEU  15          HD23      LEU  15  -2.834  -1.626   5.268
  443    H    ASP  16           HN       ASP  16   0.199  -0.875   9.696
  444    HA   ASP  16           HA       ASP  16  -1.572  -2.232  11.443
  445    HB2  ASP  16           HB2      ASP  16   1.078  -0.866  11.898
  446    HB3  ASP  16           HB1      ASP  16   0.210  -1.722  13.171
  447    H    ASP  17           HN       ASP  17  -0.613   1.139  11.141
  448    HA   ASP  17           HA       ASP  17  -1.834   2.074  13.519
  449    HB2  ASP  17           HB2      ASP  17  -1.070   3.458  10.947
  450    HB3  ASP  17           HB1      ASP  17  -1.755   4.313  12.326
  451    H    SER  18           HN       SER  18  -3.178   0.842  10.697
  452    HA   SER  18           HA       SER  18  -5.420   2.448  10.284
  453    HB2  SER  18           HB2      SER  18  -6.385   0.536   9.150
  454    HB3  SER  18           HB1      SER  18  -4.658   0.592   8.796
  455    HG   SER  18           HG       SER  18  -4.642  -1.355   9.561
  456    H    SER  19           HN       SER  19  -4.661   0.298  12.818
  457    HA   SER  19           HA       SER  19  -7.382  -0.092  13.713
  458    HB2  SER  19           HB2      SER  19  -5.664  -1.808  14.151
  459    HB3  SER  19           HB1      SER  19  -4.778  -0.650  15.140
  460    HG   SER  19           HG       SER  19  -6.005  -1.614  16.611
  461    H    SER  20           HN       SER  20  -5.002   2.285  14.060
  462    HA   SER  20           HA       SER  20  -5.886   3.327  16.604
  463    HB2  SER  20           HB2      SER  20  -3.555   3.628  15.773
  464    HB3  SER  20           HB1      SER  20  -4.178   4.669  14.496
  465    HG   SER  20           HG       SER  20  -4.066   6.192  15.933
  466    H2   ZBR 100           HA3      TBS 100  -1.240   1.300  -2.155
  467    H4   ZBR 100           HC3      TBS 100   0.565   2.043   1.696
  468    H6   ZBR 100           HB3      TBS 100   2.975   0.560  -1.569
  469    H7   ZBR 100          HB11      TBS 100   1.668   1.109  -3.976
  470    H7A  ZBR 100          HB12      TBS 100   0.025   0.464  -3.924
  471    H8   ZBR 100          HA11      TBS 100  -2.148   3.034  -0.206
  472    H8A  ZBR 100          HA12      TBS 100  -1.715   2.450   1.404
  473    H9   ZBR 100          HC11      TBS 100   3.314   2.316   1.382
  474    H9A  ZBR 100          HC12      TBS 100   3.972   0.925   0.513
  Start of MODEL   16
    1    H1   LYS   1           HN       LYS   1  -6.566   4.791  16.693
    2    HA   LYS   1           HA       LYS   1  -8.784   5.196  14.838
    3    HB2  LYS   1           HB2      LYS   1  -8.225   6.144  17.652
    4    HB3  LYS   1           HB1      LYS   1  -9.631   6.656  16.717
    5    HG2  LYS   1           HG2      LYS   1 -10.415   4.382  16.510
    6    HG3  LYS   1           HG1      LYS   1  -8.932   3.753  17.225
    7    HD2  LYS   1           HD2      LYS   1 -10.594   3.721  18.957
    8    HD3  LYS   1           HD1      LYS   1  -9.515   5.066  19.319
    9    HE2  LYS   1           HE2      LYS   1 -11.097   6.665  18.435
   10    HE3  LYS   1           HE1      LYS   1 -12.125   5.377  17.806
   11    HZ1  LYS   1           HZ1      LYS   1 -12.202   6.560  20.315
   12    HZ2  LYS   1           HZ2      LYS   1 -11.651   4.971  20.552
   13    HZ3  LYS   1           HZ3      LYS   1 -13.127   5.253  19.759
   14    H    ASN   2           HN       ASN   2  -5.836   6.277  14.771
   15    HA   ASN   2           HA       ASN   2  -6.069   9.075  14.894
   16    HB2  ASN   2           HB2      ASN   2  -3.924   9.129  13.700
   17    HB3  ASN   2           HB1      ASN   2  -3.896   7.963  15.015
   18   HD21  ASN   2          HD21      ASN   2  -5.849   6.622  12.680
   19   HD22  ASN   2          HD22      ASN   2  -4.690   5.710  11.844
   20    HA   PRO   3           HA       PRO   3  -8.087  10.252  11.107
   21    HB2  PRO   3           HB2      PRO   3  -5.811  12.133  10.589
   22    HB3  PRO   3           HB1      PRO   3  -7.552  12.469  10.676
   23    HG2  PRO   3           HG2      PRO   3  -5.927  13.173  12.652
   24    HG3  PRO   3           HG1      PRO   3  -7.552  12.547  12.987
   25    HD2  PRO   3           HD2      PRO   3  -4.905  11.161  13.253
   26    HD3  PRO   3           HD1      PRO   3  -6.354  11.053  14.273
   27    H    GLU   4           HN       GLU   4  -4.755   9.273  11.089
   28    HA   GLU   4           HA       GLU   4  -4.240   9.207   8.320
   29    HB2  GLU   4           HB2      GLU   4  -3.150   7.518  10.579
   30    HB3  GLU   4           HB1      GLU   4  -2.520   7.484   8.933
   31    HG2  GLU   4           HG2      GLU   4  -1.991   9.867   9.048
   32    HG3  GLU   4           HG1      GLU   4  -2.700   9.970  10.659
   33    H    ALA   5           HN       ALA   5  -6.332   7.344  10.246
   34    HA   ALA   5           HA       ALA   5  -6.306   4.847   8.968
   35    HB1  ALA   5           HB1      ALA   5  -7.546   5.432  11.086
   36    HB2  ALA   5           HB2      ALA   5  -8.485   4.499   9.920
   37    HB3  ALA   5           HB3      ALA   5  -8.753   6.234  10.079
   38    H    GLU   6           HN       GLU   6  -7.586   7.928   7.975
   39    HA   GLU   6           HA       GLU   6  -9.465   7.081   6.057
   40    HB2  GLU   6           HB2      GLU   6  -7.731   9.556   6.207
   41    HB3  GLU   6           HB1      GLU   6  -9.000   9.330   5.002
   42    HG2  GLU   6           HG2      GLU   6 -10.674   9.083   6.767
   43    HG3  GLU   6           HG1      GLU   6  -9.422   9.214   8.001
   44    H    GLU   7           HN       GLU   7  -5.964   7.547   5.884
   45    HA   GLU   7           HA       GLU   7  -5.696   7.246   3.091
   46    HB2  GLU   7           HB2      GLU   7  -3.891   8.136   4.528
   47    HB3  GLU   7           HB1      GLU   7  -3.701   6.545   5.262
   48    HG2  GLU   7           HG2      GLU   7  -2.023   6.867   3.499
   49    HG3  GLU   7           HG1      GLU   7  -3.145   5.596   3.029
   50    H    ILE   8           HN       ILE   8  -5.761   4.922   5.739
   51    HA   ILE   8           HA       ILE   8  -5.004   2.631   4.275
   52    HB   ILE   8           HB       ILE   8  -6.595   3.067   6.803
   53   HG12  ILE   8          HG12      ILE   8  -4.655   2.057   7.851
   54   HG13  ILE   8          HG11      ILE   8  -3.984   1.607   6.283
   55   HG21  ILE   8          HG21      ILE   8  -7.663   1.109   6.029
   56   HG22  ILE   8          HG22      ILE   8  -6.359   0.484   7.033
   57   HG23  ILE   8          HG23      ILE   8  -6.189   0.491   5.279
   58   HD11  ILE   8          HD11      ILE   8  -3.551   3.880   5.703
   59   HD12  ILE   8          HD12      ILE   8  -3.003   3.707   7.370
   60   HD13  ILE   8          HD13      ILE   8  -4.548   4.484   7.032
   61    H    THR   9           HN       THR   9  -8.175   4.117   4.874
   62    HA   THR   9           HA       THR   9  -9.740   2.119   3.668
   63    HB   THR   9           HB       THR   9 -10.210   5.108   3.842
   64    HG1  THR   9           HG1      THR   9 -11.392   4.519   5.668
   65   HG21  THR   9          HG21      THR   9 -11.993   2.799   3.068
   66   HG22  THR   9          HG22      THR   9 -11.707   4.302   2.192
   67   HG23  THR   9          HG23      THR   9 -12.647   4.316   3.684
   68    H    ARG  10           HN       ARG  10  -8.183   5.009   2.320
   69    HA   ARG  10           HA       ARG  10  -9.160   4.706  -0.321
   70    HB2  ARG  10           HB2      ARG  10  -8.162   6.803   0.507
   71    HB3  ARG  10           HB1      ARG  10  -6.590   6.010   0.613
   72    HG2  ARG  10           HG2      ARG  10  -6.553   5.630  -1.779
   73    HG3  ARG  10           HG1      ARG  10  -8.206   6.225  -1.942
   74    HD2  ARG  10           HD2      ARG  10  -6.665   7.991  -2.592
   75    HD3  ARG  10           HD1      ARG  10  -7.452   8.439  -1.083
   76    HE   ARG  10           HE       ARG  10  -4.984   7.096  -0.563
   77   HH11  ARG  10          HH11      ARG  10  -3.232   8.370   0.105
   78   HH12  ARG  10          HH12      ARG  10  -3.264  10.082  -0.139
   79   HH21  ARG  10          HH21      ARG  10  -6.375  10.073  -1.663
   80   HH22  ARG  10          HH22      ARG  10  -5.040  11.047  -1.142
   81    H    CYS  11           HN       CYS  11  -6.244   3.544   1.306
   82    HA   CYS  11           HA       CYS  11  -4.903   2.444  -0.880
   83    HB2  CYS  11           HB2      CYS  11  -4.085   2.691   1.522
   84    HB3  CYS  11           HB1      CYS  11  -4.957   1.199   1.864
   85    H    LYS  12           HN       LYS  12  -7.351   1.007   1.243
   86    HA   LYS  12           HA       LYS  12  -7.322  -1.578   0.129
   87    HB2  LYS  12           HB2      LYS  12  -8.417  -1.003   2.278
   88    HB3  LYS  12           HB1      LYS  12  -9.657  -0.117   1.390
   89    HG2  LYS  12           HG2      LYS  12 -10.313  -2.169   0.213
   90    HG3  LYS  12           HG1      LYS  12  -9.041  -3.067   1.042
   91    HD2  LYS  12           HD2      LYS  12 -10.099  -2.556   3.214
   92    HD3  LYS  12           HD1      LYS  12 -11.379  -1.674   2.381
   93    HE2  LYS  12           HE2      LYS  12 -12.019  -3.728   1.177
   94    HE3  LYS  12           HE1      LYS  12 -10.733  -4.613   1.999
   95    HZ1  LYS  12           HZ1      LYS  12 -11.964  -4.819   3.819
   96    HZ2  LYS  12           HZ2      LYS  12 -13.289  -4.303   2.888
   97    HZ3  LYS  12           HZ3      LYS  12 -12.412  -3.183   3.816
   98    H    LYS  13           HN       LYS  13  -9.196   1.315  -0.694
   99    HA   LYS  13           HA       LYS  13 -10.862   0.143  -2.637
  100    HB2  LYS  13           HB2      LYS  13 -11.223   2.402  -1.685
  101    HB3  LYS  13           HB1      LYS  13  -9.802   2.979  -2.557
  102    HG2  LYS  13           HG2      LYS  13 -10.839   2.435  -4.695
  103    HG3  LYS  13           HG1      LYS  13 -12.230   1.729  -3.874
  104    HD2  LYS  13           HD2      LYS  13 -12.736   3.929  -2.855
  105    HD3  LYS  13           HD1      LYS  13 -11.364   4.632  -3.712
  106    HE2  LYS  13           HE2      LYS  13 -13.671   3.240  -5.097
  107    HE3  LYS  13           HE1      LYS  13 -13.583   4.986  -4.860
  108    HZ1  LYS  13           HZ1      LYS  13 -12.626   4.782  -6.905
  109    HZ2  LYS  13           HZ2      LYS  13 -11.958   3.254  -6.580
  110    HZ3  LYS  13           HZ3      LYS  13 -11.242   4.652  -5.933
  111    H    LEU  14           HN       LEU  14  -7.642   1.607  -2.880
  112    HA   LEU  14           HA       LEU  14  -7.404   1.465  -5.691
  113    HB2  LEU  14           HB2      LEU  14  -5.358   1.464  -3.470
  114    HB3  LEU  14           HB1      LEU  14  -4.911   1.513  -5.173
  115    HG   LEU  14           HG       LEU  14  -6.810   3.497  -3.882
  116   HD11  LEU  14          HD11      LEU  14  -3.837   3.781  -4.423
  117   HD12  LEU  14          HD12      LEU  14  -4.590   3.666  -2.834
  118   HD13  LEU  14          HD13      LEU  14  -4.904   5.067  -3.854
  119   HD21  LEU  14          HD21      LEU  14  -7.188   3.701  -6.178
  120   HD22  LEU  14          HD22      LEU  14  -5.553   3.201  -6.604
  121   HD23  LEU  14          HD23      LEU  14  -5.845   4.823  -5.991
  122    H    LEU  15           HN       LEU  15  -6.552  -0.832  -3.133
  123    HA   LEU  15           HA       LEU  15  -5.339  -2.756  -4.822
  124    HB2  LEU  15           HB2      LEU  15  -6.663  -2.982  -2.117
  125    HB3  LEU  15           HB1      LEU  15  -5.810  -4.316  -2.892
  126    HG   LEU  15           HG       LEU  15  -4.563  -1.600  -2.364
  127   HD11  LEU  15          HD11      LEU  15  -4.235  -4.151  -0.758
  128   HD12  LEU  15          HD12      LEU  15  -5.222  -2.775  -0.262
  129   HD13  LEU  15          HD13      LEU  15  -3.477  -2.592  -0.431
  130   HD21  LEU  15          HD21      LEU  15  -3.210  -2.590  -4.003
  131   HD22  LEU  15          HD22      LEU  15  -3.552  -4.229  -3.445
  132   HD23  LEU  15          HD23      LEU  15  -2.449  -3.198  -2.537
  133    H    ASP  16           HN       ASP  16  -8.643  -2.274  -3.715
  134    HA   ASP  16           HA       ASP  16  -9.749  -4.652  -4.753
  135    HB2  ASP  16           HB2      ASP  16 -10.955  -1.955  -4.133
  136    HB3  ASP  16           HB1      ASP  16 -11.915  -3.320  -4.700
  137    H    ASP  17           HN       ASP  17  -9.092  -1.525  -6.178
  138    HA   ASP  17           HA       ASP  17 -10.568  -1.825  -8.563
  139    HB2  ASP  17           HB2      ASP  17  -8.109  -0.193  -7.911
  140    HB3  ASP  17           HB1      ASP  17  -8.938  -0.110  -9.462
  141    H    SER  18           HN       SER  18  -7.905  -3.531  -7.444
  142    HA   SER  18           HA       SER  18  -6.324  -3.908  -9.702
  143    HB2  SER  18           HB2      SER  18  -6.983  -5.858  -7.489
  144    HB3  SER  18           HB1      SER  18  -5.674  -6.064  -8.650
  145    HG   SER  18           HG       SER  18  -4.659  -5.019  -7.087
  146    H    SER  19           HN       SER  19  -9.352  -5.332  -8.795
  147    HA   SER  19           HA       SER  19  -9.329  -7.296 -10.914
  148    HB2  SER  19           HB2      SER  19 -10.549  -7.679  -8.772
  149    HB3  SER  19           HB1      SER  19 -11.664  -6.391  -9.219
  150    HG   SER  19           HG       SER  19 -12.668  -7.840 -10.349
  151    H    SER  20           HN       SER  20 -10.074  -4.033 -10.646
  152    HA   SER  20           HA       SER  20 -12.044  -3.903 -12.752
  153    HB2  SER  20           HB2      SER  20 -11.701  -2.215 -10.818
  154    HB3  SER  20           HB1      SER  20 -10.394  -1.566 -11.804
  155    HG   SER  20           HG       SER  20 -11.868  -0.623 -12.954
  156    H1   LYS   1           HN       LYS   1 -11.753  -3.256 -14.863
  157    HA   LYS   1           HA       LYS   1  -9.106  -3.737 -15.974
  158    HB2  LYS   1           HB2      LYS   1 -11.814  -3.218 -17.210
  159    HB3  LYS   1           HB1      LYS   1 -10.335  -3.401 -18.152
  160    HG2  LYS   1           HG2      LYS   1  -9.982  -5.635 -17.309
  161    HG3  LYS   1           HG1      LYS   1 -11.298  -5.458 -16.149
  162    HD2  LYS   1           HD2      LYS   1 -12.170  -6.748 -17.975
  163    HD3  LYS   1           HD1      LYS   1 -12.852  -5.131 -18.132
  164    HE2  LYS   1           HE2      LYS   1 -11.269  -4.554 -19.865
  165    HE3  LYS   1           HE1      LYS   1 -10.366  -6.047 -19.607
  166    HZ1  LYS   1           HZ1      LYS   1 -12.509  -5.622 -21.313
  167    HZ2  LYS   1           HZ2      LYS   1 -13.087  -6.627 -20.070
  168    HZ3  LYS   1           HZ3      LYS   1 -11.728  -7.091 -20.982
  169    H    ASN   2           HN       ASN   2 -10.231  -1.220 -14.470
  170    HA   ASN   2           HA       ASN   2 -10.043   0.891 -16.315
  171    HB2  ASN   2           HB2      ASN   2  -9.884   2.358 -14.353
  172    HB3  ASN   2           HB1      ASN   2 -11.161   1.166 -14.158
  173   HD21  ASN   2          HD21      ASN   2  -8.310  -0.525 -13.877
  174   HD22  ASN   2          HD22      ASN   2  -8.116  -0.457 -12.193
  175    HA   PRO   3           HA       PRO   3  -5.686   1.487 -16.985
  176    HB2  PRO   3           HB2      PRO   3  -6.065   4.370 -16.251
  177    HB3  PRO   3           HB1      PRO   3  -5.373   3.665 -17.725
  178    HG2  PRO   3           HG2      PRO   3  -7.798   4.734 -17.741
  179    HG3  PRO   3           HG1      PRO   3  -7.449   3.256 -18.660
  180    HD2  PRO   3           HD2      PRO   3  -8.912   3.556 -16.058
  181    HD3  PRO   3           HD1      PRO   3  -9.228   2.466 -17.424
  182    H    GLU   4           HN       GLU   4  -7.165   2.539 -14.022
  183    HA   GLU   4           HA       GLU   4  -4.892   3.317 -12.549
  184    HB2  GLU   4           HB2      GLU   4  -7.515   2.108 -11.658
  185    HB3  GLU   4           HB1      GLU   4  -6.300   2.743 -10.549
  186    HG2  GLU   4           HG2      GLU   4  -6.453   4.948 -11.594
  187    HG3  GLU   4           HG1      GLU   4  -7.602   4.331 -12.780
  188    H    ALA   5           HN       ALA   5  -5.866   0.271 -13.703
  189    HA   ALA   5           HA       ALA   5  -4.898  -1.481 -11.737
  190    HB1  ALA   5           HB1      ALA   5  -6.240  -2.120 -13.773
  191    HB2  ALA   5           HB2      ALA   5  -4.845  -3.155 -13.463
  192    HB3  ALA   5           HB3      ALA   5  -4.768  -1.927 -14.726
  193    H    GLU   6           HN       GLU   6  -3.241   0.500 -14.071
  194    HA   GLU   6           HA       GLU   6  -0.768  -0.845 -14.187
  195    HB2  GLU   6           HB2      GLU   6  -1.471   2.087 -14.444
  196    HB3  GLU   6           HB1      GLU   6   0.144   1.444 -14.752
  197    HG2  GLU   6           HG2      GLU   6  -0.743  -0.028 -16.494
  198    HG3  GLU   6           HG1      GLU   6  -2.383   0.519 -16.150
  199    H    GLU   7           HN       GLU   7  -2.073   1.498 -11.883
  200    HA   GLU   7           HA       GLU   7   0.314   1.954 -10.448
  201    HB2  GLU   7           HB2      GLU   7  -1.685   3.391 -10.224
  202    HB3  GLU   7           HB1      GLU   7  -2.542   2.063  -9.440
  203    HG2  GLU   7           HG2      GLU   7  -1.637   3.605  -7.754
  204    HG3  GLU   7           HG1      GLU   7  -0.837   2.043  -7.630
  205    H    ILE   8           HN       ILE   8  -2.210  -0.490 -10.151
  206    HA   ILE   8           HA       ILE   8  -1.367  -1.633  -7.713
  207    HB   ILE   8           HB       ILE   8  -2.941  -2.662 -10.073
  208   HG12  ILE   8          HG12      ILE   8  -4.783  -2.612  -8.497
  209   HG13  ILE   8          HG11      ILE   8  -3.687  -2.292  -7.155
  210   HG21  ILE   8          HG21      ILE   8  -1.927  -4.683  -9.397
  211   HG22  ILE   8          HG22      ILE   8  -3.430  -4.664  -8.481
  212   HG23  ILE   8          HG23      ILE   8  -1.917  -4.217  -7.696
  213   HD11  ILE   8          HD11      ILE   8  -3.187  -0.099  -7.956
  214   HD12  ILE   8          HD12      ILE   8  -4.937  -0.268  -8.085
  215   HD13  ILE   8          HD13      ILE   8  -3.934  -0.429  -9.525
  216    H    THR   9           HN       THR   9  -0.463  -2.303 -11.080
  217    HA   THR   9           HA       THR   9   1.149  -4.549 -10.578
  218    HB   THR   9           HB       THR   9   1.408  -2.423 -12.724
  219    HG1  THR   9           HG1      THR   9   0.213  -3.909 -13.927
  220   HG21  THR   9          HG21      THR   9   2.688  -5.133 -12.357
  221   HG22  THR   9          HG22      THR   9   3.467  -3.590 -12.715
  222   HG23  THR   9          HG23      THR   9   2.505  -4.402 -13.951
  223    H    ARG  10           HN       ARG  10   1.908  -1.084 -10.634
  224    HA   ARG  10           HA       ARG  10   4.685  -1.349 -10.144
  225    HB2  ARG  10           HB2      ARG  10   3.660   0.736 -10.977
  226    HB3  ARG  10           HB1      ARG  10   2.847   0.948  -9.425
  227    HG2  ARG  10           HG2      ARG  10   4.971   1.125  -8.270
  228    HG3  ARG  10           HG1      ARG  10   5.854   0.730  -9.746
  229    HD2  ARG  10           HD2      ARG  10   5.911   3.138  -9.416
  230    HD3  ARG  10           HD1      ARG  10   4.906   2.771 -10.814
  231    HE   ARG  10           HE       ARG  10   3.301   2.936  -8.460
  232   HH11  ARG  10          HH11      ARG  10   2.050   4.805  -8.182
  233   HH12  ARG  10          HH12      ARG  10   2.413   6.232  -9.088
  234   HH21  ARG  10          HH21      ARG  10   5.108   4.816 -10.742
  235   HH22  ARG  10          HH22      ARG  10   4.144   6.241 -10.536
  236    H    CYS  11           HN       CYS  11   1.892  -0.989  -8.007
  237    HA   CYS  11           HA       CYS  11   3.215  -0.700  -5.568
  238    HB2  CYS  11           HB2      CYS  11   0.727  -0.501  -6.026
  239    HB3  CYS  11           HB1      CYS  11   0.665  -2.261  -5.953
  240    H    LYS  12           HN       LYS  12   2.242  -3.643  -7.288
  241    HA   LYS  12           HA       LYS  12   3.052  -5.493  -5.326
  242    HB2  LYS  12           HB2      LYS  12   1.621  -6.065  -7.267
  243    HB3  LYS  12           HB1      LYS  12   3.012  -5.858  -8.331
  244    HG2  LYS  12           HG2      LYS  12   4.213  -7.644  -7.151
  245    HG3  LYS  12           HG1      LYS  12   2.862  -7.831  -6.033
  246    HD2  LYS  12           HD2      LYS  12   1.388  -8.444  -7.912
  247    HD3  LYS  12           HD1      LYS  12   2.740  -8.265  -9.031
  248    HE2  LYS  12           HE2      LYS  12   3.969 -10.037  -7.845
  249    HE3  LYS  12           HE1      LYS  12   2.634 -10.210  -6.705
  250    HZ1  LYS  12           HZ1      LYS  12   1.483 -11.420  -8.152
  251    HZ2  LYS  12           HZ2      LYS  12   2.916 -11.554  -9.055
  252    HZ3  LYS  12           HZ3      LYS  12   1.781 -10.348  -9.433
  253    H    LYS  13           HN       LYS  13   4.794  -4.035  -8.048
  254    HA   LYS  13           HA       LYS  13   7.174  -5.520  -7.809
  255    HB2  LYS  13           HB2      LYS  13   6.627  -4.088  -9.758
  256    HB3  LYS  13           HB1      LYS  13   6.846  -2.658  -8.749
  257    HG2  LYS  13           HG2      LYS  13   9.180  -3.241  -8.352
  258    HG3  LYS  13           HG1      LYS  13   8.984  -4.751  -9.243
  259    HD2  LYS  13           HD2      LYS  13   8.434  -3.464 -11.286
  260    HD3  LYS  13           HD1      LYS  13   8.668  -1.961 -10.392
  261    HE2  LYS  13           HE2      LYS  13  10.806  -4.087 -10.694
  262    HE3  LYS  13           HE1      LYS  13  10.676  -2.674 -11.742
  263    HZ1  LYS  13           HZ1      LYS  13  12.093  -1.894 -10.154
  264    HZ2  LYS  13           HZ2      LYS  13  11.418  -2.835  -8.910
  265    HZ3  LYS  13           HZ3      LYS  13  10.617  -1.439  -9.455
  266    H    LEU  14           HN       LEU  14   6.122  -2.506  -6.268
  267    HA   LEU  14           HA       LEU  14   8.545  -1.931  -4.936
  268    HB2  LEU  14           HB2      LEU  14   5.670  -1.239  -4.329
  269    HB3  LEU  14           HB1      LEU  14   7.016  -0.620  -3.377
  270    HG   LEU  14           HG       LEU  14   6.817  -0.307  -6.389
  271   HD11  LEU  14          HD11      LEU  14   6.061   1.681  -4.223
  272   HD12  LEU  14          HD12      LEU  14   4.930   0.842  -5.280
  273   HD13  LEU  14          HD13      LEU  14   6.071   1.998  -5.958
  274   HD21  LEU  14          HD21      LEU  14   9.059   0.100  -5.871
  275   HD22  LEU  14          HD22      LEU  14   8.691   0.688  -4.249
  276   HD23  LEU  14          HD23      LEU  14   8.392   1.712  -5.647
  277    H    LEU  15           HN       LEU  15   5.716  -3.828  -3.973
  278    HA   LEU  15           HA       LEU  15   6.586  -4.379  -1.334
  279    HB2  LEU  15           HB2      LEU  15   4.692  -5.822  -3.189
  280    HB3  LEU  15           HB1      LEU  15   4.943  -6.293  -1.510
  281    HG   LEU  15           HG       LEU  15   4.127  -3.499  -2.367
  282   HD11  LEU  15          HD11      LEU  15   2.346  -5.693  -1.271
  283   HD12  LEU  15          HD12      LEU  15   2.430  -5.240  -2.974
  284   HD13  LEU  15          HD13      LEU  15   1.852  -4.077  -1.781
  285   HD21  LEU  15          HD21      LEU  15   4.956  -3.247  -0.191
  286   HD22  LEU  15          HD22      LEU  15   4.508  -4.885   0.285
  287   HD23  LEU  15          HD23      LEU  15   3.274  -3.635   0.153
  288    H    ASP  16           HN       ASP  16   7.038  -6.036  -4.405
  289    HA   ASP  16           HA       ASP  16   8.273  -8.367  -3.408
  290    HB2  ASP  16           HB2      ASP  16   8.439  -6.971  -6.080
  291    HB3  ASP  16           HB1      ASP  16   9.245  -8.503  -5.749
  292    H    ASP  17           HN       ASP  17   9.496  -5.191  -4.206
  293    HA   ASP  17           HA       ASP  17  12.257  -5.772  -4.172
  294    HB2  ASP  17           HB2      ASP  17  10.732  -3.221  -3.616
  295    HB3  ASP  17           HB1      ASP  17  12.490  -3.303  -3.659
  296    H    SER  18           HN       SER  18   9.991  -5.908  -1.702
  297    HA   SER  18           HA       SER  18  11.323  -4.898   0.524
  298    HB2  SER  18           HB2      SER  18   9.499  -7.303   0.349
  299    HB3  SER  18           HB1      SER  18   9.944  -6.478   1.839
  300    HG   SER  18           HG       SER  18   8.159  -5.425   1.326
  301    H    SER  19           HN       SER  19  11.704  -7.892  -1.176
  302    HA   SER  19           HA       SER  19  13.466  -9.059   0.792
  303    HB2  SER  19           HB2      SER  19  12.021 -10.452  -0.695
  304    HB3  SER  19           HB1      SER  19  13.009  -9.939  -2.062
  305    HG   SER  19           HG       SER  19  14.276 -11.513  -1.494
  306    H    SER  20           HN       SER  20  13.777  -6.867  -1.733
  307    HA   SER  20           HA       SER  20  16.535  -7.431  -2.396
  308    HB2  SER  20           HB2      SER  20  14.757  -6.277  -3.891
  309    HB3  SER  20           HB1      SER  20  15.145  -4.823  -2.976
  310    HG   SER  20           HG       SER  20  16.878  -4.675  -4.142
  311    H1   LYS   1           HN       LYS   1  18.345  -6.229  -1.811
  312    HA   LYS   1           HA       LYS   1  18.170  -4.955   0.806
  313    HB2  LYS   1           HB2      LYS   1  20.487  -5.715  -0.978
  314    HB3  LYS   1           HB1      LYS   1  20.673  -4.866   0.556
  315    HG2  LYS   1           HG2      LYS   1  19.658  -6.687   1.773
  316    HG3  LYS   1           HG1      LYS   1  19.210  -7.504   0.277
  317    HD2  LYS   1           HD2      LYS   1  21.175  -8.610   1.106
  318    HD3  LYS   1           HD1      LYS   1  21.685  -7.631  -0.267
  319    HE2  LYS   1           HE2      LYS   1  22.561  -5.915   1.196
  320    HE3  LYS   1           HE1      LYS   1  21.875  -6.703   2.614
  321    HZ1  LYS   1           HZ1      LYS   1  24.364  -7.115   1.465
  322    HZ2  LYS   1           HZ2      LYS   1  23.466  -8.528   1.174
  323    HZ3  LYS   1           HZ3      LYS   1  23.671  -7.960   2.762
  324    H    ASN   2           HN       ASN   2  17.416  -3.856  -2.038
  325    HA   ASN   2           HA       ASN   2  19.090  -1.634  -2.440
  326    HB2  ASN   2           HB2      ASN   2  17.326  -0.794  -3.924
  327    HB3  ASN   2           HB1      ASN   2  17.647  -2.496  -4.216
  328   HD21  ASN   2          HD21      ASN   2  16.078  -2.387  -1.287
  329   HD22  ASN   2          HD22      ASN   2  14.482  -2.590  -1.824
  330    HA   PRO   3           HA       PRO   3  17.826   1.354   0.605
  331    HB2  PRO   3           HB2      PRO   3  17.461   3.331  -1.621
  332    HB3  PRO   3           HB1      PRO   3  18.456   3.453  -0.156
  333    HG2  PRO   3           HG2      PRO   3  19.567   3.016  -2.525
  334    HG3  PRO   3           HG1      PRO   3  20.178   2.208  -1.066
  335    HD2  PRO   3           HD2      PRO   3  18.484   1.086  -3.275
  336    HD3  PRO   3           HD1      PRO   3  19.802   0.331  -2.354
  337    H    GLU   4           HN       GLU   4  15.846   0.759  -2.190
  338    HA   GLU   4           HA       GLU   4  13.574   2.297  -1.558
  339    HB2  GLU   4           HB2      GLU   4  13.852  -0.302  -3.077
  340    HB3  GLU   4           HB1      GLU   4  12.355   0.625  -2.987
  341    HG2  GLU   4           HG2      GLU   4  13.456   2.563  -3.992
  342    HG3  GLU   4           HG1      GLU   4  14.995   1.703  -4.018
  343    H    ALA   5           HN       ALA   5  14.897  -0.449  -0.051
  344    HA   ALA   5           HA       ALA   5  12.631  -1.778   0.931
  345    HB1  ALA   5           HB1      ALA   5  15.019  -2.569   1.100
  346    HB2  ALA   5           HB2      ALA   5  14.088  -2.728   2.591
  347    HB3  ALA   5           HB3      ALA   5  15.244  -1.408   2.410
  348    H    GLU   6           HN       GLU   6  14.102   1.244   1.841
  349    HA   GLU   6           HA       GLU   6  13.076   1.524   4.447
  350    HB2  GLU   6           HB2      GLU   6  13.744   3.575   2.326
  351    HB3  GLU   6           HB1      GLU   6  13.293   3.998   3.977
  352    HG2  GLU   6           HG2      GLU   6  15.175   2.707   4.855
  353    HG3  GLU   6           HG1      GLU   6  15.603   2.187   3.226
  354    H    GLU   7           HN       GLU   7  11.671   2.213   1.277
  355    HA   GLU   7           HA       GLU   7   9.367   3.562   2.189
  356    HB2  GLU   7           HB2      GLU   7  10.097   3.594  -0.172
  357    HB3  GLU   7           HB1      GLU   7   9.702   1.881  -0.310
  358    HG2  GLU   7           HG2      GLU   7   7.863   3.248  -1.194
  359    HG3  GLU   7           HG1      GLU   7   7.333   2.394   0.251
  360    H    ILE   8           HN       ILE   8  10.080   0.149   1.689
  361    HA   ILE   8           HA       ILE   8   7.469  -0.857   2.036
  362    HB   ILE   8           HB       ILE   8  10.225  -2.026   2.407
  363   HG12  ILE   8          HG12      ILE   8   9.633  -3.309   0.448
  364   HG13  ILE   8          HG11      ILE   8   7.958  -2.777   0.534
  365   HG21  ILE   8          HG21      ILE   8   9.066  -3.268   4.048
  366   HG22  ILE   8          HG22      ILE   8   8.912  -4.267   2.604
  367   HG23  ILE   8          HG23      ILE   8   7.562  -3.257   3.125
  368   HD11  ILE   8          HD11      ILE   8   8.544  -0.544  -0.076
  369   HD12  ILE   8          HD12      ILE   8   9.435  -1.592  -1.180
  370   HD13  ILE   8          HD13      ILE   8  10.265  -0.853   0.187
  371    H    THR   9           HN       THR   9  10.068  -0.173   4.354
  372    HA   THR   9           HA       THR   9   8.807  -1.233   6.630
  373    HB   THR   9           HB       THR   9  10.724   1.105   6.396
  374    HG1  THR   9           HG1      THR   9  12.259  -0.475   6.828
  375   HG21  THR   9          HG21      THR   9   9.707  -0.487   8.749
  376   HG22  THR   9          HG22      THR   9   9.767   1.265   8.553
  377   HG23  THR   9          HG23      THR   9  11.256   0.353   8.799
  378    H    ARG  10           HN       ARG  10   8.691   2.006   5.180
  379    HA   ARG  10           HA       ARG  10   7.030   3.184   7.148
  380    HB2  ARG  10           HB2      ARG  10   8.318   4.508   5.512
  381    HB3  ARG  10           HB1      ARG  10   7.290   3.894   4.216
  382    HG2  ARG  10           HG2      ARG  10   5.332   4.931   5.196
  383    HG3  ARG  10           HG1      ARG  10   6.251   5.414   6.622
  384    HD2  ARG  10           HD2      ARG  10   6.043   7.328   5.136
  385    HD3  ARG  10           HD1      ARG  10   7.721   6.797   5.162
  386    HE   ARG  10           HE       ARG  10   6.315   5.544   3.015
  387   HH11  ARG  10          HH11      ARG  10   6.707   6.322   0.922
  388   HH12  ARG  10          HH12      ARG  10   7.442   7.871   0.698
  389   HH21  ARG  10          HH21      ARG  10   7.683   8.541   4.090
  390   HH22  ARG  10          HH22      ARG  10   7.992   9.129   2.489
  391    H    CYS  11           HN       CYS  11   6.343   1.492   4.123
  392    HA   CYS  11           HA       CYS  11   3.585   1.897   3.983
  393    HB2  CYS  11           HB2      CYS  11   5.128   0.794   2.272
  394    HB3  CYS  11           HB1      CYS  11   4.940  -0.681   3.215
  395    H    LYS  12           HN       LYS  12   5.426  -0.637   5.644
  396    HA   LYS  12           HA       LYS  12   3.228  -2.132   6.572
  397    HB2  LYS  12           HB2      LYS  12   5.567  -2.946   6.604
  398    HB3  LYS  12           HB1      LYS  12   5.939  -1.785   7.879
  399    HG2  LYS  12           HG2      LYS  12   4.284  -2.836   9.354
  400    HG3  LYS  12           HG1      LYS  12   3.842  -3.968   8.076
  401    HD2  LYS  12           HD2      LYS  12   6.147  -4.852   8.066
  402    HD3  LYS  12           HD1      LYS  12   6.580  -3.731   9.357
  403    HE2  LYS  12           HE2      LYS  12   4.899  -4.764  10.831
  404    HE3  LYS  12           HE1      LYS  12   4.445  -5.877   9.541
  405    HZ1  LYS  12           HZ1      LYS  12   6.193  -7.163   9.957
  406    HZ2  LYS  12           HZ2      LYS  12   6.375  -6.300  11.411
  407    HZ3  LYS  12           HZ3      LYS  12   7.263  -5.848  10.035
  408    H    LYS  13           HN       LYS  13   4.984   0.599   7.997
  409    HA   LYS  13           HA       LYS  13   3.669   0.630  10.484
  410    HB2  LYS  13           HB2      LYS  13   5.719   1.929   9.986
  411    HB3  LYS  13           HB1      LYS  13   4.776   2.983   8.933
  412    HG2  LYS  13           HG2      LYS  13   3.380   3.680  10.805
  413    HG3  LYS  13           HG1      LYS  13   4.207   2.550  11.879
  414    HD2  LYS  13           HD2      LYS  13   6.336   3.756  11.494
  415    HD3  LYS  13           HD1      LYS  13   5.488   4.901  10.454
  416    HE2  LYS  13           HE2      LYS  13   4.755   4.396  13.350
  417    HE3  LYS  13           HE1      LYS  13   5.801   5.712  12.819
  418    HZ1  LYS  13           HZ1      LYS  13   3.794   6.752  12.788
  419    HZ2  LYS  13           HZ2      LYS  13   2.925   5.339  12.422
  420    HZ3  LYS  13           HZ3      LYS  13   3.798   6.143  11.206
  421    H    LEU  14           HN       LEU  14   2.872   2.169   7.392
  422    HA   LEU  14           HA       LEU  14   0.649   3.656   8.301
  423    HB2  LEU  14           HB2      LEU  14   1.373   2.520   5.598
  424    HB3  LEU  14           HB1      LEU  14  -0.031   3.553   5.851
  425    HG   LEU  14           HG       LEU  14   2.790   4.336   6.648
  426   HD11  LEU  14          HD11      LEU  14   1.250   5.062   4.136
  427   HD12  LEU  14          HD12      LEU  14   2.667   4.019   4.211
  428   HD13  LEU  14          HD13      LEU  14   2.813   5.728   4.610
  429   HD21  LEU  14          HD21      LEU  14   1.405   5.783   7.845
  430   HD22  LEU  14          HD22      LEU  14   0.108   5.708   6.653
  431   HD23  LEU  14          HD23      LEU  14   1.542   6.679   6.337
  432    H    LEU  15           HN       LEU  15   0.922   0.373   7.004
  433    HA   LEU  15           HA       LEU  15  -1.856  -0.186   6.956
  434    HB2  LEU  15           HB2      LEU  15   0.569  -1.978   7.136
  435    HB3  LEU  15           HB1      LEU  15  -1.073  -2.589   6.946
  436    HG   LEU  15           HG       LEU  15   0.200  -0.574   5.068
  437   HD11  LEU  15          HD11      LEU  15  -0.126  -3.559   4.656
  438   HD12  LEU  15          HD12      LEU  15   1.394  -2.766   5.075
  439   HD13  LEU  15          HD13      LEU  15   0.610  -2.409   3.536
  440   HD21  LEU  15          HD21      LEU  15  -2.102  -0.382   4.688
  441   HD22  LEU  15          HD22      LEU  15  -2.423  -2.059   5.126
  442   HD23  LEU  15          HD23      LEU  15  -1.700  -1.676   3.566
  443    H    ASP  16           HN       ASP  16   0.636  -0.610   9.407
  444    HA   ASP  16           HA       ASP  16  -0.908  -2.047  11.279
  445    HB2  ASP  16           HB2      ASP  16   1.498  -0.251  11.586
  446    HB3  ASP  16           HB1      ASP  16   0.772  -1.110  12.943
  447    H    ASP  17           HN       ASP  17  -0.568   1.370  10.612
  448    HA   ASP  17           HA       ASP  17  -1.832   2.381  12.924
  449    HB2  ASP  17           HB2      ASP  17  -1.528   3.507  10.135
  450    HB3  ASP  17           HB1      ASP  17  -2.279   4.401  11.455
  451    H    SER  18           HN       SER  18  -3.069   0.503  10.441
  452    HA   SER  18           HA       SER  18  -5.599   1.562   9.966
  453    HB2  SER  18           HB2      SER  18  -4.722  -1.326  10.093
  454    HB3  SER  18           HB1      SER  18  -6.258  -0.780   9.425
  455    HG   SER  18           HG       SER  18  -5.015  -0.747   7.682
  456    H    SER  19           HN       SER  19  -4.384  -0.300  12.624
  457    HA   SER  19           HA       SER  19  -6.977  -0.716  13.827
  458    HB2  SER  19           HB2      SER  19  -5.083  -2.312  14.158
  459    HB3  SER  19           HB1      SER  19  -4.255  -1.067  15.091
  460    HG   SER  19           HG       SER  19  -5.410  -1.734  16.707
  461    H    SER  20           HN       SER  20  -4.719   1.769  13.738
  462    HA   SER  20           HA       SER  20  -5.338   2.948  16.303
  463    HB2  SER  20           HB2      SER  20  -3.168   3.243  14.913
  464    HB3  SER  20           HB1      SER  20  -4.087   4.441  14.006
  465    HG   SER  20           HG       SER  20  -3.809   5.749  15.618
  466    H2   ZBR 100           HA3      TBS 100  -1.499   1.287  -2.123
  467    H4   ZBR 100           HC3      TBS 100   0.643   1.819   1.599
  468    H6   ZBR 100           HB3      TBS 100   2.723   0.370  -1.914
  469    H7   ZBR 100          HB11      TBS 100   1.257   1.029  -4.185
  470    H7A  ZBR 100          HB12      TBS 100  -0.413   0.481  -4.024
  471    H8   ZBR 100          HA11      TBS 100  -2.200   2.958  -0.058
  472    H8A  ZBR 100          HA12      TBS 100  -1.625   2.360   1.501
  473    H9   ZBR 100          HC11      TBS 100   3.382   1.994   1.054
  474    H9A  ZBR 100          HC12      TBS 100   3.899   0.608   0.088
  Start of MODEL   17
    1    H1   LYS   1           HN       LYS   1  -6.357   6.455  16.385
    2    HA   LYS   1           HA       LYS   1  -8.452   6.772  14.393
    3    HB2  LYS   1           HB2      LYS   1  -7.798   8.305  16.919
    4    HB3  LYS   1           HB1      LYS   1  -9.182   8.648  15.881
    5    HG2  LYS   1           HG2      LYS   1 -10.009   6.346  16.217
    6    HG3  LYS   1           HG1      LYS   1  -8.627   6.005  17.259
    7    HD2  LYS   1           HD2      LYS   1  -9.349   7.784  18.808
    8    HD3  LYS   1           HD1      LYS   1 -10.733   8.127  17.769
    9    HE2  LYS   1           HE2      LYS   1 -11.566   5.832  18.108
   10    HE3  LYS   1           HE1      LYS   1 -10.179   5.476  19.138
   11    HZ1  LYS   1           HZ1      LYS   1 -11.686   7.846  19.852
   12    HZ2  LYS   1           HZ2      LYS   1 -11.036   6.627  20.842
   13    HZ3  LYS   1           HZ3      LYS   1 -12.518   6.381  20.049
   14    H    ASN   2           HN       ASN   2  -5.374   7.428  14.203
   15    HA   ASN   2           HA       ASN   2  -5.222  10.180  13.719
   16    HB2  ASN   2           HB2      ASN   2  -3.098   9.704  12.593
   17    HB3  ASN   2           HB1      ASN   2  -3.227   8.789  14.096
   18   HD21  ASN   2          HD21      ASN   2  -5.383   7.287  12.125
   19   HD22  ASN   2          HD22      ASN   2  -4.374   6.113  11.431
   20    HA   PRO   3           HA       PRO   3  -7.119  10.806   9.756
   21    HB2  PRO   3           HB2      PRO   3  -4.629  12.247   8.912
   22    HB3  PRO   3           HB1      PRO   3  -6.312  12.814   8.920
   23    HG2  PRO   3           HG2      PRO   3  -4.581  13.666  10.742
   24    HG3  PRO   3           HG1      PRO   3  -6.270  13.331  11.167
   25    HD2  PRO   3           HD2      PRO   3  -3.818  11.697  11.717
   26    HD3  PRO   3           HD1      PRO   3  -5.255  11.978  12.724
   27    H    GLU   4           HN       GLU   4  -3.861   9.543   9.910
   28    HA   GLU   4           HA       GLU   4  -3.488   8.831   7.211
   29    HB2  GLU   4           HB2      GLU   4  -2.419   7.590   9.754
   30    HB3  GLU   4           HB1      GLU   4  -1.866   7.152   8.138
   31    HG2  GLU   4           HG2      GLU   4  -1.188   9.478   7.723
   32    HG3  GLU   4           HG1      GLU   4  -1.773   9.943   9.319
   33    H    ALA   5           HN       ALA   5  -5.520   7.518   9.652
   34    HA   ALA   5           HA       ALA   5  -5.725   4.836   8.870
   35    HB1  ALA   5           HB1      ALA   5  -7.773   4.783  10.090
   36    HB2  ALA   5           HB2      ALA   5  -8.032   6.513   9.868
   37    HB3  ALA   5           HB3      ALA   5  -6.741   5.943  10.926
   38    H    GLU   6           HN       GLU   6  -7.144   7.751   7.525
   39    HA   GLU   6           HA       GLU   6  -9.107   6.564   5.888
   40    HB2  GLU   6           HB2      GLU   6  -7.525   9.123   5.593
   41    HB3  GLU   6           HB1      GLU   6  -8.843   8.668   4.512
   42    HG2  GLU   6           HG2      GLU   6 -10.398   8.572   6.395
   43    HG3  GLU   6           HG1      GLU   6  -9.090   8.926   7.523
   44    H    GLU   7           HN       GLU   7  -5.652   7.111   5.438
   45    HA   GLU   7           HA       GLU   7  -5.519   6.505   2.689
   46    HB2  GLU   7           HB2      GLU   7  -3.656   7.556   3.932
   47    HB3  GLU   7           HB1      GLU   7  -3.420   6.059   4.831
   48    HG2  GLU   7           HG2      GLU   7  -1.824   6.199   2.966
   49    HG3  GLU   7           HG1      GLU   7  -2.945   4.865   2.705
   50    H    ILE   8           HN       ILE   8  -5.350   4.481   5.582
   51    HA   ILE   8           HA       ILE   8  -4.675   2.056   4.284
   52    HB   ILE   8           HB       ILE   8  -6.063   2.711   6.880
   53   HG12  ILE   8          HG12      ILE   8  -4.013   1.674   7.810
   54   HG13  ILE   8          HG11      ILE   8  -3.443   1.344   6.175
   55   HG21  ILE   8          HG21      ILE   8  -7.154   0.679   6.370
   56   HG22  ILE   8          HG22      ILE   8  -5.768   0.167   7.333
   57   HG23  ILE   8          HG23      ILE   8  -5.732   0.008   5.575
   58   HD11  ILE   8          HD11      ILE   8  -3.209   3.659   5.683
   59   HD12  ILE   8          HD12      ILE   8  -2.543   3.465   7.307
   60   HD13  ILE   8          HD13      ILE   8  -4.163   4.121   7.090
   61    H    THR   9           HN       THR   9  -7.813   3.530   5.022
   62    HA   THR   9           HA       THR   9  -9.435   1.416   4.119
   63    HB   THR   9           HB       THR   9  -9.978   4.394   4.134
   64    HG1  THR   9           HG1      THR   9 -11.032   2.559   5.952
   65   HG21  THR   9          HG21      THR   9 -11.587   3.409   2.688
   66   HG22  THR   9          HG22      THR   9 -12.389   3.537   4.254
   67   HG23  THR   9          HG23      THR   9 -11.750   1.984   3.714
   68    H    ARG  10           HN       ARG  10  -8.063   4.207   2.441
   69    HA   ARG  10           HA       ARG  10  -9.297   3.814  -0.058
   70    HB2  ARG  10           HB2      ARG  10  -8.101   5.888   0.560
   71    HB3  ARG  10           HB1      ARG  10  -6.572   5.009   0.510
   72    HG2  ARG  10           HG2      ARG  10  -6.841   4.538  -1.843
   73    HG3  ARG  10           HG1      ARG  10  -8.474   5.204  -1.842
   74    HD2  ARG  10           HD2      ARG  10  -6.966   6.870  -2.755
   75    HD3  ARG  10           HD1      ARG  10  -7.515   7.414  -1.173
   76    HE   ARG  10           HE       ARG  10  -5.089   5.981  -0.861
   77   HH11  ARG  10          HH11      ARG  10  -3.180   7.162  -0.567
   78   HH12  ARG  10          HH12      ARG  10  -3.111   8.828  -1.026
   79   HH21  ARG  10          HH21      ARG  10  -6.380   8.920  -2.170
   80   HH22  ARG  10          HH22      ARG  10  -4.920   9.822  -1.936
   81    H    CYS  11           HN       CYS  11  -6.431   2.410   1.400
   82    HA   CYS  11           HA       CYS  11  -5.205   1.249  -0.791
   83    HB2  CYS  11           HB2      CYS  11  -4.507   1.209   1.686
   84    HB3  CYS  11           HB1      CYS  11  -5.559  -0.199   1.832
   85    H    LYS  12           HN       LYS  12  -7.974   0.075   1.101
   86    HA   LYS  12           HA       LYS  12  -8.219  -2.448  -0.134
   87    HB2  LYS  12           HB2      LYS  12 -10.277  -0.629   1.137
   88    HB3  LYS  12           HB1      LYS  12 -10.629  -2.276   0.612
   89    HG2  LYS  12           HG2      LYS  12  -8.849  -3.129   2.099
   90    HG3  LYS  12           HG1      LYS  12  -8.506  -1.482   2.629
   91    HD2  LYS  12           HD2      LYS  12 -10.802  -1.274   3.500
   92    HD3  LYS  12           HD1      LYS  12 -11.158  -2.917   2.964
   93    HE2  LYS  12           HE2      LYS  12  -9.388  -3.788   4.447
   94    HE3  LYS  12           HE1      LYS  12  -9.030  -2.147   4.984
   95    HZ1  LYS  12           HZ1      LYS  12 -11.796  -2.656   5.213
   96    HZ2  LYS  12           HZ2      LYS  12 -10.682  -2.252   6.431
   97    HZ3  LYS  12           HZ3      LYS  12 -10.932  -3.879   6.010
   98    H    LYS  13           HN       LYS  13  -9.463   0.728  -1.033
   99    HA   LYS  13           HA       LYS  13 -11.173  -0.092  -3.115
  100    HB2  LYS  13           HB2      LYS  13 -11.147   2.194  -2.129
  101    HB3  LYS  13           HB1      LYS  13  -9.600   2.489  -2.925
  102    HG2  LYS  13           HG2      LYS  13 -10.629   2.111  -5.119
  103    HG3  LYS  13           HG1      LYS  13 -12.176   1.751  -4.350
  104    HD2  LYS  13           HD2      LYS  13 -12.220   4.031  -3.389
  105    HD3  LYS  13           HD1      LYS  13 -10.688   4.390  -4.186
  106    HE2  LYS  13           HE2      LYS  13 -11.724   3.986  -6.384
  107    HE3  LYS  13           HE1      LYS  13 -13.256   3.609  -5.596
  108    HZ1  LYS  13           HZ1      LYS  13 -13.666   5.761  -5.156
  109    HZ2  LYS  13           HZ2      LYS  13 -12.605   6.039  -6.454
  110    HZ3  LYS  13           HZ3      LYS  13 -12.040   6.137  -4.854
  111    H    LEU  14           HN       LEU  14  -7.707   0.631  -3.044
  112    HA   LEU  14           HA       LEU  14  -7.253   0.580  -5.828
  113    HB2  LEU  14           HB2      LEU  14  -5.460  -0.076  -3.485
  114    HB3  LEU  14           HB1      LEU  14  -4.880   0.016  -5.149
  115    HG   LEU  14           HG       LEU  14  -6.330   2.269  -3.726
  116   HD11  LEU  14          HD11      LEU  14  -4.038   1.627  -2.779
  117   HD12  LEU  14          HD12      LEU  14  -4.219   3.296  -3.317
  118   HD13  LEU  14          HD13      LEU  14  -3.372   2.131  -4.332
  119   HD21  LEU  14          HD21      LEU  14  -6.595   2.754  -5.989
  120   HD22  LEU  14          HD22      LEU  14  -5.119   1.912  -6.458
  121   HD23  LEU  14          HD23      LEU  14  -5.027   3.505  -5.703
  122    H    LEU  15           HN       LEU  15  -7.149  -2.001  -3.398
  123    HA   LEU  15           HA       LEU  15  -6.295  -4.045  -5.167
  124    HB2  LEU  15           HB2      LEU  15  -7.703  -3.995  -2.517
  125    HB3  LEU  15           HB1      LEU  15  -7.526  -5.525  -3.377
  126    HG   LEU  15           HG       LEU  15  -5.665  -5.016  -1.738
  127   HD11  LEU  15          HD11      LEU  15  -5.509  -6.319  -4.107
  128   HD12  LEU  15          HD12      LEU  15  -4.125  -6.112  -3.036
  129   HD13  LEU  15          HD13      LEU  15  -4.336  -5.034  -4.413
  130   HD21  LEU  15          HD21      LEU  15  -4.119  -3.258  -2.152
  131   HD22  LEU  15          HD22      LEU  15  -5.704  -2.534  -2.381
  132   HD23  LEU  15          HD23      LEU  15  -4.745  -2.986  -3.780
  133    H    ASP  16           HN       ASP  16  -9.511  -2.925  -4.219
  134    HA   ASP  16           HA       ASP  16 -10.953  -4.884  -5.676
  135    HB2  ASP  16           HB2      ASP  16 -11.676  -2.127  -4.684
  136    HB3  ASP  16           HB1      ASP  16 -12.825  -3.171  -5.520
  137    H    ASP  17           HN       ASP  17  -9.742  -1.671  -6.482
  138    HA   ASP  17           HA       ASP  17 -10.971  -1.501  -9.039
  139    HB2  ASP  17           HB2      ASP  17  -8.609  -0.069  -7.817
  140    HB3  ASP  17           HB1      ASP  17  -9.220   0.288  -9.431
  141    H    SER  18           HN       SER  18  -8.436  -3.391  -7.873
  142    HA   SER  18           HA       SER  18  -6.652  -3.461 -10.019
  143    HB2  SER  18           HB2      SER  18  -5.927  -5.598  -9.163
  144    HB3  SER  18           HB1      SER  18  -6.344  -4.582  -7.784
  145    HG   SER  18           HG       SER  18  -7.282  -6.652  -7.611
  146    H    SER  19           HN       SER  19  -9.816  -4.776  -9.676
  147    HA   SER  19           HA       SER  19  -9.568  -6.511 -12.012
  148    HB2  SER  19           HB2      SER  19 -11.843  -7.159 -11.577
  149    HB3  SER  19           HB1      SER  19 -10.991  -7.117 -10.035
  150    HG   SER  19           HG       SER  19 -11.820  -4.920  -9.848
  151    H    SER  20           HN       SER  20 -10.263  -3.291 -11.391
  152    HA   SER  20           HA       SER  20 -12.021  -2.843 -13.653
  153    HB2  SER  20           HB2      SER  20 -12.228  -1.406 -11.689
  154    HB3  SER  20           HB1      SER  20 -10.557  -0.882 -11.870
  155    HG   SER  20           HG       SER  20 -11.085   0.189 -13.697
  156    H1   LYS   1           HN       LYS   1 -11.501  -1.705 -15.548
  157    HA   LYS   1           HA       LYS   1  -8.785  -2.159 -16.480
  158    HB2  LYS   1           HB2      LYS   1 -11.246  -1.062 -17.858
  159    HB3  LYS   1           HB1      LYS   1  -9.694  -1.326 -18.653
  160    HG2  LYS   1           HG2      LYS   1  -9.792  -3.720 -18.047
  161    HG3  LYS   1           HG1      LYS   1 -11.351  -3.454 -17.267
  162    HD2  LYS   1           HD2      LYS   1 -12.311  -2.714 -19.410
  163    HD3  LYS   1           HD1      LYS   1 -10.755  -2.969 -20.200
  164    HE2  LYS   1           HE2      LYS   1 -10.842  -5.361 -19.610
  165    HE3  LYS   1           HE1      LYS   1 -12.397  -5.111 -18.818
  166    HZ1  LYS   1           HZ1      LYS   1 -12.218  -4.137 -21.539
  167    HZ2  LYS   1           HZ2      LYS   1 -13.470  -4.988 -20.767
  168    HZ3  LYS   1           HZ3      LYS   1 -12.120  -5.822 -21.375
  169    H    ASN   2           HN       ASN   2  -9.897   0.068 -14.547
  170    HA   ASN   2           HA       ASN   2  -9.365   2.505 -15.820
  171    HB2  ASN   2           HB2      ASN   2  -9.280   3.477 -13.569
  172    HB3  ASN   2           HB1      ASN   2 -10.643   2.367 -13.725
  173   HD21  ASN   2          HD21      ASN   2  -8.023   0.371 -13.679
  174   HD22  ASN   2          HD22      ASN   2  -7.918   0.074 -12.012
  175    HA   PRO   3           HA       PRO   3  -4.936   2.795 -16.021
  176    HB2  PRO   3           HB2      PRO   3  -5.173   5.486 -14.722
  177    HB3  PRO   3           HB1      PRO   3  -4.408   5.041 -16.262
  178    HG2  PRO   3           HG2      PRO   3  -6.742   6.294 -16.222
  179    HG3  PRO   3           HG1      PRO   3  -6.414   5.014 -17.404
  180    HD2  PRO   3           HD2      PRO   3  -8.067   4.907 -14.905
  181    HD3  PRO   3           HD1      PRO   3  -8.343   4.157 -16.490
  182    H    GLU   4           HN       GLU   4  -6.567   3.487 -13.008
  183    HA   GLU   4           HA       GLU   4  -4.348   3.652 -11.285
  184    HB2  GLU   4           HB2      GLU   4  -7.180   2.717 -10.786
  185    HB3  GLU   4           HB1      GLU   4  -5.989   2.966  -9.509
  186    HG2  GLU   4           HG2      GLU   4  -5.741   5.316 -10.173
  187    HG3  GLU   4           HG1      GLU   4  -6.891   5.078 -11.488
  188    H    ALA   5           HN       ALA   5  -5.743   0.988 -12.947
  189    HA   ALA   5           HA       ALA   5  -5.120  -1.154 -11.250
  190    HB1  ALA   5           HB1      ALA   5  -5.320  -2.550 -13.175
  191    HB2  ALA   5           HB2      ALA   5  -4.908  -1.224 -14.262
  192    HB3  ALA   5           HB3      ALA   5  -6.455  -1.220 -13.415
  193    H    GLU   6           HN       GLU   6  -3.112   0.738 -13.418
  194    HA   GLU   6           HA       GLU   6  -0.864  -0.959 -13.526
  195    HB2  GLU   6           HB2      GLU   6  -1.116   2.049 -13.719
  196    HB3  GLU   6           HB1      GLU   6   0.390   1.178 -14.008
  197    HG2  GLU   6           HG2      GLU   6  -0.661  -0.107 -15.803
  198    HG3  GLU   6           HG1      GLU   6  -2.208   0.676 -15.487
  199    H    GLU   7           HN       GLU   7  -1.925   1.428 -11.157
  200    HA   GLU   7           HA       GLU   7   0.454   1.558  -9.653
  201    HB2  GLU   7           HB2      GLU   7  -1.396   3.174  -9.383
  202    HB3  GLU   7           HB1      GLU   7  -2.408   1.896  -8.708
  203    HG2  GLU   7           HG2      GLU   7  -1.402   3.246  -6.910
  204    HG3  GLU   7           HG1      GLU   7  -0.786   1.595  -6.854
  205    H    ILE   8           HN       ILE   8  -2.331  -0.614  -9.491
  206    HA   ILE   8           HA       ILE   8  -1.609  -1.962  -7.120
  207    HB   ILE   8           HB       ILE   8  -3.300  -2.693  -9.509
  208   HG12  ILE   8          HG12      ILE   8  -5.093  -2.625  -7.801
  209   HG13  ILE   8          HG11      ILE   8  -3.893  -2.263  -6.561
  210   HG21  ILE   8          HG21      ILE   8  -2.477  -4.836  -8.926
  211   HG22  ILE   8          HG22      ILE   8  -3.997  -4.710  -8.038
  212   HG23  ILE   8          HG23      ILE   8  -2.462  -4.459  -7.207
  213   HD11  ILE   8          HD11      ILE   8  -3.412  -0.139  -7.494
  214   HD12  ILE   8          HD12      ILE   8  -5.169  -0.272  -7.577
  215   HD13  ILE   8          HD13      ILE   8  -4.195  -0.548  -9.019
  216    H    THR   9           HN       THR   9  -0.834  -2.582 -10.525
  217    HA   THR   9           HA       THR   9   0.554  -5.001 -10.145
  218    HB   THR   9           HB       THR   9   0.962  -2.861 -12.249
  219    HG1  THR   9           HG1      THR   9  -0.350  -5.284 -12.669
  220   HG21  THR   9          HG21      THR   9   2.884  -4.262 -12.292
  221   HG22  THR   9          HG22      THR   9   1.822  -4.889 -13.552
  222   HG23  THR   9          HG23      THR   9   1.926  -5.712 -11.996
  223    H    ARG  10           HN       ARG  10   1.639  -1.638 -10.098
  224    HA   ARG  10           HA       ARG  10   4.398  -2.116  -9.804
  225    HB2  ARG  10           HB2      ARG  10   3.449   0.099 -10.363
  226    HB3  ARG  10           HB1      ARG  10   2.781   0.213  -8.734
  227    HG2  ARG  10           HG2      ARG  10   4.987   0.164  -7.753
  228    HG3  ARG  10           HG1      ARG  10   5.731  -0.176  -9.317
  229    HD2  ARG  10           HD2      ARG  10   6.006   2.184  -8.837
  230    HD3  ARG  10           HD1      ARG  10   4.848   2.010 -10.149
  231    HE   ARG  10           HE       ARG  10   3.440   2.089  -7.693
  232   HH11  ARG  10          HH11      ARG  10   2.430   4.025  -7.097
  233   HH12  ARG  10          HH12      ARG  10   2.922   5.518  -7.820
  234   HH21  ARG  10          HH21      ARG  10   5.359   4.057  -9.805
  235   HH22  ARG  10          HH22      ARG  10   4.582   5.537  -9.352
  236    H    CYS  11           HN       CYS  11   1.761  -2.013  -7.487
  237    HA   CYS  11           HA       CYS  11   3.133  -1.864  -5.093
  238    HB2  CYS  11           HB2      CYS  11   0.604  -2.011  -5.512
  239    HB3  CYS  11           HB1      CYS  11   0.831  -3.758  -5.539
  240    H    LYS  12           HN       LYS  12   2.558  -4.700  -7.159
  241    HA   LYS  12           HA       LYS  12   3.623  -6.646  -5.412
  242    HB2  LYS  12           HB2      LYS  12   3.477  -6.522  -8.433
  243    HB3  LYS  12           HB1      LYS  12   4.004  -7.952  -7.545
  244    HG2  LYS  12           HG2      LYS  12   1.849  -8.003  -6.342
  245    HG3  LYS  12           HG1      LYS  12   1.320  -6.573  -7.231
  246    HD2  LYS  12           HD2      LYS  12   1.552  -7.811  -9.358
  247    HD3  LYS  12           HD1      LYS  12   2.065  -9.242  -8.463
  248    HE2  LYS  12           HE2      LYS  12  -0.093  -9.287  -7.275
  249    HE3  LYS  12           HE1      LYS  12  -0.610  -7.847  -8.154
  250    HZ1  LYS  12           HZ1      LYS  12   0.332  -9.798  -9.964
  251    HZ2  LYS  12           HZ2      LYS  12  -1.211  -9.095  -9.861
  252    HZ3  LYS  12           HZ3      LYS  12  -0.847 -10.487  -8.958
  253    H    LYS  13           HN       LYS  13   5.161  -4.531  -7.782
  254    HA   LYS  13           HA       LYS  13   7.727  -5.690  -7.744
  255    HB2  LYS  13           HB2      LYS  13   6.969  -4.006  -9.411
  256    HB3  LYS  13           HB1      LYS  13   7.023  -2.774  -8.150
  257    HG2  LYS  13           HG2      LYS  13   9.416  -3.169  -7.822
  258    HG3  LYS  13           HG1      LYS  13   9.390  -4.460  -9.025
  259    HD2  LYS  13           HD2      LYS  13   8.675  -2.826 -10.745
  260    HD3  LYS  13           HD1      LYS  13   8.745  -1.541  -9.539
  261    HE2  LYS  13           HE2      LYS  13  11.151  -1.982  -9.203
  262    HE3  LYS  13           HE1      LYS  13  11.081  -3.272 -10.402
  263    HZ1  LYS  13           HZ1      LYS  13  10.992  -1.821 -12.097
  264    HZ2  LYS  13           HZ2      LYS  13  11.718  -0.760 -10.986
  265    HZ3  LYS  13           HZ3      LYS  13  10.041  -0.699 -11.251
  266    H    LEU  14           HN       LEU  14   6.203  -3.252  -5.678
  267    HA   LEU  14           HA       LEU  14   8.505  -2.485  -4.238
  268    HB2  LEU  14           HB2      LEU  14   5.580  -2.538  -3.480
  269    HB3  LEU  14           HB1      LEU  14   6.827  -1.815  -2.463
  270    HG   LEU  14           HG       LEU  14   6.325  -1.031  -5.352
  271   HD11  LEU  14          HD11      LEU  14   4.429  -0.527  -3.701
  272   HD12  LEU  14          HD12      LEU  14   5.093   0.854  -4.571
  273   HD13  LEU  14          HD13      LEU  14   5.559   0.561  -2.898
  274   HD21  LEU  14          HD21      LEU  14   8.505  -0.319  -4.915
  275   HD22  LEU  14          HD22      LEU  14   8.208  -0.103  -3.190
  276   HD23  LEU  14          HD23      LEU  14   7.600   1.083  -4.348
  277    H    LEU  15           HN       LEU  15   6.114  -5.033  -3.632
  278    HA   LEU  15           HA       LEU  15   7.213  -5.891  -1.162
  279    HB2  LEU  15           HB2      LEU  15   5.438  -7.142  -3.235
  280    HB3  LEU  15           HB1      LEU  15   6.043  -8.125  -1.901
  281    HG   LEU  15           HG       LEU  15   3.795  -7.038  -1.476
  282   HD11  LEU  15          HD11      LEU  15   5.787  -7.540   0.294
  283   HD12  LEU  15          HD12      LEU  15   4.233  -6.856   0.766
  284   HD13  LEU  15          HD13      LEU  15   5.622  -5.797   0.535
  285   HD21  LEU  15          HD21      LEU  15   3.608  -4.685  -1.202
  286   HD22  LEU  15          HD22      LEU  15   4.549  -4.896  -2.672
  287   HD23  LEU  15          HD23      LEU  15   5.359  -4.468  -1.173
  288    H    ASP  16           HN       ASP  16   7.816  -6.893  -4.499
  289    HA   ASP  16           HA       ASP  16   9.632  -8.977  -3.860
  290    HB2  ASP  16           HB2      ASP  16   9.221  -7.313  -6.345
  291    HB3  ASP  16           HB1      ASP  16  10.401  -8.620  -6.255
  292    H    ASP  17           HN       ASP  17  10.020  -5.532  -4.505
  293    HA   ASP  17           HA       ASP  17  12.863  -5.524  -4.506
  294    HB2  ASP  17           HB2      ASP  17  10.822  -3.337  -4.082
  295    HB3  ASP  17           HB1      ASP  17  12.559  -3.041  -4.102
  296    H    SER  18           HN       SER  18  10.604  -5.962  -2.047
  297    HA   SER  18           HA       SER  18  11.754  -4.632   0.123
  298    HB2  SER  18           HB2      SER  18  10.543  -6.173   1.531
  299    HB3  SER  18           HB1      SER  18   9.544  -5.846   0.118
  300    HG   SER  18           HG       SER  18   9.670  -8.074   0.548
  301    H    SER  19           HN       SER  19  12.732  -7.478  -1.555
  302    HA   SER  19           HA       SER  19  14.618  -8.298   0.517
  303    HB2  SER  19           HB2      SER  19  15.170 -10.136  -0.935
  304    HB3  SER  19           HB1      SER  19  13.417  -9.955  -0.932
  305    HG   SER  19           HG       SER  19  13.771  -8.601  -2.851
  306    H    SER  20           HN       SER  20  14.568  -6.164  -2.069
  307    HA   SER  20           HA       SER  20  17.393  -6.288  -2.708
  308    HB2  SER  20           HB2      SER  20  15.844  -5.632  -4.461
  309    HB3  SER  20           HB1      SER  20  15.259  -4.286  -3.488
  310    HG   SER  20           HG       SER  20  17.179  -3.272  -3.729
  311    H1   LYS   1           HN       LYS   1  18.962  -4.764  -2.181
  312    HA   LYS   1           HA       LYS   1  18.579  -3.460   0.374
  313    HB2  LYS   1           HB2      LYS   1  20.948  -3.600  -1.502
  314    HB3  LYS   1           HB1      LYS   1  20.979  -2.808   0.074
  315    HG2  LYS   1           HG2      LYS   1  20.350  -4.934   1.159
  316    HG3  LYS   1           HG1      LYS   1  20.321  -5.727  -0.417
  317    HD2  LYS   1           HD2      LYS   1  22.709  -5.199  -0.734
  318    HD3  LYS   1           HD1      LYS   1  22.743  -4.403   0.840
  319    HE2  LYS   1           HE2      LYS   1  22.124  -6.520   1.935
  320    HE3  LYS   1           HE1      LYS   1  22.071  -7.322   0.365
  321    HZ1  LYS   1           HZ1      LYS   1  24.515  -5.880   0.934
  322    HZ2  LYS   1           HZ2      LYS   1  24.293  -7.415   0.241
  323    HZ3  LYS   1           HZ3      LYS   1  24.236  -7.225   1.928
  324    H    ASN   2           HN       ASN   2  17.459  -2.625  -2.451
  325    HA   ASN   2           HA       ASN   2  18.510  -0.081  -2.958
  326    HB2  ASN   2           HB2      ASN   2  16.510   0.298  -4.324
  327    HB3  ASN   2           HB1      ASN   2  17.173  -1.310  -4.615
  328   HD21  ASN   2          HD21      ASN   2  15.888  -1.577  -1.605
  329   HD22  ASN   2          HD22      ASN   2  14.320  -2.088  -2.001
  330    HA   PRO   3           HA       PRO   3  16.788   2.560   0.170
  331    HB2  PRO   3           HB2      PRO   3  15.871   4.381  -2.027
  332    HB3  PRO   3           HB1      PRO   3  16.908   4.735  -0.629
  333    HG2  PRO   3           HG2      PRO   3  17.935   4.511  -3.066
  334    HG3  PRO   3           HG1      PRO   3  18.798   3.888  -1.647
  335    HD2  PRO   3           HD2      PRO   3  17.262   2.386  -3.737
  336    HD3  PRO   3           HD1      PRO   3  18.766   1.958  -2.895
  337    H    GLU   4           HN       GLU   4  14.819   1.641  -2.569
  338    HA   GLU   4           HA       GLU   4  12.318   2.612  -1.716
  339    HB2  GLU   4           HB2      GLU   4  13.038   0.219  -3.421
  340    HB3  GLU   4           HB1      GLU   4  11.392   0.813  -3.205
  341    HG2  GLU   4           HG2      GLU   4  12.038   2.997  -4.118
  342    HG3  GLU   4           HG1      GLU   4  13.704   2.447  -4.289
  343    H    ALA   5           HN       ALA   5  14.268   0.032  -0.565
  344    HA   ALA   5           HA       ALA   5  12.358  -1.742   0.462
  345    HB1  ALA   5           HB1      ALA   5  14.101  -2.588   1.858
  346    HB2  ALA   5           HB2      ALA   5  14.976  -1.058   1.808
  347    HB3  ALA   5           HB3      ALA   5  14.878  -2.065   0.364
  348    H    GLU   6           HN       GLU   6  13.551   1.333   1.666
  349    HA   GLU   6           HA       GLU   6  12.573   1.177   4.306
  350    HB2  GLU   6           HB2      GLU   6  13.030   3.539   2.475
  351    HB3  GLU   6           HB1      GLU   6  12.588   3.697   4.174
  352    HG2  GLU   6           HG2      GLU   6  14.585   2.453   4.842
  353    HG3  GLU   6           HG1      GLU   6  15.014   2.195   3.151
  354    H    GLU   7           HN       GLU   7  11.048   2.098   1.259
  355    HA   GLU   7           HA       GLU   7   8.668   3.167   2.323
  356    HB2  GLU   7           HB2      GLU   7   9.322   3.449  -0.040
  357    HB3  GLU   7           HB1      GLU   7   9.092   1.721  -0.310
  358    HG2  GLU   7           HG2      GLU   7   7.111   2.976  -1.051
  359    HG3  GLU   7           HG1      GLU   7   6.698   1.952   0.323
  360    H    ILE   8           HN       ILE   8   9.612  -0.128   1.456
  361    HA   ILE   8           HA       ILE   8   7.080  -1.337   1.835
  362    HB   ILE   8           HB       ILE   8   9.916  -2.356   1.953
  363   HG12  ILE   8          HG12      ILE   8   9.163  -3.603  -0.045
  364   HG13  ILE   8          HG11      ILE   8   7.544  -2.934   0.140
  365   HG21  ILE   8          HG21      ILE   8   8.932  -3.802   3.540
  366   HG22  ILE   8          HG22      ILE   8   8.755  -4.686   2.024
  367   HG23  ILE   8          HG23      ILE   8   7.380  -3.814   2.707
  368   HD11  ILE   8          HD11      ILE   8   8.301  -0.731  -0.341
  369   HD12  ILE   8          HD12      ILE   8   9.096  -1.765  -1.531
  370   HD13  ILE   8          HD13      ILE   8   9.987  -1.196  -0.123
  371    H    THR   9           HN       THR   9   9.759  -0.737   4.081
  372    HA   THR   9           HA       THR   9   8.672  -2.061   6.314
  373    HB   THR   9           HB       THR   9  10.505   0.346   6.210
  374    HG1  THR   9           HG1      THR   9  11.370  -2.214   6.827
  375   HG21  THR   9          HG21      THR   9   9.629   0.228   8.417
  376   HG22  THR   9          HG22      THR   9  11.186  -0.596   8.491
  377   HG23  THR   9          HG23      THR   9   9.694  -1.534   8.430
  378    H    ARG  10           HN       ARG  10   8.357   1.273   5.178
  379    HA   ARG  10           HA       ARG  10   6.866   2.289   7.335
  380    HB2  ARG  10           HB2      ARG  10   7.904   3.720   5.611
  381    HB3  ARG  10           HB1      ARG  10   6.747   3.117   4.425
  382    HG2  ARG  10           HG2      ARG  10   4.892   4.044   5.664
  383    HG3  ARG  10           HG1      ARG  10   5.947   4.492   7.005
  384    HD2  ARG  10           HD2      ARG  10   5.524   6.470   5.667
  385    HD3  ARG  10           HD1      ARG  10   7.203   5.990   5.447
  386    HE   ARG  10           HE       ARG  10   5.631   4.783   3.422
  387   HH11  ARG  10          HH11      ARG  10   5.656   5.701   1.355
  388   HH12  ARG  10          HH12      ARG  10   6.174   7.339   1.140
  389   HH21  ARG  10          HH21      ARG  10   6.787   7.864   4.509
  390   HH22  ARG  10          HH22      ARG  10   6.812   8.563   2.925
  391    H    CYS  11           HN       CYS  11   5.936   0.491   4.467
  392    HA   CYS  11           HA       CYS  11   3.196   0.860   4.450
  393    HB2  CYS  11           HB2      CYS  11   4.669  -0.519   2.858
  394    HB3  CYS  11           HB1      CYS  11   4.476  -1.834   4.016
  395    H    LYS  12           HN       LYS  12   5.134  -1.349   6.445
  396    HA   LYS  12           HA       LYS  12   2.989  -2.737   7.643
  397    HB2  LYS  12           HB2      LYS  12   5.777  -2.098   8.638
  398    HB3  LYS  12           HB1      LYS  12   4.664  -3.171   9.490
  399    HG2  LYS  12           HG2      LYS  12   4.513  -4.607   7.485
  400    HG3  LYS  12           HG1      LYS  12   5.630  -3.537   6.636
  401    HD2  LYS  12           HD2      LYS  12   7.368  -4.004   8.323
  402    HD3  LYS  12           HD1      LYS  12   6.254  -5.071   9.178
  403    HE2  LYS  12           HE2      LYS  12   6.101  -6.515   7.185
  404    HE3  LYS  12           HE1      LYS  12   7.209  -5.449   6.323
  405    HZ1  LYS  12           HZ1      LYS  12   8.307  -6.169   8.822
  406    HZ2  LYS  12           HZ2      LYS  12   8.922  -6.455   7.264
  407    HZ3  LYS  12           HZ3      LYS  12   7.859  -7.571   7.979
  408    H    LYS  13           HN       LYS  13   4.566   0.310   8.461
  409    HA   LYS  13           HA       LYS  13   3.359   0.715  10.975
  410    HB2  LYS  13           HB2      LYS  13   5.287   2.031  10.105
  411    HB3  LYS  13           HB1      LYS  13   4.194   2.822   8.969
  412    HG2  LYS  13           HG2      LYS  13   2.849   3.691  10.829
  413    HG3  LYS  13           HG1      LYS  13   3.893   2.864  11.987
  414    HD2  LYS  13           HD2      LYS  13   5.824   4.188  11.186
  415    HD3  LYS  13           HD1      LYS  13   4.767   5.030  10.052
  416    HE2  LYS  13           HE2      LYS  13   3.413   5.879  11.930
  417    HE3  LYS  13           HE1      LYS  13   4.458   5.029  13.069
  418    HZ1  LYS  13           HZ1      LYS  13   6.088   6.533  12.837
  419    HZ2  LYS  13           HZ2      LYS  13   4.837   7.554  12.307
  420    HZ3  LYS  13           HZ3      LYS  13   5.819   6.749  11.177
  421    H    LEU  14           HN       LEU  14   2.304   1.484   7.683
  422    HA   LEU  14           HA       LEU  14   0.058   3.053   8.357
  423    HB2  LEU  14           HB2      LEU  14   0.644   1.296   5.969
  424    HB3  LEU  14           HB1      LEU  14  -0.774   2.343   6.069
  425    HG   LEU  14           HG       LEU  14   2.083   3.316   6.383
  426   HD11  LEU  14          HD11      LEU  14   1.477   2.383   4.083
  427   HD12  LEU  14          HD12      LEU  14   2.016   4.063   4.114
  428   HD13  LEU  14          HD13      LEU  14   0.299   3.690   3.970
  429   HD21  LEU  14          HD21      LEU  14   0.802   4.983   7.383
  430   HD22  LEU  14          HD22      LEU  14  -0.626   4.626   6.411
  431   HD23  LEU  14          HD23      LEU  14   0.723   5.520   5.706
  432    H    LEU  15           HN       LEU  15   0.400  -0.439   7.842
  433    HA   LEU  15           HA       LEU  15  -2.349  -1.061   8.173
  434    HB2  LEU  15           HB2      LEU  15   0.210  -2.610   8.393
  435    HB3  LEU  15           HB1      LEU  15  -1.306  -3.367   8.883
  436    HG   LEU  15           HG       LEU  15  -0.660  -3.768   6.469
  437   HD11  LEU  15          HD11      LEU  15  -3.142  -3.466   7.520
  438   HD12  LEU  15          HD12      LEU  15  -2.857  -3.838   5.821
  439   HD13  LEU  15          HD13      LEU  15  -3.182  -2.177   6.313
  440   HD21  LEU  15          HD21      LEU  15  -0.698  -1.993   4.883
  441   HD22  LEU  15          HD22      LEU  15   0.226  -1.376   6.245
  442   HD23  LEU  15          HD23      LEU  15  -1.446  -0.882   6.031
  443    H    ASP  16           HN       ASP  16   0.331  -0.879  10.473
  444    HA   ASP  16           HA       ASP  16  -1.156  -1.748  12.725
  445    HB2  ASP  16           HB2      ASP  16   1.357  -0.102  12.437
  446    HB3  ASP  16           HB1      ASP  16   0.685  -0.541  14.006
  447    H    ASP  17           HN       ASP  17  -0.548   1.418  11.302
  448    HA   ASP  17           HA       ASP  17  -1.786   2.930  13.369
  449    HB2  ASP  17           HB2      ASP  17  -1.146   3.572  10.484
  450    HB3  ASP  17           HB1      ASP  17  -1.855   4.739  11.599
  451    H    SER  18           HN       SER  18  -3.035   0.873  11.014
  452    HA   SER  18           HA       SER  18  -5.401   2.140  10.243
  453    HB2  SER  18           HB2      SER  18  -6.238  -0.063   9.699
  454    HB3  SER  18           HB1      SER  18  -4.517  -0.027   9.322
  455    HG   SER  18           HG       SER  18  -5.091  -1.885  10.524
  456    H    SER  19           HN       SER  19  -4.488   0.691  13.226
  457    HA   SER  19           HA       SER  19  -7.220   0.604  14.257
  458    HB2  SER  19           HB2      SER  19  -6.263  -0.303  16.272
  459    HB3  SER  19           HB1      SER  19  -5.499  -1.104  14.900
  460    HG   SER  19           HG       SER  19  -3.817   0.519  15.112
  461    H    SER  20           HN       SER  20  -4.735   2.844  14.004
  462    HA   SER  20           HA       SER  20  -5.382   4.395  16.363
  463    HB2  SER  20           HB2      SER  20  -3.097   4.447  15.511
  464    HB3  SER  20           HB1      SER  20  -3.661   5.064  13.962
  465    HG   SER  20           HG       SER  20  -4.231   6.955  14.925
  466    H2   ZBR 100           HA3      TBS 100  -1.910  -0.567  -1.564
  467    H4   ZBR 100           HC3      TBS 100   0.229   0.023   2.138
  468    H6   ZBR 100           HB3      TBS 100   2.308  -1.441  -1.355
  469    H7   ZBR 100          HB11      TBS 100   0.517  -0.615  -3.663
  470    H7A  ZBR 100          HB12      TBS 100  -0.856  -1.679  -3.350
  471    H8   ZBR 100          HA11      TBS 100  -2.379   1.306   0.789
  472    H8A  ZBR 100          HA12      TBS 100  -2.125   0.161   2.106
  473    H9   ZBR 100          HC11      TBS 100   3.142   0.217   1.271
  474    H9A  ZBR 100          HC12      TBS 100   3.387  -1.453   0.752
  Start of MODEL   18
    1    H1   LYS   1           HN       LYS   1  -6.609   5.503  16.701
    2    HA   LYS   1           HA       LYS   1  -8.683   5.973  14.764
    3    HB2  LYS   1           HB2      LYS   1  -7.996   7.366  17.361
    4    HB3  LYS   1           HB1      LYS   1  -9.433   7.704  16.396
    5    HG2  LYS   1           HG2      LYS   1 -10.144   5.351  16.621
    6    HG3  LYS   1           HG1      LYS   1  -8.712   5.015  17.597
    7    HD2  LYS   1           HD2      LYS   1  -9.455   6.666  19.270
    8    HD3  LYS   1           HD1      LYS   1 -10.889   7.006  18.300
    9    HE2  LYS   1           HE2      LYS   1 -11.608   4.659  18.527
   10    HE3  LYS   1           HE1      LYS   1 -10.174   4.310  19.493
   11    HZ1  LYS   1           HZ1      LYS   1 -11.566   6.576  20.495
   12    HZ2  LYS   1           HZ2      LYS   1 -11.145   5.135  21.289
   13    HZ3  LYS   1           HZ3      LYS   1 -12.595   5.231  20.411
   14    H    ASN   2           HN       ASN   2  -5.634   6.731  14.499
   15    HA   ASN   2           HA       ASN   2  -5.493   9.499  14.228
   16    HB2  ASN   2           HB2      ASN   2  -3.507   9.020  12.745
   17    HB3  ASN   2           HB1      ASN   2  -3.467   8.197  14.296
   18   HD21  ASN   2          HD21      ASN   2  -5.848   6.806  12.306
   19   HD22  ASN   2          HD22      ASN   2  -4.936   5.512  11.708
   20    HA   PRO   3           HA       PRO   3  -7.768  10.358  10.545
   21    HB2  PRO   3           HB2      PRO   3  -6.256  12.426   9.495
   22    HB3  PRO   3           HB1      PRO   3  -7.379  12.608  10.854
   23    HG2  PRO   3           HG2      PRO   3  -4.410  12.260  10.883
   24    HG3  PRO   3           HG1      PRO   3  -5.431  13.327  11.869
   25    HD2  PRO   3           HD2      PRO   3  -4.449  11.029  12.841
   26    HD3  PRO   3           HD1      PRO   3  -6.046  11.622  13.327
   27    H    GLU   4           HN       GLU   4  -4.414   9.515  10.401
   28    HA   GLU   4           HA       GLU   4  -4.061   9.408   7.596
   29    HB2  GLU   4           HB2      GLU   4  -2.712   7.894   9.836
   30    HB3  GLU   4           HB1      GLU   4  -2.195   7.825   8.151
   31    HG2  GLU   4           HG2      GLU   4  -1.843  10.254   8.136
   32    HG3  GLU   4           HG1      GLU   4  -2.408  10.358   9.803
   33    H    ALA   5           HN       ALA   5  -5.937   7.523   9.701
   34    HA   ALA   5           HA       ALA   5  -5.815   4.972   8.543
   35    HB1  ALA   5           HB1      ALA   5  -7.967   4.572   9.577
   36    HB2  ALA   5           HB2      ALA   5  -8.260   6.305   9.729
   37    HB3  ALA   5           HB3      ALA   5  -6.987   5.539  10.679
   38    H    GLU   6           HN       GLU   6  -7.284   7.924   7.448
   39    HA   GLU   6           HA       GLU   6  -9.216   6.904   5.681
   40    HB2  GLU   6           HB2      GLU   6  -7.553   9.432   5.548
   41    HB3  GLU   6           HB1      GLU   6  -8.916   9.094   4.481
   42    HG2  GLU   6           HG2      GLU   6  -9.093   9.131   7.506
   43    HG3  GLU   6           HG1      GLU   6  -9.536  10.488   6.472
   44    H    GLU   7           HN       GLU   7  -5.747   7.415   5.307
   45    HA   GLU   7           HA       GLU   7  -5.592   6.972   2.526
   46    HB2  GLU   7           HB2      GLU   7  -3.742   7.947   3.828
   47    HB3  GLU   7           HB1      GLU   7  -3.521   6.408   4.662
   48    HG2  GLU   7           HG2      GLU   7  -1.913   6.595   2.824
   49    HG3  GLU   7           HG1      GLU   7  -3.055   5.311   2.475
   50    H    ILE   8           HN       ILE   8  -5.507   4.781   5.284
   51    HA   ILE   8           HA       ILE   8  -4.815   2.415   3.894
   52    HB   ILE   8           HB       ILE   8  -6.310   2.927   6.467
   53   HG12  ILE   8          HG12      ILE   8  -4.257   2.014   7.453
   54   HG13  ILE   8          HG11      ILE   8  -3.607   1.699   5.844
   55   HG21  ILE   8          HG21      ILE   8  -5.764   0.331   5.029
   56   HG22  ILE   8          HG22      ILE   8  -7.259   0.880   5.790
   57   HG23  ILE   8          HG23      ILE   8  -5.893   0.383   6.788
   58   HD11  ILE   8          HD11      ILE   8  -4.461   4.471   6.677
   59   HD12  ILE   8          HD12      ILE   8  -3.377   3.996   5.355
   60   HD13  ILE   8          HD13      ILE   8  -2.849   3.863   7.027
   61    H    THR   9           HN       THR   9  -7.947   3.913   4.630
   62    HA   THR   9           HA       THR   9  -9.597   1.870   3.597
   63    HB   THR   9           HB       THR   9 -10.069   4.860   3.706
   64    HG1  THR   9           HG1      THR   9  -9.651   3.480   5.667
   65   HG21  THR   9          HG21      THR   9 -11.884   2.505   3.172
   66   HG22  THR   9          HG22      THR   9 -11.659   3.949   2.186
   67   HG23  THR   9          HG23      THR   9 -12.499   4.059   3.732
   68    H    ARG  10           HN       ARG  10  -8.105   4.705   2.062
   69    HA   ARG  10           HA       ARG  10  -9.275   4.390  -0.495
   70    HB2  ARG  10           HB2      ARG  10  -8.104   6.446   0.252
   71    HB3  ARG  10           HB1      ARG  10  -6.573   5.570   0.196
   72    HG2  ARG  10           HG2      ARG  10  -6.817   5.191  -2.183
   73    HG3  ARG  10           HG1      ARG  10  -8.432   5.887  -2.177
   74    HD2  ARG  10           HD2      ARG  10  -6.910   7.576  -2.989
   75    HD3  ARG  10           HD1      ARG  10  -7.414   8.038  -1.367
   76    HE   ARG  10           HE       ARG  10  -5.042   6.524  -1.161
   77   HH11  ARG  10          HH11      ARG  10  -3.077   7.614  -0.859
   78   HH12  ARG  10          HH12      ARG  10  -2.943   9.286  -1.271
   79   HH21  ARG  10          HH21      ARG  10  -6.224   9.552  -2.359
   80   HH22  ARG  10          HH22      ARG  10  -4.723  10.385  -2.122
   81    H    CYS  11           HN       CYS  11  -6.302   3.105   0.952
   82    HA   CYS  11           HA       CYS  11  -5.248   1.891  -1.360
   83    HB2  CYS  11           HB2      CYS  11  -4.807   1.751   1.544
   84    HB3  CYS  11           HB1      CYS  11  -4.461   0.239   0.707
   85    H    LYS  12           HN       LYS  12  -7.544   0.729   1.067
   86    HA   LYS  12           HA       LYS  12  -7.729  -1.941   0.221
   87    HB2  LYS  12           HB2      LYS  12  -8.706  -1.047   2.330
   88    HB3  LYS  12           HB1      LYS  12  -9.940  -0.224   1.375
   89    HG2  LYS  12           HG2      LYS  12 -10.718  -2.371   0.478
   90    HG3  LYS  12           HG1      LYS  12  -9.453  -3.215   1.371
   91    HD2  LYS  12           HD2      LYS  12 -10.411  -2.415   3.499
   92    HD3  LYS  12           HD1      LYS  12 -11.679  -1.570   2.608
   93    HE2  LYS  12           HE2      LYS  12 -12.506  -3.738   3.418
   94    HE3  LYS  12           HE1      LYS  12 -12.438  -3.726   1.655
   95    HZ1  LYS  12           HZ1      LYS  12 -10.176  -4.721   3.274
   96    HZ2  LYS  12           HZ2      LYS  12 -10.534  -5.034   1.644
   97    HZ3  LYS  12           HZ3      LYS  12 -11.477  -5.732   2.872
   98    H    LYS  13           HN       LYS  13  -9.515   0.950  -0.815
   99    HA   LYS  13           HA       LYS  13 -11.267  -0.356  -2.615
  100    HB2  LYS  13           HB2      LYS  13 -10.220   2.479  -2.536
  101    HB3  LYS  13           HB1      LYS  13 -11.466   1.928  -3.658
  102    HG2  LYS  13           HG2      LYS  13 -12.866   1.216  -1.749
  103    HG3  LYS  13           HG1      LYS  13 -11.627   1.788  -0.632
  104    HD2  LYS  13           HD2      LYS  13 -11.869   4.075  -1.534
  105    HD3  LYS  13           HD1      LYS  13 -13.114   3.502  -2.645
  106    HE2  LYS  13           HE2      LYS  13 -14.504   2.801  -0.727
  107    HE3  LYS  13           HE1      LYS  13 -13.262   3.383   0.382
  108    HZ1  LYS  13           HZ1      LYS  13 -14.270   5.341   0.278
  109    HZ2  LYS  13           HZ2      LYS  13 -15.270   4.849  -1.006
  110    HZ3  LYS  13           HZ3      LYS  13 -13.723   5.476  -1.323
  111    H    LEU  14           HN       LEU  14  -8.027   1.023  -2.998
  112    HA   LEU  14           HA       LEU  14  -7.855   0.765  -5.800
  113    HB2  LEU  14           HB2      LEU  14  -5.818   0.876  -3.577
  114    HB3  LEU  14           HB1      LEU  14  -5.305   0.651  -5.249
  115    HG   LEU  14           HG       LEU  14  -7.224   2.886  -4.589
  116   HD11  LEU  14          HD11      LEU  14  -5.569   3.444  -3.036
  117   HD12  LEU  14          HD12      LEU  14  -5.020   4.298  -4.469
  118   HD13  LEU  14          HD13      LEU  14  -4.266   2.772  -4.005
  119   HD21  LEU  14          HD21      LEU  14  -6.535   2.149  -6.963
  120   HD22  LEU  14          HD22      LEU  14  -4.932   2.745  -6.569
  121   HD23  LEU  14          HD23      LEU  14  -6.309   3.849  -6.585
  122    H    LEU  15           HN       LEU  15  -7.026  -1.460  -3.171
  123    HA   LEU  15           HA       LEU  15  -5.874  -3.479  -4.781
  124    HB2  LEU  15           HB2      LEU  15  -7.295  -3.620  -2.109
  125    HB3  LEU  15           HB1      LEU  15  -6.432  -4.969  -2.834
  126    HG   LEU  15           HG       LEU  15  -5.165  -2.266  -2.304
  127   HD11  LEU  15          HD11      LEU  15  -5.806  -3.288  -0.173
  128   HD12  LEU  15          HD12      LEU  15  -4.058  -3.399  -0.384
  129   HD13  LEU  15          HD13      LEU  15  -5.072  -4.816  -0.664
  130   HD21  LEU  15          HD21      LEU  15  -4.215  -4.914  -3.379
  131   HD22  LEU  15          HD22      LEU  15  -3.102  -3.958  -2.413
  132   HD23  LEU  15          HD23      LEU  15  -3.788  -3.279  -3.877
  133    H    ASP  16           HN       ASP  16  -9.203  -2.911  -3.713
  134    HA   ASP  16           HA       ASP  16 -10.271  -5.273  -4.933
  135    HB2  ASP  16           HB2      ASP  16 -11.543  -2.715  -3.954
  136    HB3  ASP  16           HB1      ASP  16 -12.467  -4.058  -4.628
  137    H    ASP  17           HN       ASP  17  -9.935  -1.890  -5.911
  138    HA   ASP  17           HA       ASP  17 -11.381  -2.131  -8.350
  139    HB2  ASP  17           HB2      ASP  17  -9.353  -0.115  -7.380
  140    HB3  ASP  17           HB1      ASP  17 -10.185   0.017  -8.929
  141    H    SER  18           HN       SER  18  -8.390  -3.324  -7.375
  142    HA   SER  18           HA       SER  18  -6.790  -3.027  -9.638
  143    HB2  SER  18           HB2      SER  18  -5.529  -4.919  -8.814
  144    HB3  SER  18           HB1      SER  18  -6.070  -3.981  -7.426
  145    HG   SER  18           HG       SER  18  -6.653  -6.002  -6.923
  146    H    SER  19           HN       SER  19  -9.594  -4.925  -9.138
  147    HA   SER  19           HA       SER  19  -9.089  -6.732 -11.355
  148    HB2  SER  19           HB2      SER  19 -11.529  -6.273  -9.644
  149    HB3  SER  19           HB1      SER  19 -11.437  -7.485 -10.919
  150    HG   SER  19           HG       SER  19 -10.216  -8.680  -9.680
  151    H    SER  20           HN       SER  20 -10.167  -3.589 -11.021
  152    HA   SER  20           HA       SER  20 -12.023  -3.564 -13.241
  153    HB2  SER  20           HB2      SER  20 -10.714  -1.236 -11.831
  154    HB3  SER  20           HB1      SER  20 -12.108  -1.164 -12.905
  155    HG   SER  20           HG       SER  20 -13.110  -2.663 -11.371
  156    H1   LYS   1           HN       LYS   1 -11.678  -2.551 -15.256
  157    HA   LYS   1           HA       LYS   1  -9.016  -2.920 -16.296
  158    HB2  LYS   1           HB2      LYS   1 -11.557  -1.905 -17.588
  159    HB3  LYS   1           HB1      LYS   1 -10.052  -2.224 -18.452
  160    HG2  LYS   1           HG2      LYS   1 -10.126  -4.582 -17.703
  161    HG3  LYS   1           HG1      LYS   1 -11.642  -4.259 -16.862
  162    HD2  LYS   1           HD2      LYS   1 -12.698  -3.626 -19.002
  163    HD3  LYS   1           HD1      LYS   1 -11.185  -3.960 -19.845
  164    HE2  LYS   1           HE2      LYS   1 -11.280  -6.309 -19.096
  165    HE3  LYS   1           HE1      LYS   1 -12.796  -5.979 -18.256
  166    HZ1  LYS   1           HZ1      LYS   1 -12.908  -5.086 -20.948
  167    HZ2  LYS   1           HZ2      LYS   1 -13.919  -6.185 -20.137
  168    HZ3  LYS   1           HZ3      LYS   1 -12.494  -6.729 -20.886
  169    H    ASN   2           HN       ASN   2 -10.028  -0.604 -14.410
  170    HA   ASN   2           HA       ASN   2  -9.654   1.791 -15.776
  171    HB2  ASN   2           HB2      ASN   2  -9.167   2.745 -13.480
  172    HB3  ASN   2           HB1      ASN   2 -10.664   1.834 -13.602
  173   HD21  ASN   2          HD21      ASN   2  -7.874  -0.172 -13.730
  174   HD22  ASN   2          HD22      ASN   2  -7.892  -0.682 -12.118
  175    HA   PRO   3           HA       PRO   3  -5.304   1.980 -16.497
  176    HB2  PRO   3           HB2      PRO   3  -4.863   4.696 -16.193
  177    HB3  PRO   3           HB1      PRO   3  -5.608   3.966 -17.628
  178    HG2  PRO   3           HG2      PRO   3  -6.911   5.290 -15.284
  179    HG3  PRO   3           HG1      PRO   3  -7.298   5.417 -17.012
  180    HD2  PRO   3           HD2      PRO   3  -8.744   3.881 -15.353
  181    HD3  PRO   3           HD1      PRO   3  -8.469   3.407 -17.040
  182    H    GLU   4           HN       GLU   4  -6.665   3.132 -13.533
  183    HA   GLU   4           HA       GLU   4  -4.295   3.796 -12.136
  184    HB2  GLU   4           HB2      GLU   4  -6.993   2.848 -11.161
  185    HB3  GLU   4           HB1      GLU   4  -5.699   3.391 -10.091
  186    HG2  GLU   4           HG2      GLU   4  -5.666   5.577 -11.210
  187    HG3  GLU   4           HG1      GLU   4  -6.924   5.038 -12.322
  188    H    ALA   5           HN       ALA   5  -5.503   0.824 -13.230
  189    HA   ALA   5           HA       ALA   5  -4.685  -0.964 -11.235
  190    HB1  ALA   5           HB1      ALA   5  -4.726  -2.663 -12.950
  191    HB2  ALA   5           HB2      ALA   5  -4.617  -1.442 -14.218
  192    HB3  ALA   5           HB3      ALA   5  -6.070  -1.555 -13.227
  193    H    GLU   6           HN       GLU   6  -2.868   0.868 -13.555
  194    HA   GLU   6           HA       GLU   6  -0.517  -0.666 -13.690
  195    HB2  GLU   6           HB2      GLU   6  -0.941   2.328 -13.873
  196    HB3  GLU   6           HB1      GLU   6   0.584   1.523 -14.252
  197    HG2  GLU   6           HG2      GLU   6  -2.057   0.855 -15.577
  198    HG3  GLU   6           HG1      GLU   6  -0.856   1.946 -16.268
  199    H    GLU   7           HN       GLU   7  -1.629   1.703 -11.324
  200    HA   GLU   7           HA       GLU   7   0.779   1.961  -9.877
  201    HB2  GLU   7           HB2      GLU   7  -1.121   3.505  -9.596
  202    HB3  GLU   7           HB1      GLU   7  -2.074   2.200  -8.887
  203    HG2  GLU   7           HG2      GLU   7  -1.096   3.577  -7.112
  204    HG3  GLU   7           HG1      GLU   7  -0.385   1.974  -7.073
  205    H    ILE   8           HN       ILE   8  -1.890  -0.329  -9.656
  206    HA   ILE   8           HA       ILE   8  -1.110  -1.625  -7.265
  207    HB   ILE   8           HB       ILE   8  -2.736  -2.517  -9.646
  208   HG12  ILE   8          HG12      ILE   8  -4.575  -2.338  -8.042
  209   HG13  ILE   8          HG11      ILE   8  -3.440  -1.934  -6.757
  210   HG21  ILE   8          HG21      ILE   8  -1.869  -4.062  -7.207
  211   HG22  ILE   8          HG22      ILE   8  -1.866  -4.571  -8.896
  212   HG23  ILE   8          HG23      ILE   8  -3.389  -4.432  -8.020
  213   HD11  ILE   8          HD11      ILE   8  -3.613  -0.292  -9.280
  214   HD12  ILE   8          HD12      ILE   8  -2.933   0.164  -7.712
  215   HD13  ILE   8          HD13      ILE   8  -4.672   0.015  -7.912
  216    H    THR   9           HN       THR   9  -0.310  -2.230 -10.668
  217    HA   THR   9           HA       THR   9   1.185  -4.591 -10.292
  218    HB   THR   9           HB       THR   9   1.503  -2.421 -12.380
  219    HG1  THR   9           HG1      THR   9  -0.547  -3.638 -12.106
  220   HG21  THR   9          HG21      THR   9   2.594  -5.228 -12.147
  221   HG22  THR   9          HG22      THR   9   3.493  -3.733 -12.405
  222   HG23  THR   9          HG23      THR   9   2.478  -4.385 -13.691
  223    H    ARG  10           HN       ARG  10   2.122  -1.167 -10.220
  224    HA   ARG  10           HA       ARG  10   4.906  -1.559  -9.897
  225    HB2  ARG  10           HB2      ARG  10   3.870   0.612 -10.504
  226    HB3  ARG  10           HB1      ARG  10   3.207   0.727  -8.873
  227    HG2  ARG  10           HG2      ARG  10   5.425   0.752  -7.908
  228    HG3  ARG  10           HG1      ARG  10   6.162   0.441  -9.476
  229    HD2  ARG  10           HD2      ARG  10   6.362   2.807  -9.028
  230    HD3  ARG  10           HD1      ARG  10   5.151   2.595 -10.290
  231    HE   ARG  10           HE       ARG  10   3.839   2.608  -7.789
  232   HH11  ARG  10          HH11      ARG  10   2.800   4.506  -7.118
  233   HH12  ARG  10          HH12      ARG  10   3.227   6.023  -7.825
  234   HH21  ARG  10          HH21      ARG  10   5.635   4.668  -9.920
  235   HH22  ARG  10          HH22      ARG  10   4.834   6.118  -9.410
  236    H    CYS  11           HN       CYS  11   2.246  -1.278  -7.565
  237    HA   CYS  11           HA       CYS  11   3.792  -1.270  -5.212
  238    HB2  CYS  11           HB2      CYS  11   0.976  -1.767  -5.936
  239    HB3  CYS  11           HB1      CYS  11   1.506  -2.561  -4.452
  240    H    LYS  12           HN       LYS  12   2.520  -3.923  -7.172
  241    HA   LYS  12           HA       LYS  12   3.165  -6.047  -5.447
  242    HB2  LYS  12           HB2      LYS  12   1.738  -6.254  -7.473
  243    HB3  LYS  12           HB1      LYS  12   3.178  -6.064  -8.473
  244    HG2  LYS  12           HG2      LYS  12   4.175  -8.067  -7.471
  245    HG3  LYS  12           HG1      LYS  12   2.777  -8.246  -6.409
  246    HD2  LYS  12           HD2      LYS  12   1.312  -8.526  -8.371
  247    HD3  LYS  12           HD1      LYS  12   2.704  -8.340  -9.438
  248    HE2  LYS  12           HE2      LYS  12   2.190 -10.721  -9.117
  249    HE3  LYS  12           HE1      LYS  12   3.754 -10.330  -8.402
  250    HZ1  LYS  12           HZ1      LYS  12   1.273 -10.246  -6.802
  251    HZ2  LYS  12           HZ2      LYS  12   2.879 -10.377  -6.266
  252    HZ3  LYS  12           HZ3      LYS  12   2.123 -11.696  -7.024
  253    H    LYS  13           HN       LYS  13   5.059  -4.464  -8.002
  254    HA   LYS  13           HA       LYS  13   7.344  -6.126  -7.824
  255    HB2  LYS  13           HB2      LYS  13   7.020  -3.253  -8.714
  256    HB3  LYS  13           HB1      LYS  13   8.521  -4.166  -8.871
  257    HG2  LYS  13           HG2      LYS  13   7.350  -5.873 -10.218
  258    HG3  LYS  13           HG1      LYS  13   5.852  -4.952 -10.071
  259    HD2  LYS  13           HD2      LYS  13   6.888  -3.042 -11.215
  260    HD3  LYS  13           HD1      LYS  13   8.407  -3.929 -11.343
  261    HE2  LYS  13           HE2      LYS  13   7.289  -5.659 -12.698
  262    HE3  LYS  13           HE1      LYS  13   5.766  -4.778 -12.572
  263    HZ1  LYS  13           HZ1      LYS  13   6.398  -3.657 -14.360
  264    HZ2  LYS  13           HZ2      LYS  13   7.953  -4.338 -14.328
  265    HZ3  LYS  13           HZ3      LYS  13   7.619  -2.935 -13.430
  266    H    LEU  14           HN       LEU  14   6.389  -3.164  -6.123
  267    HA   LEU  14           HA       LEU  14   8.819  -2.732  -4.763
  268    HB2  LEU  14           HB2      LEU  14   5.948  -1.979  -4.229
  269    HB3  LEU  14           HB1      LEU  14   7.201  -1.568  -3.058
  270    HG   LEU  14           HG       LEU  14   7.614  -0.878  -5.969
  271   HD11  LEU  14          HD11      LEU  14   5.523   0.152  -5.662
  272   HD12  LEU  14          HD12      LEU  14   6.655   1.428  -5.255
  273   HD13  LEU  14          HD13      LEU  14   5.836   0.533  -3.973
  274   HD21  LEU  14          HD21      LEU  14   9.381  -0.676  -4.086
  275   HD22  LEU  14          HD22      LEU  14   8.385   0.620  -3.451
  276   HD23  LEU  14          HD23      LEU  14   9.098   0.759  -5.059
  277    H    LEU  15           HN       LEU  15   5.943  -4.615  -3.900
  278    HA   LEU  15           HA       LEU  15   6.774  -5.329  -1.294
  279    HB2  LEU  15           HB2      LEU  15   4.958  -6.733  -3.273
  280    HB3  LEU  15           HB1      LEU  15   5.158  -7.237  -1.601
  281    HG   LEU  15           HG       LEU  15   4.315  -4.442  -2.414
  282   HD11  LEU  15          HD11      LEU  15   2.597  -6.038  -3.120
  283   HD12  LEU  15          HD12      LEU  15   2.038  -5.151  -1.702
  284   HD13  LEU  15          HD13      LEU  15   2.631  -6.804  -1.530
  285   HD21  LEU  15          HD21      LEU  15   4.730  -5.888   0.189
  286   HD22  LEU  15          HD22      LEU  15   3.423  -4.717   0.094
  287   HD23  LEU  15          HD23      LEU  15   5.071  -4.213  -0.237
  288    H    ASP  16           HN       ASP  16   7.257  -6.885  -4.441
  289    HA   ASP  16           HA       ASP  16   8.657  -9.154  -3.399
  290    HB2  ASP  16           HB2      ASP  16   8.482  -7.938  -6.156
  291    HB3  ASP  16           HB1      ASP  16   9.406  -9.398  -5.806
  292    H    ASP  17           HN       ASP  17   9.629  -6.014  -4.699
  293    HA   ASP  17           HA       ASP  17  12.429  -6.526  -4.669
  294    HB2  ASP  17           HB2      ASP  17  10.831  -3.965  -4.718
  295    HB3  ASP  17           HB1      ASP  17  12.591  -4.008  -4.797
  296    H    SER  18           HN       SER  18  10.195  -6.088  -2.195
  297    HA   SER  18           HA       SER  18  11.562  -4.538  -0.327
  298    HB2  SER  18           HB2      SER  18  10.144  -5.537   1.333
  299    HB3  SER  18           HB1      SER  18   9.196  -5.425  -0.146
  300    HG   SER  18           HG       SER  18   8.915  -7.474   0.436
  301    H    SER  19           HN       SER  19  12.187  -7.715  -1.457
  302    HA   SER  19           HA       SER  19  13.864  -8.468   0.789
  303    HB2  SER  19           HB2      SER  19  13.408  -9.747  -1.905
  304    HB3  SER  19           HB1      SER  19  14.438 -10.434  -0.651
  305    HG   SER  19           HG       SER  19  12.710 -11.098   0.334
  306    H    SER  20           HN       SER  20  14.214  -6.576  -1.956
  307    HA   SER  20           HA       SER  20  17.024  -7.087  -2.422
  308    HB2  SER  20           HB2      SER  20  15.359  -4.769  -3.411
  309    HB3  SER  20           HB1      SER  20  16.900  -5.323  -4.057
  310    HG   SER  20           HG       SER  20  15.815  -7.345  -4.491
  311    H1   LYS   1           HN       LYS   1  18.729  -5.633  -1.993
  312    HA   LYS   1           HA       LYS   1  18.465  -4.222   0.506
  313    HB2  LYS   1           HB2      LYS   1  20.787  -4.506  -1.414
  314    HB3  LYS   1           HB1      LYS   1  20.887  -3.721   0.162
  315    HG2  LYS   1           HG2      LYS   1  20.157  -5.816   1.250
  316    HG3  LYS   1           HG1      LYS   1  20.077  -6.603  -0.327
  317    HD2  LYS   1           HD2      LYS   1  22.487  -6.179  -0.663
  318    HD3  LYS   1           HD1      LYS   1  22.568  -5.404   0.921
  319    HE2  LYS   1           HE2      LYS   1  21.847  -7.506   1.993
  320    HE3  LYS   1           HE1      LYS   1  21.766  -8.284   0.412
  321    HZ1  LYS   1           HZ1      LYS   1  24.268  -7.006   0.773
  322    HZ2  LYS   1           HZ2      LYS   1  23.936  -8.640   0.447
  323    HZ3  LYS   1           HZ3      LYS   1  23.972  -8.081   2.051
  324    H    ASN   2           HN       ASN   2  17.317  -3.362  -2.304
  325    HA   ASN   2           HA       ASN   2  18.474  -0.917  -2.957
  326    HB2  ASN   2           HB2      ASN   2  16.255  -0.426  -4.061
  327    HB3  ASN   2           HB1      ASN   2  16.965  -1.970  -4.505
  328   HD21  ASN   2          HD21      ASN   2  15.823  -2.053  -1.294
  329   HD22  ASN   2          HD22      ASN   2  14.326  -2.784  -1.594
  330    HA   PRO   3           HA       PRO   3  17.225   1.806   0.277
  331    HB2  PRO   3           HB2      PRO   3  16.844   4.147  -1.151
  332    HB3  PRO   3           HB1      PRO   3  18.436   3.498  -0.715
  333    HG2  PRO   3           HG2      PRO   3  16.943   3.274  -3.296
  334    HG3  PRO   3           HG1      PRO   3  18.668   3.579  -3.013
  335    HD2  PRO   3           HD2      PRO   3  17.767   1.158  -3.725
  336    HD3  PRO   3           HD1      PRO   3  19.142   1.334  -2.624
  337    H    GLU   4           HN       GLU   4  15.191   1.298  -2.480
  338    HA   GLU   4           HA       GLU   4  12.923   2.792  -1.699
  339    HB2  GLU   4           HB2      GLU   4  13.192   0.311  -3.403
  340    HB3  GLU   4           HB1      GLU   4  11.680   1.199  -3.199
  341    HG2  GLU   4           HG2      GLU   4  12.741   3.235  -4.077
  342    HG3  GLU   4           HG1      GLU   4  14.271   2.376  -4.250
  343    H    ALA   5           HN       ALA   5  14.336   0.010  -0.373
  344    HA   ALA   5           HA       ALA   5  12.127  -1.441   0.557
  345    HB1  ALA   5           HB1      ALA   5  13.635  -2.405   2.181
  346    HB2  ALA   5           HB2      ALA   5  14.766  -1.065   1.986
  347    HB3  ALA   5           HB3      ALA   5  14.506  -2.200   0.660
  348    H    GLU   6           HN       GLU   6  13.482   1.584   1.589
  349    HA   GLU   6           HA       GLU   6  12.525   1.693   4.229
  350    HB2  GLU   6           HB2      GLU   6  12.988   3.888   2.195
  351    HB3  GLU   6           HB1      GLU   6  12.623   4.188   3.895
  352    HG2  GLU   6           HG2      GLU   6  14.954   2.511   2.925
  353    HG3  GLU   6           HG1      GLU   6  15.080   4.208   3.390
  354    H    GLU   7           HN       GLU   7  10.965   2.417   1.151
  355    HA   GLU   7           HA       GLU   7   8.628   3.612   2.179
  356    HB2  GLU   7           HB2      GLU   7   9.249   3.725  -0.205
  357    HB3  GLU   7           HB1      GLU   7   8.983   1.988  -0.355
  358    HG2  GLU   7           HG2      GLU   7   7.008   3.215  -1.137
  359    HG3  GLU   7           HG1      GLU   7   6.608   2.304   0.307
  360    H    ILE   8           HN       ILE   8   9.497   0.252   1.572
  361    HA   ILE   8           HA       ILE   8   6.961  -0.907   2.029
  362    HB   ILE   8           HB       ILE   8   9.774  -1.969   2.278
  363   HG12  ILE   8          HG12      ILE   8   9.119  -3.210   0.272
  364   HG13  ILE   8          HG11      ILE   8   7.495  -2.544   0.360
  365   HG21  ILE   8          HG21      ILE   8   7.138  -3.288   2.921
  366   HG22  ILE   8          HG22      ILE   8   8.641  -3.313   3.845
  367   HG23  ILE   8          HG23      ILE   8   8.507  -4.240   2.353
  368   HD11  ILE   8          HD11      ILE   8   9.922  -0.762   0.199
  369   HD12  ILE   8          HD12      ILE   8   8.238  -0.377  -0.190
  370   HD13  ILE   8          HD13      ILE   8   9.176  -1.420  -1.250
  371    H    THR   9           HN       THR   9   9.655  -0.158   4.207
  372    HA   THR   9           HA       THR   9   8.579  -1.307   6.549
  373    HB   THR   9           HB       THR   9  10.415   1.081   6.239
  374    HG1  THR   9           HG1      THR   9  10.978  -1.120   5.426
  375   HG21  THR   9          HG21      THR   9   9.645  -0.619   8.617
  376   HG22  THR   9          HG22      THR   9   9.498   1.131   8.451
  377   HG23  THR   9          HG23      THR   9  11.092   0.388   8.589
  378    H    ARG  10           HN       ARG  10   8.248   1.933   5.138
  379    HA   ARG  10           HA       ARG  10   6.740   3.090   7.233
  380    HB2  ARG  10           HB2      ARG  10   7.818   4.398   5.427
  381    HB3  ARG  10           HB1      ARG  10   6.653   3.739   4.278
  382    HG2  ARG  10           HG2      ARG  10   4.811   4.754   5.477
  383    HG3  ARG  10           HG1      ARG  10   5.885   5.291   6.765
  384    HD2  ARG  10           HD2      ARG  10   5.481   7.179   5.313
  385    HD3  ARG  10           HD1      ARG  10   7.137   6.639   5.050
  386    HE   ARG  10           HE       ARG  10   5.468   5.323   3.193
  387   HH11  ARG  10          HH11      ARG  10   5.380   6.100   1.064
  388   HH12  ARG  10          HH12      ARG  10   5.867   7.720   0.714
  389   HH21  ARG  10          HH21      ARG  10   6.647   8.478   4.006
  390   HH22  ARG  10          HH22      ARG  10   6.583   9.068   2.379
  391    H    CYS  11           HN       CYS  11   5.803   1.288   4.327
  392    HA   CYS  11           HA       CYS  11   3.013   1.617   4.553
  393    HB2  CYS  11           HB2      CYS  11   4.851  -0.220   3.137
  394    HB3  CYS  11           HB1      CYS  11   3.213  -0.822   3.399
  395    H    LYS  12           HN       LYS  12   5.222  -0.761   5.951
  396    HA   LYS  12           HA       LYS  12   3.309  -2.503   7.049
  397    HB2  LYS  12           HB2      LYS  12   5.742  -2.991   6.907
  398    HB3  LYS  12           HB1      LYS  12   6.028  -1.801   8.178
  399    HG2  LYS  12           HG2      LYS  12   4.624  -3.074   9.731
  400    HG3  LYS  12           HG1      LYS  12   4.257  -4.244   8.462
  401    HD2  LYS  12           HD2      LYS  12   6.643  -4.834   8.304
  402    HD3  LYS  12           HD1      LYS  12   7.022  -3.654   9.560
  403    HE2  LYS  12           HE2      LYS  12   6.863  -5.900  10.536
  404    HE3  LYS  12           HE1      LYS  12   5.553  -4.884  11.137
  405    HZ1  LYS  12           HZ1      LYS  12   5.190  -6.583   8.750
  406    HZ2  LYS  12           HZ2      LYS  12   4.010  -5.935   9.785
  407    HZ3  LYS  12           HZ3      LYS  12   4.989  -7.221  10.308
  408    H    LYS  13           HN       LYS  13   4.845   0.412   8.381
  409    HA   LYS  13           HA       LYS  13   3.637   0.305  10.939
  410    HB2  LYS  13           HB2      LYS  13   4.673   2.636   9.311
  411    HB3  LYS  13           HB1      LYS  13   4.141   2.767  10.988
  412    HG2  LYS  13           HG2      LYS  13   5.807   1.061  11.647
  413    HG3  LYS  13           HG1      LYS  13   6.352   0.960   9.973
  414    HD2  LYS  13           HD2      LYS  13   6.978   3.341  10.017
  415    HD3  LYS  13           HD1      LYS  13   6.424   3.458  11.687
  416    HE2  LYS  13           HE2      LYS  13   8.090   1.774  12.366
  417    HE3  LYS  13           HE1      LYS  13   8.645   1.646  10.697
  418    HZ1  LYS  13           HZ1      LYS  13  10.034   3.289  11.186
  419    HZ2  LYS  13           HZ2      LYS  13   9.270   3.612  12.669
  420    HZ3  LYS  13           HZ3      LYS  13   8.692   4.324  11.238
  421    H    LEU  14           HN       LEU  14   2.617   1.734   7.860
  422    HA   LEU  14           HA       LEU  14   0.351   3.104   8.832
  423    HB2  LEU  14           HB2      LEU  14   1.142   1.999   6.140
  424    HB3  LEU  14           HB1      LEU  14  -0.438   2.750   6.363
  425    HG   LEU  14           HG       LEU  14   2.031   4.205   7.316
  426   HD11  LEU  14          HD11      LEU  14   2.714   3.817   5.107
  427   HD12  LEU  14          HD12      LEU  14   1.881   5.356   4.984
  428   HD13  LEU  14          HD13      LEU  14   1.074   3.873   4.470
  429   HD21  LEU  14          HD21      LEU  14  -0.431   4.903   7.749
  430   HD22  LEU  14          HD22      LEU  14  -0.504   5.257   6.031
  431   HD23  LEU  14          HD23      LEU  14   0.633   6.123   7.066
  432    H    LEU  15           HN       LEU  15   0.768  -0.193   7.599
  433    HA   LEU  15           HA       LEU  15  -1.962  -0.927   7.656
  434    HB2  LEU  15           HB2      LEU  15   0.563  -2.580   7.953
  435    HB3  LEU  15           HB1      LEU  15  -1.044  -3.270   7.770
  436    HG   LEU  15           HG       LEU  15   0.177  -1.319   5.799
  437   HD11  LEU  15          HD11      LEU  15   1.484  -3.385   5.800
  438   HD12  LEU  15          HD12      LEU  15   0.482  -3.323   4.350
  439   HD13  LEU  15          HD13      LEU  15   0.006  -4.344   5.707
  440   HD21  LEU  15          HD21      LEU  15  -2.409  -2.843   5.982
  441   HD22  LEU  15          HD22      LEU  15  -1.700  -2.589   4.392
  442   HD23  LEU  15          HD23      LEU  15  -2.102  -1.209   5.396
  443    H    ASP  16           HN       ASP  16   0.597  -1.148  10.097
  444    HA   ASP  16           HA       ASP  16  -1.040  -2.431  12.066
  445    HB2  ASP  16           HB2      ASP  16   1.564  -0.912  12.238
  446    HB3  ASP  16           HB1      ASP  16   0.788  -1.661  13.634
  447    H    ASP  17           HN       ASP  17  -0.167   0.918  11.349
  448    HA   ASP  17           HA       ASP  17  -1.426   2.056  13.633
  449    HB2  ASP  17           HB2      ASP  17  -0.565   3.217  10.986
  450    HB3  ASP  17           HB1      ASP  17  -1.288   4.188  12.267
  451    H    SER  18           HN       SER  18  -2.667   0.614  10.858
  452    HA   SER  18           HA       SER  18  -4.881   2.183  10.230
  453    HB2  SER  18           HB2      SER  18  -5.840   0.169   9.259
  454    HB3  SER  18           HB1      SER  18  -4.111   0.195   8.931
  455    HG   SER  18           HG       SER  18  -4.582  -1.815   9.719
  456    H    SER  19           HN       SER  19  -4.248   0.253  12.985
  457    HA   SER  19           HA       SER  19  -7.025   0.034  13.799
  458    HB2  SER  19           HB2      SER  19  -4.450  -0.621  15.224
  459    HB3  SER  19           HB1      SER  19  -6.049  -0.899  15.908
  460    HG   SER  19           HG       SER  19  -6.181  -2.623  14.726
  461    H    SER  20           HN       SER  20  -4.644   2.388  13.944
  462    HA   SER  20           HA       SER  20  -5.446   3.607  16.437
  463    HB2  SER  20           HB2      SER  20  -3.786   4.780  14.197
  464    HB3  SER  20           HB1      SER  20  -3.906   5.388  15.845
  465    HG   SER  20           HG       SER  20  -3.135   3.223  16.462
  466    H2   ZBR 100           HA3      TBS 100  -1.826   0.360  -1.656
  467    H4   ZBR 100           HC3      TBS 100   0.630   0.629   1.898
  468    H6   ZBR 100           HB3      TBS 100   2.369  -0.689  -1.836
  469    H7   ZBR 100          HB11      TBS 100  -0.713   0.112  -3.783
  470    H7A  ZBR 100          HB12      TBS 100  -0.226  -1.545  -3.466
  471    H8   ZBR 100          HA11      TBS 100  -1.550   1.625   1.838
  472    H8A  ZBR 100          HA12      TBS 100  -2.397   0.148   1.418
  473    H9   ZBR 100          HC11      TBS 100   3.769  -0.143   0.019
  474    H9A  ZBR 100          HC12      TBS 100   3.024  -1.183   1.221
  Start of MODEL   19
    1    H1   LYS   1           HN       LYS   1  -5.899   5.746  17.034
    2    HA   LYS   1           HA       LYS   1  -8.150   6.162  15.280
    3    HB2  LYS   1           HB2      LYS   1  -7.227   7.666  17.741
    4    HB3  LYS   1           HB1      LYS   1  -8.754   7.946  16.905
    5    HG2  LYS   1           HG2      LYS   1  -9.415   5.610  17.316
    6    HG3  LYS   1           HG1      LYS   1  -7.889   5.321  18.151
    7    HD2  LYS   1           HD2      LYS   1  -8.483   7.110  19.784
    8    HD3  LYS   1           HD1      LYS   1 -10.046   7.281  18.985
    9    HE2  LYS   1           HE2      LYS   1  -9.006   4.725  20.240
   10    HE3  LYS   1           HE1      LYS   1 -10.185   5.807  20.979
   11    HZ1  LYS   1           HZ1      LYS   1 -10.951   3.758  19.588
   12    HZ2  LYS   1           HZ2      LYS   1 -10.691   4.796  18.270
   13    HZ3  LYS   1           HZ3      LYS   1 -11.795   5.226  19.488
   14    H    ASN   2           HN       ASN   2  -5.140   6.861  14.745
   15    HA   ASN   2           HA       ASN   2  -4.987   9.636  14.337
   16    HB2  ASN   2           HB2      ASN   2  -3.054   9.072  12.878
   17    HB3  ASN   2           HB1      ASN   2  -3.006   8.225  14.419
   18   HD21  ASN   2          HD21      ASN   2  -1.617   7.247  12.121
   19   HD22  ASN   2          HD22      ASN   2  -2.346   5.792  11.636
   20    HA   PRO   3           HA       PRO   3  -7.447  10.296  10.708
   21    HB2  PRO   3           HB2      PRO   3  -6.027  12.301   9.441
   22    HB3  PRO   3           HB1      PRO   3  -7.046  12.567  10.871
   23    HG2  PRO   3           HG2      PRO   3  -4.084  12.181  10.713
   24    HG3  PRO   3           HG1      PRO   3  -5.016  13.354  11.663
   25    HD2  PRO   3           HD2      PRO   3  -4.023  11.129  12.802
   26    HD3  PRO   3           HD1      PRO   3  -5.603  11.778  13.286
   27    H    GLU   4           HN       GLU   4  -4.123   9.380  10.473
   28    HA   GLU   4           HA       GLU   4  -3.876   9.108   7.668
   29    HB2  GLU   4           HB2      GLU   4  -2.491   7.669   9.938
   30    HB3  GLU   4           HB1      GLU   4  -2.048   7.481   8.239
   31    HG2  GLU   4           HG2      GLU   4  -1.620   9.888   8.061
   32    HG3  GLU   4           HG1      GLU   4  -2.108  10.113   9.740
   33    H    ALA   5           HN       ALA   5  -5.731   7.388   9.928
   34    HA   ALA   5           HA       ALA   5  -5.745   4.782   8.907
   35    HB1  ALA   5           HB1      ALA   5  -6.817   5.524  11.043
   36    HB2  ALA   5           HB2      ALA   5  -7.869   4.524  10.038
   37    HB3  ALA   5           HB3      ALA   5  -8.098   6.272  10.090
   38    H    GLU   6           HN       GLU   6  -7.177   7.717   7.695
   39    HA   GLU   6           HA       GLU   6  -9.167   6.627   6.021
   40    HB2  GLU   6           HB2      GLU   6  -7.499   9.140   5.749
   41    HB3  GLU   6           HB1      GLU   6  -8.887   8.763   4.728
   42    HG2  GLU   6           HG2      GLU   6  -8.996   8.933   7.753
   43    HG3  GLU   6           HG1      GLU   6  -9.453  10.248   6.672
   44    H    GLU   7           HN       GLU   7  -5.703   7.152   5.539
   45    HA   GLU   7           HA       GLU   7  -5.607   6.526   2.782
   46    HB2  GLU   7           HB2      GLU   7  -3.548   6.405   4.989
   47    HB3  GLU   7           HB1      GLU   7  -3.163   5.958   3.326
   48    HG2  GLU   7           HG2      GLU   7  -4.397   8.617   4.099
   49    HG3  GLU   7           HG1      GLU   7  -2.662   8.370   3.898
   50    H    ILE   8           HN       ILE   8  -5.461   4.512   5.675
   51    HA   ILE   8           HA       ILE   8  -4.734   2.080   4.410
   52    HB   ILE   8           HB       ILE   8  -6.195   2.759   6.966
   53   HG12  ILE   8          HG12      ILE   8  -4.160   1.914   7.996
   54   HG13  ILE   8          HG11      ILE   8  -3.544   1.384   6.434
   55   HG21  ILE   8          HG21      ILE   8  -5.707   0.040   5.744
   56   HG22  ILE   8          HG22      ILE   8  -7.199   0.677   6.431
   57   HG23  ILE   8          HG23      ILE   8  -5.853   0.253   7.489
   58   HD11  ILE   8          HD11      ILE   8  -4.248   4.267   6.982
   59   HD12  ILE   8          HD12      ILE   8  -3.247   3.619   5.681
   60   HD13  ILE   8          HD13      ILE   8  -2.652   3.615   7.341
   61    H    THR   9           HN       THR   9  -7.908   3.545   5.130
   62    HA   THR   9           HA       THR   9  -9.485   1.422   4.134
   63    HB   THR   9           HB       THR   9 -10.093   4.386   4.243
   64    HG1  THR   9           HG1      THR   9 -10.512   4.020   6.263
   65   HG21  THR   9          HG21      THR   9 -11.798   1.946   3.732
   66   HG22  THR   9          HG22      THR   9 -11.686   3.420   2.771
   67   HG23  THR   9          HG23      THR   9 -12.485   3.450   4.342
   68    H    ARG  10           HN       ARG  10  -8.154   4.323   2.591
   69    HA   ARG  10           HA       ARG  10  -9.327   3.917   0.046
   70    HB2  ARG  10           HB2      ARG  10  -8.334   6.065   0.765
   71    HB3  ARG  10           HB1      ARG  10  -6.734   5.325   0.727
   72    HG2  ARG  10           HG2      ARG  10  -6.904   4.924  -1.653
   73    HG3  ARG  10           HG1      ARG  10  -8.590   5.441  -1.666
   74    HD2  ARG  10           HD2      ARG  10  -7.197   7.267  -2.482
   75    HD3  ARG  10           HD1      ARG  10  -7.872   7.704  -0.917
   76    HE   ARG  10           HE       ARG  10  -5.719   7.601   0.007
   77   HH11  ARG  10          HH11      ARG  10  -3.466   7.552  -0.215
   78   HH12  ARG  10          HH12      ARG  10  -2.756   7.020  -1.702
   79   HH21  ARG  10          HH21      ARG  10  -5.799   6.431  -3.251
   80   HH22  ARG  10          HH22      ARG  10  -4.077   6.386  -3.419
   81    H    CYS  11           HN       CYS  11  -6.291   2.860   1.497
   82    HA   CYS  11           HA       CYS  11  -5.019   1.749  -0.709
   83    HB2  CYS  11           HB2      CYS  11  -4.170   1.975   1.695
   84    HB3  CYS  11           HB1      CYS  11  -5.030   0.472   2.019
   85    H    LYS  12           HN       LYS  12  -7.402   0.264   1.478
   86    HA   LYS  12           HA       LYS  12  -7.353  -2.275   0.289
   87    HB2  LYS  12           HB2      LYS  12  -8.373  -1.806   2.501
   88    HB3  LYS  12           HB1      LYS  12  -9.657  -0.909   1.701
   89    HG2  LYS  12           HG2      LYS  12 -10.500  -3.120   2.183
   90    HG3  LYS  12           HG1      LYS  12 -10.252  -3.020   0.444
   91    HD2  LYS  12           HD2      LYS  12  -8.182  -4.272   0.604
   92    HD3  LYS  12           HD1      LYS  12  -8.223  -4.200   2.364
   93    HE2  LYS  12           HE2      LYS  12 -10.294  -5.547   2.353
   94    HE3  LYS  12           HE1      LYS  12 -10.236  -5.610   0.590
   95    HZ1  LYS  12           HZ1      LYS  12  -8.828  -7.294   0.715
   96    HZ2  LYS  12           HZ2      LYS  12  -8.922  -7.263   2.411
   97    HZ3  LYS  12           HZ3      LYS  12  -7.733  -6.354   1.606
   98    H    LYS  13           HN       LYS  13  -9.326   0.580  -0.329
   99    HA   LYS  13           HA       LYS  13 -11.029  -0.548  -2.272
  100    HB2  LYS  13           HB2      LYS  13 -10.084   2.290  -1.843
  101    HB3  LYS  13           HB1      LYS  13 -11.323   1.849  -3.013
  102    HG2  LYS  13           HG2      LYS  13 -11.508   1.195  -0.057
  103    HG3  LYS  13           HG1      LYS  13 -12.209   2.643  -0.775
  104    HD2  LYS  13           HD2      LYS  13 -13.426   1.023  -2.393
  105    HD3  LYS  13           HD1      LYS  13 -12.977  -0.243  -1.254
  106    HE2  LYS  13           HE2      LYS  13 -14.492   2.260  -0.476
  107    HE3  LYS  13           HE1      LYS  13 -15.246   0.700  -0.805
  108    HZ1  LYS  13           HZ1      LYS  13 -13.536  -0.143   0.924
  109    HZ2  LYS  13           HZ2      LYS  13 -14.952   0.629   1.457
  110    HZ3  LYS  13           HZ3      LYS  13 -13.482   1.478   1.416
  111    H    LEU  14           HN       LEU  14  -7.856   0.961  -2.522
  112    HA   LEU  14           HA       LEU  14  -7.710   1.077  -5.335
  113    HB2  LEU  14           HB2      LEU  14  -5.604   0.817  -3.184
  114    HB3  LEU  14           HB1      LEU  14  -5.200   1.019  -4.883
  115    HG   LEU  14           HG       LEU  14  -7.015   2.940  -3.386
  116   HD11  LEU  14          HD11      LEU  14  -4.038   2.729  -3.405
  117   HD12  LEU  14          HD12      LEU  14  -5.114   3.476  -2.227
  118   HD13  LEU  14          HD13      LEU  14  -4.689   4.342  -3.694
  119   HD21  LEU  14          HD21      LEU  14  -7.326   3.308  -5.688
  120   HD22  LEU  14          HD22      LEU  14  -5.654   2.903  -6.083
  121   HD23  LEU  14          HD23      LEU  14  -6.032   4.442  -5.311
  122    H    LEU  15           HN       LEU  15  -6.817  -1.477  -3.032
  123    HA   LEU  15           HA       LEU  15  -5.686  -3.238  -4.940
  124    HB2  LEU  15           HB2      LEU  15  -6.966  -3.744  -2.247
  125    HB3  LEU  15           HB1      LEU  15  -6.112  -4.976  -3.175
  126    HG   LEU  15           HG       LEU  15  -4.889  -2.334  -2.325
  127   HD11  LEU  15          HD11      LEU  15  -3.723  -3.603  -0.597
  128   HD12  LEU  15          HD12      LEU  15  -4.520  -5.088  -1.119
  129   HD13  LEU  15          HD13      LEU  15  -5.466  -3.788  -0.395
  130   HD21  LEU  15          HD21      LEU  15  -3.891  -4.742  -3.832
  131   HD22  LEU  15          HD22      LEU  15  -2.767  -3.883  -2.778
  132   HD23  LEU  15          HD23      LEU  15  -3.553  -3.031  -4.099
  133    H    ASP  16           HN       ASP  16  -8.972  -2.869  -3.678
  134    HA   ASP  16           HA       ASP  16 -10.127  -5.098  -4.988
  135    HB2  ASP  16           HB2      ASP  16 -11.294  -2.513  -3.953
  136    HB3  ASP  16           HB1      ASP  16 -12.283  -3.789  -4.662
  137    H    ASP  17           HN       ASP  17  -9.581  -1.772  -5.969
  138    HA   ASP  17           HA       ASP  17 -11.116  -1.802  -8.342
  139    HB2  ASP  17           HB2      ASP  17  -8.744  -0.143  -7.485
  140    HB3  ASP  17           HB1      ASP  17  -9.598   0.116  -9.005
  141    H    SER  18           HN       SER  18  -8.324  -3.493  -7.544
  142    HA   SER  18           HA       SER  18  -6.813  -3.421  -9.884
  143    HB2  SER  18           HB2      SER  18  -5.867  -5.533  -9.147
  144    HB3  SER  18           HB1      SER  18  -6.122  -4.501  -7.740
  145    HG   SER  18           HG       SER  18  -7.927  -5.650  -7.226
  146    H    SER  19           HN       SER  19  -9.836  -4.868  -9.231
  147    HA   SER  19           HA       SER  19  -9.748  -6.685 -11.497
  148    HB2  SER  19           HB2      SER  19 -12.006  -5.941  -9.631
  149    HB3  SER  19           HB1      SER  19 -12.108  -7.169 -10.890
  150    HG   SER  19           HG       SER  19 -10.594  -8.371  -9.827
  151    H    SER  20           HN       SER  20 -10.411  -3.449 -10.979
  152    HA   SER  20           HA       SER  20 -12.372  -3.107 -13.077
  153    HB2  SER  20           HB2      SER  20 -12.289  -1.588 -11.118
  154    HB3  SER  20           HB1      SER  20 -10.707  -1.020 -11.648
  155    HG   SER  20           HG       SER  20 -13.009  -0.080 -12.374
  156    H1   LYS   1           HN       LYS   1 -12.038  -2.135 -15.080
  157    HA   LYS   1           HA       LYS   1  -9.474  -2.693 -16.284
  158    HB2  LYS   1           HB2      LYS   1 -11.984  -1.432 -17.412
  159    HB3  LYS   1           HB1      LYS   1 -10.567  -1.887 -18.360
  160    HG2  LYS   1           HG2      LYS   1 -10.828  -4.228 -17.638
  161    HG3  LYS   1           HG1      LYS   1 -12.245  -3.780 -16.689
  162    HD2  LYS   1           HD2      LYS   1 -13.342  -2.967 -18.778
  163    HD3  LYS   1           HD1      LYS   1 -11.951  -3.545 -19.698
  164    HE2  LYS   1           HE2      LYS   1 -13.713  -5.278 -17.939
  165    HE3  LYS   1           HE1      LYS   1 -13.809  -5.194 -19.698
  166    HZ1  LYS   1           HZ1      LYS   1 -12.374  -7.010 -18.513
  167    HZ2  LYS   1           HZ2      LYS   1 -11.213  -5.771 -18.463
  168    HZ3  LYS   1           HZ3      LYS   1 -11.842  -6.289 -19.953
  169    H    ASN   2           HN       ASN   2 -10.212  -0.374 -14.294
  170    HA   ASN   2           HA       ASN   2  -9.703   2.049 -15.629
  171    HB2  ASN   2           HB2      ASN   2  -9.262   2.933 -13.351
  172    HB3  ASN   2           HB1      ASN   2 -10.729   1.968 -13.421
  173   HD21  ASN   2          HD21      ASN   2  -9.314   2.394 -10.972
  174   HD22  ASN   2          HD22      ASN   2  -8.670   0.908 -10.463
  175    HA   PRO   3           HA       PRO   3  -5.332   1.917 -16.372
  176    HB2  PRO   3           HB2      PRO   3  -4.637   4.569 -16.024
  177    HB3  PRO   3           HB1      PRO   3  -5.479   3.952 -17.460
  178    HG2  PRO   3           HG2      PRO   3  -6.614   5.302 -15.044
  179    HG3  PRO   3           HG1      PRO   3  -6.989   5.564 -16.758
  180    HD2  PRO   3           HD2      PRO   3  -8.608   4.086 -15.200
  181    HD3  PRO   3           HD1      PRO   3  -8.328   3.653 -16.899
  182    H    GLU   4           HN       GLU   4  -6.598   3.049 -13.362
  183    HA   GLU   4           HA       GLU   4  -4.192   3.504 -11.945
  184    HB2  GLU   4           HB2      GLU   4  -6.934   2.661 -10.995
  185    HB3  GLU   4           HB1      GLU   4  -5.607   3.083  -9.911
  186    HG2  GLU   4           HG2      GLU   4  -5.452   5.307 -10.933
  187    HG3  GLU   4           HG1      GLU   4  -6.740   4.892 -12.063
  188    H    ALA   5           HN       ALA   5  -5.577   0.652 -13.152
  189    HA   ALA   5           HA       ALA   5  -4.844  -1.278 -11.262
  190    HB1  ALA   5           HB1      ALA   5  -6.268  -1.676 -13.277
  191    HB2  ALA   5           HB2      ALA   5  -4.988  -2.874 -13.079
  192    HB3  ALA   5           HB3      ALA   5  -4.815  -1.588 -14.273
  193    H    GLU   6           HN       GLU   6  -2.921   0.542 -13.525
  194    HA   GLU   6           HA       GLU   6  -0.654  -1.127 -13.682
  195    HB2  GLU   6           HB2      GLU   6  -0.924   1.885 -13.838
  196    HB3  GLU   6           HB1      GLU   6   0.559   1.010 -14.217
  197    HG2  GLU   6           HG2      GLU   6  -2.107   0.494 -15.565
  198    HG3  GLU   6           HG1      GLU   6  -0.845   1.526 -16.237
  199    H    GLU   7           HN       GLU   7  -1.639   1.305 -11.312
  200    HA   GLU   7           HA       GLU   7   0.762   1.368  -9.818
  201    HB2  GLU   7           HB2      GLU   7  -2.110   1.988  -9.116
  202    HB3  GLU   7           HB1      GLU   7  -0.802   2.154  -7.944
  203    HG2  GLU   7           HG2      GLU   7  -0.781   3.483 -10.667
  204    HG3  GLU   7           HG1      GLU   7  -1.347   4.281  -9.198
  205    H    ILE   8           HN       ILE   8  -2.070  -0.732  -9.663
  206    HA   ILE   8           HA       ILE   8  -1.423  -2.067  -7.247
  207    HB   ILE   8           HB       ILE   8  -3.062  -2.808  -9.675
  208   HG12  ILE   8          HG12      ILE   8  -4.916  -2.568  -8.116
  209   HG13  ILE   8          HG11      ILE   8  -3.803  -2.353  -6.767
  210   HG21  ILE   8          HG21      ILE   8  -2.368  -4.511  -7.276
  211   HG22  ILE   8          HG22      ILE   8  -2.307  -4.949  -8.982
  212   HG23  ILE   8          HG23      ILE   8  -3.862  -4.754  -8.179
  213   HD11  ILE   8          HD11      ILE   8  -3.784  -0.515  -9.161
  214   HD12  ILE   8          HD12      ILE   8  -3.088  -0.233  -7.565
  215   HD13  ILE   8          HD13      ILE   8  -4.838  -0.227  -7.781
  216    H    THR   9           HN       THR   9  -0.616  -2.762 -10.652
  217    HA   THR   9           HA       THR   9   0.784  -5.171 -10.177
  218    HB   THR   9           HB       THR   9   1.171  -3.114 -12.366
  219    HG1  THR   9           HG1      THR   9  -0.496  -4.030 -13.248
  220   HG21  THR   9          HG21      THR   9   2.170  -5.939 -11.987
  221   HG22  THR   9          HG22      THR   9   3.100  -4.496 -12.393
  222   HG23  THR   9          HG23      THR   9   2.018  -5.214 -13.587
  223    H    ARG  10           HN       ARG  10   1.837  -1.789 -10.301
  224    HA   ARG  10           HA       ARG  10   4.599  -2.283  -9.928
  225    HB2  ARG  10           HB2      ARG  10   3.691  -0.128 -10.733
  226    HB3  ARG  10           HB1      ARG  10   2.993   0.159  -9.140
  227    HG2  ARG  10           HG2      ARG  10   5.183   0.194  -8.114
  228    HG3  ARG  10           HG1      ARG  10   5.948  -0.315  -9.621
  229    HD2  ARG  10           HD2      ARG  10   6.234   2.090  -9.365
  230    HD3  ARG  10           HD1      ARG  10   5.134   1.777 -10.701
  231    HE   ARG  10           HE       ARG  10   3.387   2.704  -9.441
  232   HH11  ARG  10          HH11      ARG  10   2.636   3.943  -7.703
  233   HH12  ARG  10          HH12      ARG  10   3.642   4.186  -6.316
  234   HH21  ARG  10          HH21      ARG  10   6.284   2.335  -7.580
  235   HH22  ARG  10          HH22      ARG  10   5.706   3.277  -6.247
  236    H    CYS  11           HN       CYS  11   1.924  -1.741  -7.694
  237    HA   CYS  11           HA       CYS  11   3.293  -1.525  -5.285
  238    HB2  CYS  11           HB2      CYS  11   0.779  -1.334  -5.731
  239    HB3  CYS  11           HB1      CYS  11   0.739  -3.092  -5.604
  240    H    LYS  12           HN       LYS  12   2.216  -4.463  -6.984
  241    HA   LYS  12           HA       LYS  12   3.082  -6.273  -5.025
  242    HB2  LYS  12           HB2      LYS  12   1.554  -6.876  -6.885
  243    HB3  LYS  12           HB1      LYS  12   2.889  -6.700  -8.016
  244    HG2  LYS  12           HG2      LYS  12   2.642  -9.053  -7.530
  245    HG3  LYS  12           HG1      LYS  12   4.117  -8.504  -6.742
  246    HD2  LYS  12           HD2      LYS  12   3.004  -8.412  -4.589
  247    HD3  LYS  12           HD1      LYS  12   1.436  -8.708  -5.336
  248    HE2  LYS  12           HE2      LYS  12   2.217 -10.943  -6.045
  249    HE3  LYS  12           HE1      LYS  12   3.782 -10.630  -5.291
  250    HZ1  LYS  12           HZ1      LYS  12   2.950 -11.253  -3.354
  251    HZ2  LYS  12           HZ2      LYS  12   1.453 -11.587  -4.087
  252    HZ3  LYS  12           HZ3      LYS  12   1.761 -10.045  -3.444
  253    H    LYS  13           HN       LYS  13   4.689  -4.920  -7.860
  254    HA   LYS  13           HA       LYS  13   7.078  -6.406  -7.684
  255    HB2  LYS  13           HB2      LYS  13   6.510  -3.661  -8.813
  256    HB3  LYS  13           HB1      LYS  13   8.055  -4.483  -8.997
  257    HG2  LYS  13           HG2      LYS  13   5.413  -5.675  -9.891
  258    HG3  LYS  13           HG1      LYS  13   6.469  -4.751 -10.956
  259    HD2  LYS  13           HD2      LYS  13   8.318  -6.434 -10.268
  260    HD3  LYS  13           HD1      LYS  13   7.001  -7.428  -9.652
  261    HE2  LYS  13           HE2      LYS  13   7.134  -6.380 -12.489
  262    HE3  LYS  13           HE1      LYS  13   7.629  -8.000 -12.003
  263    HZ1  LYS  13           HZ1      LYS  13   5.281  -8.070 -10.953
  264    HZ2  LYS  13           HZ2      LYS  13   5.458  -8.327 -12.623
  265    HZ3  LYS  13           HZ3      LYS  13   4.938  -6.817 -12.043
  266    H    LEU  14           HN       LEU  14   6.077  -3.387  -6.177
  267    HA   LEU  14           HA       LEU  14   8.562  -2.672  -5.055
  268    HB2  LEU  14           HB2      LEU  14   5.706  -2.139  -4.221
  269    HB3  LEU  14           HB1      LEU  14   7.083  -1.428  -3.389
  270    HG   LEU  14           HG       LEU  14   6.652  -1.146  -6.381
  271   HD11  LEU  14          HD11      LEU  14   5.383   0.320  -4.111
  272   HD12  LEU  14          HD12      LEU  14   4.832   0.106  -5.770
  273   HD13  LEU  14          HD13      LEU  14   6.036   1.328  -5.401
  274   HD21  LEU  14          HD21      LEU  14   8.886  -0.574  -5.914
  275   HD22  LEU  14          HD22      LEU  14   8.488   0.094  -4.329
  276   HD23  LEU  14          HD23      LEU  14   8.074   0.983  -5.795
  277    H    LEU  15           HN       LEU  15   5.914  -4.699  -3.826
  278    HA   LEU  15           HA       LEU  15   7.029  -5.142  -1.259
  279    HB2  LEU  15           HB2      LEU  15   5.095  -6.768  -2.921
  280    HB3  LEU  15           HB1      LEU  15   5.481  -7.123  -1.237
  281    HG   LEU  15           HG       LEU  15   4.398  -4.460  -2.210
  282   HD11  LEU  15          HD11      LEU  15   2.247  -5.180  -1.297
  283   HD12  LEU  15          HD12      LEU  15   2.944  -6.732  -0.830
  284   HD13  LEU  15          HD13      LEU  15   2.783  -6.315  -2.536
  285   HD21  LEU  15          HD21      LEU  15   5.136  -5.592   0.482
  286   HD22  LEU  15          HD22      LEU  15   3.787  -4.459   0.381
  287   HD23  LEU  15          HD23      LEU  15   5.386  -3.966  -0.158
  288    H    ASP  16           HN       ASP  16   7.305  -6.891  -4.322
  289    HA   ASP  16           HA       ASP  16   8.804  -9.092  -3.362
  290    HB2  ASP  16           HB2      ASP  16   8.562  -7.829  -6.094
  291    HB3  ASP  16           HB1      ASP  16   9.522  -9.278  -5.794
  292    H    ASP  17           HN       ASP  17   9.713  -5.904  -4.510
  293    HA   ASP  17           HA       ASP  17  12.503  -6.320  -4.681
  294    HB2  ASP  17           HB2      ASP  17  10.849  -3.829  -4.266
  295    HB3  ASP  17           HB1      ASP  17  12.602  -3.799  -4.446
  296    H    SER  18           HN       SER  18  10.476  -6.314  -2.000
  297    HA   SER  18           HA       SER  18  11.951  -4.965  -0.058
  298    HB2  SER  18           HB2      SER  18  10.736  -6.298   1.566
  299    HB3  SER  18           HB1      SER  18   9.648  -5.889   0.242
  300    HG   SER  18           HG       SER  18   9.873  -7.916  -0.573
  301    H    SER  19           HN       SER  19  12.541  -7.932  -1.642
  302    HA   SER  19           HA       SER  19  14.421  -8.915   0.343
  303    HB2  SER  19           HB2      SER  19  13.736  -9.921  -2.422
  304    HB3  SER  19           HB1      SER  19  14.841 -10.725  -1.311
  305    HG   SER  19           HG       SER  19  13.169 -11.085   0.079
  306    H    SER  20           HN       SER  20  14.466  -6.759  -2.214
  307    HA   SER  20           HA       SER  20  17.220  -7.149  -3.010
  308    HB2  SER  20           HB2      SER  20  15.522  -6.265  -4.591
  309    HB3  SER  20           HB1      SER  20  15.365  -4.826  -3.587
  310    HG   SER  20           HG       SER  20  17.067  -5.185  -5.503
  311    H1   LYS   1           HN       LYS   1  18.937  -5.711  -2.617
  312    HA   LYS   1           HA       LYS   1  18.897  -4.518   0.019
  313    HB2  LYS   1           HB2      LYS   1  21.064  -4.645  -2.091
  314    HB3  LYS   1           HB1      LYS   1  21.286  -4.037  -0.449
  315    HG2  LYS   1           HG2      LYS   1  20.606  -6.225   0.458
  316    HG3  LYS   1           HG1      LYS   1  20.385  -6.838  -1.180
  317    HD2  LYS   1           HD2      LYS   1  22.786  -6.350  -1.649
  318    HD3  LYS   1           HD1      LYS   1  22.985  -5.860   0.034
  319    HE2  LYS   1           HE2      LYS   1  22.052  -8.597  -0.882
  320    HE3  LYS   1           HE1      LYS   1  23.683  -8.216  -0.330
  321    HZ1  LYS   1           HZ1      LYS   1  21.924  -9.150   1.318
  322    HZ2  LYS   1           HZ2      LYS   1  21.396  -7.538   1.384
  323    HZ3  LYS   1           HZ3      LYS   1  22.991  -7.931   1.817
  324    H    ASN   2           HN       ASN   2  17.555  -3.459  -2.622
  325    HA   ASN   2           HA       ASN   2  18.690  -0.944  -3.169
  326    HB2  ASN   2           HB2      ASN   2  16.498  -0.455  -4.231
  327    HB3  ASN   2           HB1      ASN   2  17.130  -2.029  -4.692
  328   HD21  ASN   2          HD21      ASN   2  14.340  -1.411  -4.852
  329   HD22  ASN   2          HD22      ASN   2  13.519  -2.361  -3.711
  330    HA   PRO   3           HA       PRO   3  17.489   1.517   0.321
  331    HB2  PRO   3           HB2      PRO   3  17.034   3.971  -0.867
  332    HB3  PRO   3           HB1      PRO   3  18.653   3.308  -0.566
  333    HG2  PRO   3           HG2      PRO   3  17.040   3.267  -3.084
  334    HG3  PRO   3           HG1      PRO   3  18.762   3.630  -2.857
  335    HD2  PRO   3           HD2      PRO   3  17.961   1.219  -3.741
  336    HD3  PRO   3           HD1      PRO   3  19.347   1.376  -2.642
  337    H    GLU   4           HN       GLU   4  15.378   1.111  -2.386
  338    HA   GLU   4           HA       GLU   4  13.100   2.508  -1.457
  339    HB2  GLU   4           HB2      GLU   4  13.361   0.122  -3.294
  340    HB3  GLU   4           HB1      GLU   4  11.841   0.967  -2.992
  341    HG2  GLU   4           HG2      GLU   4  12.822   3.065  -3.796
  342    HG3  GLU   4           HG1      GLU   4  14.368   2.259  -4.055
  343    H    ALA   5           HN       ALA   5  14.615  -0.309  -0.327
  344    HA   ALA   5           HA       ALA   5  12.481  -1.862   0.610
  345    HB1  ALA   5           HB1      ALA   5  14.894  -2.537   0.588
  346    HB2  ALA   5           HB2      ALA   5  14.085  -2.860   2.122
  347    HB3  ALA   5           HB3      ALA   5  15.159  -1.469   1.967
  348    H    GLU   6           HN       GLU   6  13.810   1.139   1.781
  349    HA   GLU   6           HA       GLU   6  12.880   1.074   4.441
  350    HB2  GLU   6           HB2      GLU   6  13.312   3.393   2.541
  351    HB3  GLU   6           HB1      GLU   6  12.973   3.580   4.262
  352    HG2  GLU   6           HG2      GLU   6  15.297   1.983   3.150
  353    HG3  GLU   6           HG1      GLU   6  15.421   3.649   3.714
  354    H    GLU   7           HN       GLU   7  11.308   2.005   1.411
  355    HA   GLU   7           HA       GLU   7   8.940   3.071   2.528
  356    HB2  GLU   7           HB2      GLU   7   9.571   1.848  -0.160
  357    HB3  GLU   7           HB1      GLU   7   7.964   2.458   0.236
  358    HG2  GLU   7           HG2      GLU   7  10.491   4.108   0.506
  359    HG3  GLU   7           HG1      GLU   7   9.455   4.139  -0.921
  360    H    ILE   8           HN       ILE   8   9.881  -0.219   1.669
  361    HA   ILE   8           HA       ILE   8   7.343  -1.437   1.998
  362    HB   ILE   8           HB       ILE   8  10.186  -2.440   2.177
  363   HG12  ILE   8          HG12      ILE   8   9.581  -3.590   0.116
  364   HG13  ILE   8          HG11      ILE   8   7.906  -3.070   0.276
  365   HG21  ILE   8          HG21      ILE   8   7.622  -3.928   2.761
  366   HG22  ILE   8          HG22      ILE   8   9.109  -3.899   3.706
  367   HG23  ILE   8          HG23      ILE   8   9.058  -4.762   2.173
  368   HD11  ILE   8          HD11      ILE   8  10.183  -1.098   0.125
  369   HD12  ILE   8          HD12      ILE   8   8.466  -0.801  -0.150
  370   HD13  ILE   8          HD13      ILE   8   9.403  -1.724  -1.324
  371    H    THR   9           HN       THR   9  10.026  -0.857   4.275
  372    HA   THR   9           HA       THR   9   8.850  -2.131   6.506
  373    HB   THR   9           HB       THR   9  10.785   0.198   6.414
  374    HG1  THR   9           HG1      THR   9  12.232  -1.278   6.080
  375   HG21  THR   9          HG21      THR   9   9.844  -1.618   8.636
  376   HG22  THR   9          HG22      THR   9   9.894   0.146   8.614
  377   HG23  THR   9          HG23      THR   9  11.392  -0.779   8.712
  378    H    ARG  10           HN       ARG  10   8.716   1.209   5.331
  379    HA   ARG  10           HA       ARG  10   7.168   2.253   7.457
  380    HB2  ARG  10           HB2      ARG  10   8.414   3.664   5.853
  381    HB3  ARG  10           HB1      ARG  10   7.294   3.185   4.578
  382    HG2  ARG  10           HG2      ARG  10   5.433   4.206   5.743
  383    HG3  ARG  10           HG1      ARG  10   6.437   4.527   7.157
  384    HD2  ARG  10           HD2      ARG  10   6.228   6.577   5.859
  385    HD3  ARG  10           HD1      ARG  10   7.885   5.993   5.760
  386    HE   ARG  10           HE       ARG  10   7.551   5.523   3.486
  387   HH11  ARG  10          HH11      ARG  10   6.376   5.753   1.564
  388   HH12  ARG  10          HH12      ARG  10   4.707   6.214   1.622
  389   HH21  ARG  10          HH21      ARG  10   4.613   6.426   5.079
  390   HH22  ARG  10          HH22      ARG  10   3.711   6.594   3.610
  391    H    CYS  11           HN       CYS  11   6.328   0.759   4.373
  392    HA   CYS  11           HA       CYS  11   3.584   1.191   4.313
  393    HB2  CYS  11           HB2      CYS  11   5.083   0.049   2.574
  394    HB3  CYS  11           HB1      CYS  11   4.861  -1.420   3.520
  395    H    LYS  12           HN       LYS  12   5.397  -1.429   5.903
  396    HA   LYS  12           HA       LYS  12   3.152  -2.821   6.842
  397    HB2  LYS  12           HB2      LYS  12   5.447  -3.764   6.804
  398    HB3  LYS  12           HB1      LYS  12   5.906  -2.653   8.089
  399    HG2  LYS  12           HG2      LYS  12   5.433  -4.793   9.104
  400    HG3  LYS  12           HG1      LYS  12   4.121  -3.701   9.540
  401    HD2  LYS  12           HD2      LYS  12   2.666  -4.689   7.871
  402    HD3  LYS  12           HD1      LYS  12   3.995  -5.635   7.205
  403    HE2  LYS  12           HE2      LYS  12   4.166  -6.863   9.343
  404    HE3  LYS  12           HE1      LYS  12   2.830  -5.907   9.992
  405    HZ1  LYS  12           HZ1      LYS  12   1.404  -7.267   9.016
  406    HZ2  LYS  12           HZ2      LYS  12   2.689  -8.219   8.441
  407    HZ3  LYS  12           HZ3      LYS  12   2.083  -6.943   7.497
  408    H    LYS  13           HN       LYS  13   5.102  -0.256   8.277
  409    HA   LYS  13           HA       LYS  13   3.832  -0.178  10.791
  410    HB2  LYS  13           HB2      LYS  13   5.260   1.962   9.205
  411    HB3  LYS  13           HB1      LYS  13   4.715   2.187  10.864
  412    HG2  LYS  13           HG2      LYS  13   6.581  -0.047  10.004
  413    HG3  LYS  13           HG1      LYS  13   7.143   1.501  10.628
  414    HD2  LYS  13           HD2      LYS  13   5.633   1.013  12.675
  415    HD3  LYS  13           HD1      LYS  13   5.578  -0.643  12.076
  416    HE2  LYS  13           HE2      LYS  13   8.143   0.863  12.639
  417    HE3  LYS  13           HE1      LYS  13   7.396  -0.285  13.750
  418    HZ1  LYS  13           HZ1      LYS  13   7.449  -1.834  11.694
  419    HZ2  LYS  13           HZ2      LYS  13   8.862  -1.608  12.610
  420    HZ3  LYS  13           HZ3      LYS  13   8.657  -0.780  11.141
  421    H    LEU  14           HN       LEU  14   3.085   1.404   7.736
  422    HA   LEU  14           HA       LEU  14   1.052   3.118   8.675
  423    HB2  LEU  14           HB2      LEU  14   1.554   1.805   6.000
  424    HB3  LEU  14           HB1      LEU  14   0.260   2.968   6.255
  425    HG   LEU  14           HG       LEU  14   3.163   3.568   6.915
  426   HD11  LEU  14          HD11      LEU  14   1.747   3.582   4.289
  427   HD12  LEU  14          HD12      LEU  14   3.468   3.463   4.649
  428   HD13  LEU  14          HD13      LEU  14   2.680   5.033   4.656
  429   HD21  LEU  14          HD21      LEU  14   1.832   5.166   8.013
  430   HD22  LEU  14          HD22      LEU  14   0.605   5.167   6.744
  431   HD23  LEU  14          HD23      LEU  14   2.157   5.958   6.474
  432    H    LEU  15           HN       LEU  15   0.953  -0.231   7.490
  433    HA   LEU  15           HA       LEU  15  -1.866  -0.506   7.572
  434    HB2  LEU  15           HB2      LEU  15   0.363  -2.541   7.766
  435    HB3  LEU  15           HB1      LEU  15  -1.340  -2.966   7.611
  436    HG   LEU  15           HG       LEU  15   0.154  -1.201   5.647
  437   HD11  LEU  15          HD11      LEU  15   0.239  -3.145   4.183
  438   HD12  LEU  15          HD12      LEU  15  -0.603  -4.122   5.386
  439   HD13  LEU  15          HD13      LEU  15   1.027  -3.531   5.713
  440   HD21  LEU  15          HD21      LEU  15  -2.653  -2.284   5.813
  441   HD22  LEU  15          HD22      LEU  15  -1.915  -2.080   4.224
  442   HD23  LEU  15          HD23      LEU  15  -2.093  -0.693   5.289
  443    H    ASP  16           HN       ASP  16   0.669  -1.144   9.959
  444    HA   ASP  16           HA       ASP  16  -0.981  -2.297  11.952
  445    HB2  ASP  16           HB2      ASP  16   1.670  -0.855  12.083
  446    HB3  ASP  16           HB1      ASP  16   0.894  -1.558  13.503
  447    H    ASP  17           HN       ASP  17  -0.126   1.019  11.179
  448    HA   ASP  17           HA       ASP  17  -1.186   2.255  13.488
  449    HB2  ASP  17           HB2      ASP  17  -0.703   3.269  10.686
  450    HB3  ASP  17           HB1      ASP  17  -1.289   4.299  11.990
  451    H    SER  18           HN       SER  18  -2.738   0.595  11.009
  452    HA   SER  18           HA       SER  18  -5.044   2.092  10.554
  453    HB2  SER  18           HB2      SER  18  -6.069   0.004   9.847
  454    HB3  SER  18           HB1      SER  18  -4.394   0.028   9.304
  455    HG   SER  18           HG       SER  18  -3.844  -1.329  10.950
  456    H    SER  19           HN       SER  19  -4.034   0.341  13.307
  457    HA   SER  19           HA       SER  19  -6.685   0.151  14.482
  458    HB2  SER  19           HB2      SER  19  -3.952  -0.451  15.619
  459    HB3  SER  19           HB1      SER  19  -5.469  -0.727  16.469
  460    HG   SER  19           HG       SER  19  -6.038  -2.222  14.944
  461    H    SER  20           HN       SER  20  -4.288   2.471  14.225
  462    HA   SER  20           HA       SER  20  -4.780   3.823  16.735
  463    HB2  SER  20           HB2      SER  20  -2.578   3.942  15.585
  464    HB3  SER  20           HB1      SER  20  -3.340   4.830  14.269
  465    HG   SER  20           HG       SER  20  -2.346   5.839  16.434
  466    H2   ZBR 100           HA3      TBS 100  -1.552   0.504  -1.832
  467    H4   ZBR 100           HC3      TBS 100   0.615   1.080   1.865
  468    H6   ZBR 100           HB3      TBS 100   2.667  -0.428  -1.633
  469    H7   ZBR 100          HB11      TBS 100   1.113   0.259  -3.925
  470    H7A  ZBR 100          HB12      TBS 100  -0.494  -0.443  -3.698
  471    H8   ZBR 100          HA11      TBS 100  -2.184   2.259   0.281
  472    H8A  ZBR 100          HA12      TBS 100  -1.686   1.513   1.804
  473    H9   ZBR 100          HC11      TBS 100   3.373   1.239   1.276
  474    H9A  ZBR 100          HC12      TBS 100   3.845  -0.209   0.378
  Start of MODEL   20
    1    H1   LYS   1           HN       LYS   1  -6.249   4.665  17.078
    2    HA   LYS   1           HA       LYS   1  -8.417   5.206  15.258
    3    HB2  LYS   1           HB2      LYS   1  -7.707   6.322  17.976
    4    HB3  LYS   1           HB1      LYS   1  -9.158   6.773  17.079
    5    HG2  LYS   1           HG2      LYS   1  -9.876   4.421  17.031
    6    HG3  LYS   1           HG1      LYS   1  -8.420   3.952  17.908
    7    HD2  LYS   1           HD2      LYS   1  -9.100   5.371  19.808
    8    HD3  LYS   1           HD1      LYS   1 -10.560   5.839  18.935
    9    HE2  LYS   1           HE2      LYS   1 -11.293   3.491  18.876
   10    HE3  LYS   1           HE1      LYS   1  -9.827   3.005  19.730
   11    HZ1  LYS   1           HZ1      LYS   1 -12.030   4.713  20.735
   12    HZ2  LYS   1           HZ2      LYS   1 -10.531   4.580  21.524
   13    HZ3  LYS   1           HZ3      LYS   1 -11.522   3.212  21.338
   14    H    ASN   2           HN       ASN   2  -5.428   6.124  14.987
   15    HA   ASN   2           HA       ASN   2  -5.406   8.928  14.967
   16    HB2  ASN   2           HB2      ASN   2  -3.434   8.653  13.430
   17    HB3  ASN   2           HB1      ASN   2  -3.340   7.678  14.891
   18   HD21  ASN   2          HD21      ASN   2  -1.891   6.995  12.526
   19   HD22  ASN   2          HD22      ASN   2  -2.531   5.548  11.912
   20    HA   PRO   3           HA       PRO   3  -7.791  10.027  11.401
   21    HB2  PRO   3           HB2      PRO   3  -6.343  12.177  10.423
   22    HB3  PRO   3           HB1      PRO   3  -7.412  12.261  11.837
   23    HG2  PRO   3           HG2      PRO   3  -4.442  11.922  11.737
   24    HG3  PRO   3           HG1      PRO   3  -5.424  12.954  12.797
   25    HD2  PRO   3           HD2      PRO   3  -4.440  10.626  13.681
   26    HD3  PRO   3           HD1      PRO   3  -6.049  11.175  14.181
   27    H    GLU   4           HN       GLU   4  -4.459   9.166  11.116
   28    HA   GLU   4           HA       GLU   4  -4.177   9.234   8.297
   29    HB2  GLU   4           HB2      GLU   4  -2.785   7.567  10.399
   30    HB3  GLU   4           HB1      GLU   4  -2.310   7.615   8.701
   31    HG2  GLU   4           HG2      GLU   4  -1.944  10.032   8.844
   32    HG3  GLU   4           HG1      GLU   4  -2.476  10.029  10.525
   33    H    ALA   5           HN       ALA   5  -6.031   7.251  10.325
   34    HA   ALA   5           HA       ALA   5  -5.962   4.761   9.043
   35    HB1  ALA   5           HB1      ALA   5  -7.988   4.276  10.175
   36    HB2  ALA   5           HB2      ALA   5  -8.458   5.975  10.226
   37    HB3  ALA   5           HB3      ALA   5  -7.129   5.397  11.232
   38    H    GLU   6           HN       GLU   6  -7.491   7.765   8.128
   39    HA   GLU   6           HA       GLU   6  -9.389   6.787   6.297
   40    HB2  GLU   6           HB2      GLU   6  -7.841   9.379   6.444
   41    HB3  GLU   6           HB1      GLU   6  -9.081   9.080   5.227
   42    HG2  GLU   6           HG2      GLU   6 -10.204  10.194   7.004
   43    HG3  GLU   6           HG1      GLU   6 -10.642   8.500   7.177
   44    H    GLU   7           HN       GLU   7  -5.939   7.483   5.977
   45    HA   GLU   7           HA       GLU   7  -5.774   7.211   3.173
   46    HB2  GLU   7           HB2      GLU   7  -3.960   8.207   4.503
   47    HB3  GLU   7           HB1      GLU   7  -3.659   6.648   5.270
   48    HG2  GLU   7           HG2      GLU   7  -2.070   7.034   3.430
   49    HG3  GLU   7           HG1      GLU   7  -3.111   5.667   3.059
   50    H    ILE   8           HN       ILE   8  -5.583   4.869   5.803
   51    HA   ILE   8           HA       ILE   8  -4.767   2.631   4.282
   52    HB   ILE   8           HB       ILE   8  -6.259   2.964   6.886
   53   HG12  ILE   8          HG12      ILE   8  -4.216   2.106   7.840
   54   HG13  ILE   8          HG11      ILE   8  -3.595   1.656   6.254
   55   HG21  ILE   8          HG21      ILE   8  -7.224   0.943   6.118
   56   HG22  ILE   8          HG22      ILE   8  -5.856   0.414   7.098
   57   HG23  ILE   8          HG23      ILE   8  -5.733   0.425   5.339
   58   HD11  ILE   8          HD11      ILE   8  -3.307   3.940   5.620
   59   HD12  ILE   8          HD12      ILE   8  -2.672   3.819   7.262
   60   HD13  ILE   8          HD13      ILE   8  -4.268   4.511   6.981
   61    H    THR   9           HN       THR   9  -7.979   3.938   5.053
   62    HA   THR   9           HA       THR   9  -9.500   1.872   3.895
   63    HB   THR   9           HB       THR   9 -10.119   4.827   4.128
   64    HG1  THR   9           HG1      THR   9 -10.359   4.332   6.134
   65   HG21  THR   9          HG21      THR   9 -11.651   3.944   2.547
   66   HG22  THR   9          HG22      THR   9 -12.512   3.897   4.086
   67   HG23  THR   9          HG23      THR   9 -11.803   2.422   3.426
   68    H    ARG  10           HN       ARG  10  -8.144   4.853   2.519
   69    HA   ARG  10           HA       ARG  10  -9.240   4.555  -0.074
   70    HB2  ARG  10           HB2      ARG  10  -8.248   6.665   0.757
   71    HB3  ARG  10           HB1      ARG  10  -6.654   5.910   0.738
   72    HG2  ARG  10           HG2      ARG  10  -6.793   5.566  -1.668
   73    HG3  ARG  10           HG1      ARG  10  -8.448   6.174  -1.691
   74    HD2  ARG  10           HD2      ARG  10  -6.962   7.954  -2.411
   75    HD3  ARG  10           HD1      ARG  10  -7.606   8.362  -0.824
   76    HE   ARG  10           HE       ARG  10  -5.135   6.990  -0.527
   77   HH11  ARG  10          HH11      ARG  10  -3.291   8.226  -0.027
   78   HH12  ARG  10          HH12      ARG  10  -3.295   9.932  -0.307
   79   HH21  ARG  10          HH21      ARG  10  -6.516   9.986  -1.580
   80   HH22  ARG  10          HH22      ARG  10  -5.115  10.927  -1.190
   81    H    CYS  11           HN       CYS  11  -6.205   3.462   1.384
   82    HA   CYS  11           HA       CYS  11  -4.982   2.413  -0.909
   83    HB2  CYS  11           HB2      CYS  11  -3.977   2.722   1.407
   84    HB3  CYS  11           HB1      CYS  11  -4.775   1.214   1.849
   85    H    LYS  12           HN       LYS  12  -7.290   0.991   1.352
   86    HA   LYS  12           HA       LYS  12  -7.262  -1.641   0.351
   87    HB2  LYS  12           HB2      LYS  12  -8.306  -1.006   2.498
   88    HB3  LYS  12           HB1      LYS  12  -9.557  -0.127   1.621
   89    HG2  LYS  12           HG2      LYS  12 -10.278  -2.204   0.522
   90    HG3  LYS  12           HG1      LYS  12  -8.995  -3.095   1.342
   91    HD2  LYS  12           HD2      LYS  12  -9.985  -2.553   3.520
   92    HD3  LYS  12           HD1      LYS  12 -11.245  -1.605   2.728
   93    HE2  LYS  12           HE2      LYS  12 -12.097  -3.841   3.271
   94    HE3  LYS  12           HE1      LYS  12 -11.995  -3.640   1.522
   95    HZ1  LYS  12           HZ1      LYS  12 -10.904  -5.674   2.939
   96    HZ2  LYS  12           HZ2      LYS  12  -9.575  -4.646   2.691
   97    HZ3  LYS  12           HZ3      LYS  12 -10.463  -5.228   1.364
   98    H    LYS  13           HN       LYS  13  -9.178   1.203  -0.534
   99    HA   LYS  13           HA       LYS  13 -10.896  -0.049  -2.377
  100    HB2  LYS  13           HB2      LYS  13 -11.211   2.262  -1.508
  101    HB3  LYS  13           HB1      LYS  13  -9.833   2.787  -2.475
  102    HG2  LYS  13           HG2      LYS  13 -10.988   2.070  -4.532
  103    HG3  LYS  13           HG1      LYS  13 -12.359   1.516  -3.570
  104    HD2  LYS  13           HD2      LYS  13 -12.719   3.812  -2.749
  105    HD3  LYS  13           HD1      LYS  13 -11.341   4.370  -3.699
  106    HE2  LYS  13           HE2      LYS  13 -13.397   4.833  -4.927
  107    HE3  LYS  13           HE1      LYS  13 -12.490   3.574  -5.766
  108    HZ1  LYS  13           HZ1      LYS  13 -14.983   3.369  -4.243
  109    HZ2  LYS  13           HZ2      LYS  13 -13.933   2.035  -4.243
  110    HZ3  LYS  13           HZ3      LYS  13 -14.549   2.634  -5.707
  111    H    LEU  14           HN       LEU  14  -7.685   1.408  -2.772
  112    HA   LEU  14           HA       LEU  14  -7.529   1.178  -5.578
  113    HB2  LEU  14           HB2      LEU  14  -5.408   1.215  -3.425
  114    HB3  LEU  14           HB1      LEU  14  -5.020   1.223  -5.142
  115    HG   LEU  14           HG       LEU  14  -6.842   3.271  -3.835
  116   HD11  LEU  14          HD11      LEU  14  -4.993   4.775  -3.702
  117   HD12  LEU  14          HD12      LEU  14  -3.951   3.694  -4.624
  118   HD13  LEU  14          HD13      LEU  14  -4.425   3.270  -2.984
  119   HD21  LEU  14          HD21      LEU  14  -5.650   2.892  -6.578
  120   HD22  LEU  14          HD22      LEU  14  -5.949   4.526  -5.994
  121   HD23  LEU  14          HD23      LEU  14  -7.279   3.385  -6.130
  122    H    LEU  15           HN       LEU  15  -6.590  -1.060  -2.987
  123    HA   LEU  15           HA       LEU  15  -5.431  -3.014  -4.682
  124    HB2  LEU  15           HB2      LEU  15  -6.686  -3.201  -1.937
  125    HB3  LEU  15           HB1      LEU  15  -5.814  -4.526  -2.706
  126    HG   LEU  15           HG       LEU  15  -4.633  -1.773  -2.229
  127   HD11  LEU  15          HD11      LEU  15  -3.341  -2.962  -0.409
  128   HD12  LEU  15          HD12      LEU  15  -4.457  -4.316  -0.596
  129   HD13  LEU  15          HD13      LEU  15  -5.058  -2.741  -0.075
  130   HD21  LEU  15          HD21      LEU  15  -3.300  -2.712  -3.897
  131   HD22  LEU  15          HD22      LEU  15  -3.588  -4.365  -3.354
  132   HD23  LEU  15          HD23      LEU  15  -2.486  -3.319  -2.461
  133    H    ASP  16           HN       ASP  16  -8.709  -2.580  -3.414
  134    HA   ASP  16           HA       ASP  16  -9.801  -4.975  -4.465
  135    HB2  ASP  16           HB2      ASP  16 -11.052  -2.354  -3.641
  136    HB3  ASP  16           HB1      ASP  16 -12.001  -3.731  -4.200
  137    H    ASP  17           HN       ASP  17  -9.434  -1.734  -5.763
  138    HA   ASP  17           HA       ASP  17 -11.011  -2.074  -8.087
  139    HB2  ASP  17           HB2      ASP  17  -8.735  -0.199  -7.433
  140    HB3  ASP  17           HB1      ASP  17  -9.623  -0.133  -8.953
  141    H    SER  18           HN       SER  18  -8.102  -3.503  -7.191
  142    HA   SER  18           HA       SER  18  -6.648  -3.574  -9.566
  143    HB2  SER  18           HB2      SER  18  -5.583  -5.575  -8.652
  144    HB3  SER  18           HB1      SER  18  -5.792  -4.372  -7.383
  145    HG   SER  18           HG       SER  18  -7.520  -6.560  -7.937
  146    H    SER  19           HN       SER  19  -9.550  -5.160  -8.674
  147    HA   SER  19           HA       SER  19  -9.388  -7.179 -10.748
  148    HB2  SER  19           HB2      SER  19 -11.571  -7.888  -9.994
  149    HB3  SER  19           HB1      SER  19 -10.557  -7.597  -8.584
  150    HG   SER  19           HG       SER  19 -11.517  -5.456  -8.546
  151    H    SER  20           HN       SER  20 -10.258  -3.953 -10.564
  152    HA   SER  20           HA       SER  20 -12.268  -3.975 -12.646
  153    HB2  SER  20           HB2      SER  20 -12.320  -2.267 -10.869
  154    HB3  SER  20           HB1      SER  20 -10.768  -1.648 -11.420
  155    HG   SER  20           HG       SER  20 -13.060  -1.886 -13.074
  156    H1   LYS   1           HN       LYS   1 -12.034  -3.303 -14.757
  157    HA   LYS   1           HA       LYS   1  -9.429  -3.690 -15.929
  158    HB2  LYS   1           HB2      LYS   1 -12.106  -2.931 -17.110
  159    HB3  LYS   1           HB1      LYS   1 -10.647  -3.171 -18.070
  160    HG2  LYS   1           HG2      LYS   1 -10.451  -5.471 -17.224
  161    HG3  LYS   1           HG1      LYS   1 -11.896  -5.239 -16.239
  162    HD2  LYS   1           HD2      LYS   1 -13.224  -4.825 -18.276
  163    HD3  LYS   1           HD1      LYS   1 -11.781  -5.058 -19.264
  164    HE2  LYS   1           HE2      LYS   1 -11.568  -7.363 -18.428
  165    HE3  LYS   1           HE1      LYS   1 -12.995  -7.136 -17.417
  166    HZ1  LYS   1           HZ1      LYS   1 -12.853  -7.123 -20.377
  167    HZ2  LYS   1           HZ2      LYS   1 -14.215  -6.591 -19.511
  168    HZ3  LYS   1           HZ3      LYS   1 -13.702  -8.206 -19.384
  169    H    ASN   2           HN       ASN   2 -10.407  -1.255 -14.203
  170    HA   ASN   2           HA       ASN   2 -10.204   1.041 -15.796
  171    HB2  ASN   2           HB2      ASN   2  -9.681   2.199 -13.623
  172    HB3  ASN   2           HB1      ASN   2 -11.110   1.173 -13.561
  173   HD21  ASN   2          HD21      ASN   2  -9.646   1.874 -11.208
  174   HD22  ASN   2          HD22      ASN   2  -8.927   0.465 -10.593
  175    HA   PRO   3           HA       PRO   3  -5.895   1.339 -16.771
  176    HB2  PRO   3           HB2      PRO   3  -5.487   4.075 -16.585
  177    HB3  PRO   3           HB1      PRO   3  -6.292   3.281 -17.953
  178    HG2  PRO   3           HG2      PRO   3  -7.507   4.644 -15.583
  179    HG3  PRO   3           HG1      PRO   3  -7.965   4.736 -17.296
  180    HD2  PRO   3           HD2      PRO   3  -9.345   3.203 -15.589
  181    HD3  PRO   3           HD1      PRO   3  -9.063   2.671 -17.254
  182    H    GLU   4           HN       GLU   4  -7.121   2.509 -13.762
  183    HA   GLU   4           HA       GLU   4  -4.696   3.268 -12.509
  184    HB2  GLU   4           HB2      GLU   4  -7.303   2.260 -11.364
  185    HB3  GLU   4           HB1      GLU   4  -5.972   2.879 -10.388
  186    HG2  GLU   4           HG2      GLU   4  -6.078   5.029 -11.552
  187    HG3  GLU   4           HG1      GLU   4  -7.359   4.420 -12.598
  188    H    ALA   5           HN       ALA   5  -5.868   0.245 -13.495
  189    HA   ALA   5           HA       ALA   5  -4.918  -1.499 -11.520
  190    HB1  ALA   5           HB1      ALA   5  -5.117  -3.216 -13.136
  191    HB2  ALA   5           HB2      ALA   5  -4.816  -2.107 -14.474
  192    HB3  ALA   5           HB3      ALA   5  -6.341  -2.031 -13.590
  193    H    GLU   6           HN       GLU   6  -3.228   0.300 -13.992
  194    HA   GLU   6           HA       GLU   6  -0.833  -1.173 -14.086
  195    HB2  GLU   6           HB2      GLU   6  -1.449   1.755 -14.520
  196    HB3  GLU   6           HB1      GLU   6   0.158   1.075 -14.770
  197    HG2  GLU   6           HG2      GLU   6  -0.882   1.019 -16.907
  198    HG3  GLU   6           HG1      GLU   6  -0.971  -0.634 -16.314
  199    H    GLU   7           HN       GLU   7  -1.976   1.337 -11.875
  200    HA   GLU   7           HA       GLU   7   0.460   1.754 -10.513
  201    HB2  GLU   7           HB2      GLU   7  -1.443   3.293 -10.289
  202    HB3  GLU   7           HB1      GLU   7  -2.374   2.034  -9.479
  203    HG2  GLU   7           HG2      GLU   7  -1.374   3.569  -7.836
  204    HG3  GLU   7           HG1      GLU   7  -0.688   1.959  -7.661
  205    H    ILE   8           HN       ILE   8  -2.153  -0.570 -10.050
  206    HA   ILE   8           HA       ILE   8  -1.287  -1.655  -7.587
  207    HB   ILE   8           HB       ILE   8  -2.970  -2.706  -9.864
  208   HG12  ILE   8          HG12      ILE   8  -4.763  -2.491  -8.259
  209   HG13  ILE   8          HG11      ILE   8  -3.627  -2.192  -6.946
  210   HG21  ILE   8          HG21      ILE   8  -2.002  -4.729  -9.103
  211   HG22  ILE   8          HG22      ILE   8  -3.509  -4.610  -8.196
  212   HG23  ILE   8          HG23      ILE   8  -1.980  -4.188  -7.427
  213   HD11  ILE   8          HD11      ILE   8  -3.036  -0.051  -7.822
  214   HD12  ILE   8          HD12      ILE   8  -4.795  -0.137  -7.926
  215   HD13  ILE   8          HD13      ILE   8  -3.813  -0.392  -9.367
  216    H    THR   9           HN       THR   9  -0.515  -2.484 -10.954
  217    HA   THR   9           HA       THR   9   1.041  -4.766 -10.417
  218    HB   THR   9           HB       THR   9   1.295  -2.739 -12.653
  219    HG1  THR   9           HG1      THR   9  -0.462  -3.658 -13.282
  220   HG21  THR   9          HG21      THR   9   3.317  -3.984 -12.634
  221   HG22  THR   9          HG22      THR   9   2.298  -4.787 -13.829
  222   HG23  THR   9          HG23      THR   9   2.483  -5.481 -12.219
  223    H    ARG  10           HN       ARG  10   1.902  -1.327 -10.618
  224    HA   ARG  10           HA       ARG  10   4.688  -1.655 -10.238
  225    HB2  ARG  10           HB2      ARG  10   3.655   0.441 -11.054
  226    HB3  ARG  10           HB1      ARG  10   2.944   0.696  -9.460
  227    HG2  ARG  10           HG2      ARG  10   5.153   0.813  -8.442
  228    HG3  ARG  10           HG1      ARG  10   5.916   0.415  -9.982
  229    HD2  ARG  10           HD2      ARG  10   6.051   2.815  -9.652
  230    HD3  ARG  10           HD1      ARG  10   4.919   2.486 -10.959
  231    HE   ARG  10           HE       ARG  10   3.510   2.650  -8.497
  232   HH11  ARG  10          HH11      ARG  10   2.353   4.560  -8.065
  233   HH12  ARG  10          HH12      ARG  10   2.718   6.005  -8.940
  234   HH21  ARG  10          HH21      ARG  10   5.242   4.553 -10.816
  235   HH22  ARG  10          HH22      ARG  10   4.353   6.004 -10.493
  236    H    CYS  11           HN       CYS  11   2.001  -1.187  -7.983
  237    HA   CYS  11           HA       CYS  11   3.474  -0.928  -5.615
  238    HB2  CYS  11           HB2      CYS  11   0.985  -0.569  -5.950
  239    HB3  CYS  11           HB1      CYS  11   0.811  -2.319  -5.838
  240    H    LYS  12           HN       LYS  12   2.330  -3.789  -7.337
  241    HA   LYS  12           HA       LYS  12   3.036  -5.717  -5.408
  242    HB2  LYS  12           HB2      LYS  12   1.591  -6.196  -7.353
  243    HB3  LYS  12           HB1      LYS  12   2.980  -5.997  -8.422
  244    HG2  LYS  12           HG2      LYS  12   4.131  -7.861  -7.312
  245    HG3  LYS  12           HG1      LYS  12   2.783  -8.040  -6.189
  246    HD2  LYS  12           HD2      LYS  12   1.279  -8.575  -8.053
  247    HD3  LYS  12           HD1      LYS  12   2.599  -8.345  -9.202
  248    HE2  LYS  12           HE2      LYS  12   2.314 -10.734  -8.724
  249    HE3  LYS  12           HE1      LYS  12   3.859 -10.171  -8.088
  250    HZ1  LYS  12           HZ1      LYS  12   1.965 -11.500  -6.677
  251    HZ2  LYS  12           HZ2      LYS  12   1.694  -9.884  -6.226
  252    HZ3  LYS  12           HZ3      LYS  12   3.227 -10.585  -6.008
  253    H    LYS  13           HN       LYS  13   4.853  -4.273  -8.083
  254    HA   LYS  13           HA       LYS  13   7.161  -5.870  -7.887
  255    HB2  LYS  13           HB2      LYS  13   6.675  -4.332  -9.781
  256    HB3  LYS  13           HB1      LYS  13   6.991  -2.961  -8.718
  257    HG2  LYS  13           HG2      LYS  13   9.289  -3.766  -8.341
  258    HG3  LYS  13           HG1      LYS  13   8.975  -5.157  -9.379
  259    HD2  LYS  13           HD2      LYS  13   8.547  -3.649 -11.281
  260    HD3  LYS  13           HD1      LYS  13   8.847  -2.253 -10.246
  261    HE2  LYS  13           HE2      LYS  13  10.870  -2.749 -11.513
  262    HE3  LYS  13           HE1      LYS  13  11.148  -3.123  -9.812
  263    HZ1  LYS  13           HZ1      LYS  13  10.824  -4.941 -12.088
  264    HZ2  LYS  13           HZ2      LYS  13  10.293  -5.461 -10.560
  265    HZ3  LYS  13           HZ3      LYS  13  11.915  -5.018 -10.792
  266    H    LEU  14           HN       LEU  14   6.240  -2.856  -6.260
  267    HA   LEU  14           HA       LEU  14   8.683  -2.406  -4.923
  268    HB2  LEU  14           HB2      LEU  14   5.834  -1.646  -4.258
  269    HB3  LEU  14           HB1      LEU  14   7.211  -1.090  -3.314
  270    HG   LEU  14           HG       LEU  14   6.968  -0.671  -6.313
  271   HD11  LEU  14          HD11      LEU  14   6.154   1.536  -5.902
  272   HD12  LEU  14          HD12      LEU  14   6.455   1.406  -4.171
  273   HD13  LEU  14          HD13      LEU  14   5.158   0.476  -4.909
  274   HD21  LEU  14          HD21      LEU  14   8.889   0.215  -4.165
  275   HD22  LEU  14          HD22      LEU  14   8.609   1.267  -5.550
  276   HD23  LEU  14          HD23      LEU  14   9.227  -0.360  -5.794
  277    H    LEU  15           HN       LEU  15   5.785  -4.227  -3.972
  278    HA   LEU  15           HA       LEU  15   6.673  -4.859  -1.355
  279    HB2  LEU  15           HB2      LEU  15   4.728  -6.231  -3.220
  280    HB3  LEU  15           HB1      LEU  15   4.954  -6.691  -1.535
  281    HG   LEU  15           HG       LEU  15   4.209  -3.895  -2.442
  282   HD11  LEU  15          HD11      LEU  15   1.930  -4.499  -1.573
  283   HD12  LEU  15          HD12      LEU  15   2.474  -6.173  -1.452
  284   HD13  LEU  15          HD13      LEU  15   2.396  -5.381  -3.027
  285   HD21  LEU  15          HD21      LEU  15   5.071  -3.606  -0.296
  286   HD22  LEU  15          HD22      LEU  15   4.603  -5.222   0.232
  287   HD23  LEU  15          HD23      LEU  15   3.389  -3.954   0.087
  288    H    ASP  16           HN       ASP  16   6.974  -6.538  -4.458
  289    HA   ASP  16           HA       ASP  16   8.221  -8.880  -3.462
  290    HB2  ASP  16           HB2      ASP  16   8.201  -7.582  -6.186
  291    HB3  ASP  16           HB1      ASP  16   9.016  -9.112  -5.863
  292    H    ASP  17           HN       ASP  17   9.461  -5.785  -4.563
  293    HA   ASP  17           HA       ASP  17  12.206  -6.466  -4.600
  294    HB2  ASP  17           HB2      ASP  17  10.773  -3.824  -4.300
  295    HB3  ASP  17           HB1      ASP  17  12.529  -3.958  -4.389
  296    H    SER  18           HN       SER  18  10.053  -6.217  -2.031
  297    HA   SER  18           HA       SER  18  11.567  -5.014  -0.025
  298    HB2  SER  18           HB2      SER  18  10.143  -6.235   1.543
  299    HB3  SER  18           HB1      SER  18   9.178  -5.620   0.205
  300    HG   SER  18           HG       SER  18  10.243  -8.244   0.475
  301    H    SER  19           HN       SER  19  11.894  -8.064  -1.549
  302    HA   SER  19           HA       SER  19  13.552  -9.218   0.530
  303    HB2  SER  19           HB2      SER  19  13.765 -11.128  -0.931
  304    HB3  SER  19           HB1      SER  19  12.080 -10.617  -0.926
  305    HG   SER  19           HG       SER  19  12.612  -9.402  -2.856
  306    H    SER  20           HN       SER  20  13.982  -7.092  -2.018
  307    HA   SER  20           HA       SER  20  16.720  -7.786  -2.646
  308    HB2  SER  20           HB2      SER  20  15.243  -6.753  -4.340
  309    HB3  SER  20           HB1      SER  20  15.149  -5.296  -3.355
  310    HG   SER  20           HG       SER  20  17.556  -6.458  -4.317
  311    H1   LYS   1           HN       LYS   1  18.565  -6.704  -2.027
  312    HA   LYS   1           HA       LYS   1  18.467  -5.393   0.536
  313    HB2  LYS   1           HB2      LYS   1  20.740  -5.982  -1.367
  314    HB3  LYS   1           HB1      LYS   1  20.953  -5.219   0.210
  315    HG2  LYS   1           HG2      LYS   1  19.928  -7.170   1.305
  316    HG3  LYS   1           HG1      LYS   1  19.694  -7.936  -0.266
  317    HD2  LYS   1           HD2      LYS   1  22.133  -7.917  -0.642
  318    HD3  LYS   1           HD1      LYS   1  22.369  -7.153   0.930
  319    HE2  LYS   1           HE2      LYS   1  21.346  -9.099   2.041
  320    HE3  LYS   1           HE1      LYS   1  21.088  -9.865   0.472
  321    HZ1  LYS   1           HZ1      LYS   1  23.675  -9.209   1.761
  322    HZ2  LYS   1           HZ2      LYS   1  23.540  -9.670   0.131
  323    HZ3  LYS   1           HZ3      LYS   1  23.076 -10.745   1.362
  324    H    ASN   2           HN       ASN   2  17.514  -4.244  -2.226
  325    HA   ASN   2           HA       ASN   2  19.028  -1.946  -2.754
  326    HB2  ASN   2           HB2      ASN   2  16.930  -1.127  -3.877
  327    HB3  ASN   2           HB1      ASN   2  17.411  -2.751  -4.357
  328   HD21  ASN   2          HD21      ASN   2  14.719  -1.847  -4.618
  329   HD22  ASN   2          HD22      ASN   2  13.754  -2.726  -3.532
  330    HA   PRO   3           HA       PRO   3  18.075   0.801   0.587
  331    HB2  PRO   3           HB2      PRO   3  17.943   3.233  -0.731
  332    HB3  PRO   3           HB1      PRO   3  19.460   2.400  -0.340
  333    HG2  PRO   3           HG2      PRO   3  17.936   2.428  -2.914
  334    HG3  PRO   3           HG1      PRO   3  19.683   2.580  -2.636
  335    HD2  PRO   3           HD2      PRO   3  18.619   0.257  -3.438
  336    HD3  PRO   3           HD1      PRO   3  19.966   0.283  -2.288
  337    H    GLU   4           HN       GLU   4  15.984   0.530  -2.147
  338    HA   GLU   4           HA       GLU   4  13.873   2.228  -1.319
  339    HB2  GLU   4           HB2      GLU   4  13.880  -0.229  -3.079
  340    HB3  GLU   4           HB1      GLU   4  12.481   0.820  -2.854
  341    HG2  GLU   4           HG2      GLU   4  13.752   2.739  -3.695
  342    HG3  GLU   4           HG1      GLU   4  15.187   1.730  -3.872
  343    H    ALA   5           HN       ALA   5  15.027  -0.701  -0.064
  344    HA   ALA   5           HA       ALA   5  12.705  -1.982   0.837
  345    HB1  ALA   5           HB1      ALA   5  14.110  -3.199   2.301
  346    HB2  ALA   5           HB2      ALA   5  15.276  -1.881   2.411
  347    HB3  ALA   5           HB3      ALA   5  15.132  -2.809   0.918
  348    H    GLU   6           HN       GLU   6  14.349   0.865   2.012
  349    HA   GLU   6           HA       GLU   6  13.301   0.971   4.620
  350    HB2  GLU   6           HB2      GLU   6  14.175   3.120   2.681
  351    HB3  GLU   6           HB1      GLU   6  13.663   3.480   4.329
  352    HG2  GLU   6           HG2      GLU   6  16.029   3.272   4.442
  353    HG3  GLU   6           HG1      GLU   6  15.409   1.759   5.085
  354    H    GLU   7           HN       GLU   7  11.987   1.999   1.504
  355    HA   GLU   7           HA       GLU   7   9.748   3.400   2.500
  356    HB2  GLU   7           HB2      GLU   7  10.479   3.598   0.162
  357    HB3  GLU   7           HB1      GLU   7  10.054   1.911  -0.120
  358    HG2  GLU   7           HG2      GLU   7   8.261   3.402  -0.908
  359    HG3  GLU   7           HG1      GLU   7   7.689   2.414   0.430
  360    H    ILE   8           HN       ILE   8  10.276  -0.004   1.735
  361    HA   ILE   8           HA       ILE   8   7.603  -0.889   2.013
  362    HB   ILE   8           HB       ILE   8  10.295  -2.237   2.274
  363   HG12  ILE   8          HG12      ILE   8   9.623  -3.329   0.224
  364   HG13  ILE   8          HG11      ILE   8   7.983  -2.703   0.365
  365   HG21  ILE   8          HG21      ILE   8   9.035  -3.516   3.823
  366   HG22  ILE   8          HG22      ILE   8   8.883  -4.404   2.306
  367   HG23  ILE   8          HG23      ILE   8   7.561  -3.378   2.868
  368   HD11  ILE   8          HD11      ILE   8   8.694  -0.469  -0.075
  369   HD12  ILE   8          HD12      ILE   8   9.534  -1.471  -1.258
  370   HD13  ILE   8          HD13      ILE   8  10.389  -0.886   0.166
  371    H    THR   9           HN       THR   9  10.245  -0.523   4.359
  372    HA   THR   9           HA       THR   9   8.926  -1.660   6.572
  373    HB   THR   9           HB       THR   9  10.982   0.563   6.483
  374    HG1  THR   9           HG1      THR   9  12.234  -1.020   5.976
  375   HG21  THR   9          HG21      THR   9  10.010   0.630   8.646
  376   HG22  THR   9          HG22      THR   9  11.461  -0.358   8.830
  377   HG23  THR   9          HG23      THR   9   9.876  -1.126   8.727
  378    H    ARG  10           HN       ARG  10   8.996   1.667   5.328
  379    HA   ARG  10           HA       ARG  10   7.438   2.829   7.385
  380    HB2  ARG  10           HB2      ARG  10   8.771   4.147   5.772
  381    HB3  ARG  10           HB1      ARG  10   7.662   3.671   4.485
  382    HG2  ARG  10           HG2      ARG  10   5.807   4.767   5.614
  383    HG3  ARG  10           HG1      ARG  10   6.829   5.140   7.001
  384    HD2  ARG  10           HD2      ARG  10   6.658   7.123   5.611
  385    HD3  ARG  10           HD1      ARG  10   8.296   6.491   5.498
  386    HE   ARG  10           HE       ARG  10   6.709   5.402   3.408
  387   HH11  ARG  10          HH11      ARG  10   6.971   6.267   1.320
  388   HH12  ARG  10          HH12      ARG  10   7.710   7.817   1.116
  389   HH21  ARG  10          HH21      ARG  10   8.186   8.335   4.508
  390   HH22  ARG  10          HH22      ARG  10   8.394   8.989   2.917
  391    H    CYS  11           HN       CYS  11   6.590   1.340   4.289
  392    HA   CYS  11           HA       CYS  11   3.845   1.902   4.286
  393    HB2  CYS  11           HB2      CYS  11   5.234   0.918   2.406
  394    HB3  CYS  11           HB1      CYS  11   5.085  -0.633   3.229
  395    H    LYS  12           HN       LYS  12   5.674  -0.738   5.750
  396    HA   LYS  12           HA       LYS  12   3.493  -2.306   6.600
  397    HB2  LYS  12           HB2      LYS  12   5.832  -3.105   6.591
  398    HB3  LYS  12           HB1      LYS  12   6.210  -1.990   7.903
  399    HG2  LYS  12           HG2      LYS  12   4.576  -3.111   9.356
  400    HG3  LYS  12           HG1      LYS  12   4.138  -4.200   8.040
  401    HD2  LYS  12           HD2      LYS  12   6.425  -5.090   7.991
  402    HD3  LYS  12           HD1      LYS  12   6.902  -3.971   9.268
  403    HE2  LYS  12           HE2      LYS  12   6.417  -6.180  10.224
  404    HE3  LYS  12           HE1      LYS  12   5.226  -5.004  10.778
  405    HZ1  LYS  12           HZ1      LYS  12   4.669  -7.380   9.594
  406    HZ2  LYS  12           HZ2      LYS  12   4.492  -6.277   8.315
  407    HZ3  LYS  12           HZ3      LYS  12   3.593  -6.078   9.743
  408    H    LYS  13           HN       LYS  13   5.227   0.368   8.143
  409    HA   LYS  13           HA       LYS  13   3.941   0.271  10.643
  410    HB2  LYS  13           HB2      LYS  13   5.969   1.630  10.154
  411    HB3  LYS  13           HB1      LYS  13   4.973   2.723   9.193
  412    HG2  LYS  13           HG2      LYS  13   3.592   3.225  11.171
  413    HG3  LYS  13           HG1      LYS  13   4.564   2.114  12.135
  414    HD2  LYS  13           HD2      LYS  13   6.567   3.487  11.709
  415    HD3  LYS  13           HD1      LYS  13   5.602   4.596  10.734
  416    HE2  LYS  13           HE2      LYS  13   5.847   5.515  12.982
  417    HE3  LYS  13           HE1      LYS  13   4.167   5.042  12.726
  418    HZ1  LYS  13           HZ1      LYS  13   6.214   3.798  14.413
  419    HZ2  LYS  13           HZ2      LYS  13   5.028   2.800  13.721
  420    HZ3  LYS  13           HZ3      LYS  13   4.575   4.082  14.738
  421    H    LEU  14           HN       LEU  14   3.095   1.934   7.625
  422    HA   LEU  14           HA       LEU  14   0.880   3.372   8.614
  423    HB2  LEU  14           HB2      LEU  14   1.553   2.327   5.858
  424    HB3  LEU  14           HB1      LEU  14   0.156   3.350   6.172
  425    HG   LEU  14           HG       LEU  14   2.994   4.129   6.925
  426   HD11  LEU  14          HD11      LEU  14   3.126   5.424   4.921
  427   HD12  LEU  14          HD12      LEU  14   1.429   5.145   4.541
  428   HD13  LEU  14          HD13      LEU  14   2.586   3.826   4.415
  429   HD21  LEU  14          HD21      LEU  14   0.304   5.488   6.975
  430   HD22  LEU  14          HD22      LEU  14   1.751   6.459   6.720
  431   HD23  LEU  14          HD23      LEU  14   1.583   5.504   8.185
  432    H    LEU  15           HN       LEU  15   1.123   0.132   7.180
  433    HA   LEU  15           HA       LEU  15  -1.663  -0.398   7.162
  434    HB2  LEU  15           HB2      LEU  15   0.748  -2.222   7.260
  435    HB3  LEU  15           HB1      LEU  15  -0.902  -2.794   7.022
  436    HG   LEU  15           HG       LEU  15   0.445  -0.729   5.255
  437   HD11  LEU  15          HD11      LEU  15   0.595  -2.623   3.607
  438   HD12  LEU  15          HD12      LEU  15   0.141  -3.724   4.910
  439   HD13  LEU  15          HD13      LEU  15   1.646  -2.808   5.011
  440   HD21  LEU  15          HD21      LEU  15  -1.840  -0.442   4.878
  441   HD22  LEU  15          HD22      LEU  15  -2.225  -2.126   5.233
  442   HD23  LEU  15          HD23      LEU  15  -1.477  -1.695   3.698
  443    H    ASP  16           HN       ASP  16   0.886  -1.027   9.540
  444    HA   ASP  16           HA       ASP  16  -0.714  -2.462  11.386
  445    HB2  ASP  16           HB2      ASP  16   1.845  -0.893  11.696
  446    HB3  ASP  16           HB1      ASP  16   1.094  -1.768  13.030
  447    H    ASP  17           HN       ASP  17  -0.029   0.956  10.958
  448    HA   ASP  17           HA       ASP  17  -1.220   1.884  13.351
  449    HB2  ASP  17           HB2      ASP  17  -0.683   3.222  10.696
  450    HB3  ASP  17           HB1      ASP  17  -1.365   4.075  12.080
  451    H    SER  18           HN       SER  18  -2.588   0.438  10.644
  452    HA   SER  18           HA       SER  18  -4.957   1.858  10.269
  453    HB2  SER  18           HB2      SER  18  -5.850  -0.216   9.331
  454    HB3  SER  18           HB1      SER  18  -4.187   0.014   8.801
  455    HG   SER  18           HG       SER  18  -5.077  -1.595  10.965
  456    H    SER  19           HN       SER  19  -3.948  -0.171  12.837
  457    HA   SER  19           HA       SER  19  -6.615  -0.622  13.877
  458    HB2  SER  19           HB2      SER  19  -5.533  -1.800  15.682
  459    HB3  SER  19           HB1      SER  19  -4.766  -2.280  14.171
  460    HG   SER  19           HG       SER  19  -3.159  -0.666  14.630
  461    H    SER  20           HN       SER  20  -4.342   1.838  13.991
  462    HA   SER  20           HA       SER  20  -5.018   2.863  16.611
  463    HB2  SER  20           HB2      SER  20  -2.775   3.236  15.667
  464    HB3  SER  20           HB1      SER  20  -3.484   4.166  14.351
  465    HG   SER  20           HG       SER  20  -3.754   4.748  17.119
  466    H2   ZBR 100           HA3      TBS 100  -1.362   1.175  -2.044
  467    H4   ZBR 100           HC3      TBS 100   0.802   1.754   1.665
  468    H6   ZBR 100           HB3      TBS 100   2.864   0.248  -1.833
  469    H7   ZBR 100          HB11      TBS 100   1.292   0.963  -4.130
  470    H7A  ZBR 100          HB12      TBS 100  -0.301   0.232  -3.902
  471    H8   ZBR 100          HA11      TBS 100  -1.961   2.961   0.120
  472    H8A  ZBR 100          HA12      TBS 100  -1.509   2.127   1.611
  473    H9   ZBR 100          HC11      TBS 100   3.614   1.922   0.978
  474    H9A  ZBR 100          HC12      TBS 100   4.003   0.378   0.210