*HEADER    TRANSCRIPTION                           21-FEB-17   5N7Y              
*TITLE     SOLUTION STRUCTURE OF B. SUBTILIS SIGMA G INHIBITOR CSFB              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ANTI-SIGMA-G FACTOR GIN;                                   
*COMPND   3 CHAIN: A, C;                                                         
*COMPND   4 SYNONYM: PROTEIN CSFB;                                               
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS;                              
*SOURCE   3 ORGANISM_TAXID: 1423;                                                
*SOURCE   4 GENE: CSFB, GIN, YAAM, BSU00240;                                     
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    ZINC-FINGER, DIMER, CSFB, SIGMA G INHIBITOR, TRANSCRIPTION            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    S.MARTINEZ-LUMBRERAS,C.ALFANO,A.ATKINSON,R.L.ISAACSON                 
*REVDAT   1   28-FEB-18 5N7Y    0                                                
# Restraints file 1: NEW_TALOSCA.tbl
 ASSIGN  (segid "   A" and resid 8    and name N   ) (segid "   A" and resid 8    and name CA  )
         (segid "   A" and resid 8    and name C   ) (segid "   A" and resid 9    and name N   )  1.00 126.00 28.00 2

 ASSIGN  (segid "   A" and resid 7    and name C   ) (segid "   A" and resid 8    and name N   )
         (segid "   A" and resid 8    and name CA  ) (segid "   A" and resid 8    and name C   )  1.00 -121.00 64.00 2

 ASSIGN  (segid "   A" and resid 9    and name N   ) (segid "   A" and resid 9    and name CA  )
         (segid "   A" and resid 9    and name C   ) (segid "   A" and resid 10   and name N   )  1.00 135.32 38.85 2

 ASSIGN  (segid "   A" and resid 8    and name C   ) (segid "   A" and resid 9    and name N   )
         (segid "   A" and resid 9    and name CA  ) (segid "   A" and resid 9    and name C   )  1.00 -97.54 133.38 2

 ASSIGN  (segid "   A" and resid 10   and name N   ) (segid "   A" and resid 10   and name CA  )
         (segid "   A" and resid 10   and name C   ) (segid "   A" and resid 11   and name N   )  1.00 125.41 16.06 2

 ASSIGN  (segid "   A" and resid 9    and name C   ) (segid "   A" and resid 10   and name N   )
         (segid "   A" and resid 10   and name CA  ) (segid "   A" and resid 10   and name C   )  1.00 -101.89 60.94 2

 ASSIGN  (segid "   A" and resid 11   and name N   ) (segid "   A" and resid 11   and name CA  )
         (segid "   A" and resid 11   and name C   ) (segid "   A" and resid 12   and name N   )  1.00 134.16 20.49 2

 ASSIGN  (segid "   A" and resid 10   and name C   ) (segid "   A" and resid 11   and name N   )
         (segid "   A" and resid 11   and name CA  ) (segid "   A" and resid 11   and name C   )  1.00 -116.63 44.56 2

 ASSIGN  (segid "   A" and resid 11   and name C   ) (segid "   A" and resid 12   and name N   )
         (segid "   A" and resid 12   and name CA  ) (segid "   A" and resid 12   and name C   )  1.00 -82.65 52.76 2

 ASSIGN  (segid "   A" and resid 13   and name N   ) (segid "   A" and resid 13   and name CA  )
         (segid "   A" and resid 13   and name C   ) (segid "   A" and resid 14   and name N   )  1.00 -29.25 30.39 2

 ASSIGN  (segid "   A" and resid 14   and name N   ) (segid "   A" and resid 14   and name CA  )
         (segid "   A" and resid 14   and name C   ) (segid "   A" and resid 15   and name N   )  1.00 -14.21 41.82 2

 ASSIGN  (segid "   A" and resid 13   and name C   ) (segid "   A" and resid 14   and name N   )
         (segid "   A" and resid 14   and name CA  ) (segid "   A" and resid 14   and name C   )  1.00 -89.55 41.57 2

 ASSIGN  (segid "   A" and resid 15   and name N   ) (segid "   A" and resid 15   and name CA  )
         (segid "   A" and resid 15   and name C   ) (segid "   A" and resid 16   and name N   )  1.00  26.98 36.49 2

 ASSIGN  (segid "   A" and resid 14   and name C   ) (segid "   A" and resid 15   and name N   )
         (segid "   A" and resid 15   and name CA  ) (segid "   A" and resid 15   and name C   )  1.00  61.47 14.28 2

 ASSIGN  (segid "   A" and resid 16   and name N   ) (segid "   A" and resid 16   and name CA  )
         (segid "   A" and resid 16   and name C   ) (segid "   A" and resid 17   and name N   )  1.00 143.71 44.79 2

 ASSIGN  (segid "   A" and resid 15   and name C   ) (segid "   A" and resid 16   and name N   )
         (segid "   A" and resid 16   and name CA  ) (segid "   A" and resid 16   and name C   )  1.00 -124.15 61.99 2

 ASSIGN  (segid "   A" and resid 17   and name N   ) (segid "   A" and resid 17   and name CA  )
         (segid "   A" and resid 17   and name C   ) (segid "   A" and resid 18   and name N   )  1.00 133.53 34.06 2

 ASSIGN  (segid "   A" and resid 16   and name C   ) (segid "   A" and resid 17   and name N   )
         (segid "   A" and resid 17   and name CA  ) (segid "   A" and resid 17   and name C   )  1.00 -98.73 52.48 2

 ASSIGN  (segid "   A" and resid 18   and name N   ) (segid "   A" and resid 18   and name CA  )
         (segid "   A" and resid 18   and name C   ) (segid "   A" and resid 19   and name N   )  1.00 154.80 42.69 2

 ASSIGN  (segid "   A" and resid 17   and name C   ) (segid "   A" and resid 18   and name N   )
         (segid "   A" and resid 18   and name CA  ) (segid "   A" and resid 18   and name C   )  1.00 -118.34 34.52 2

 ASSIGN  (segid "   A" and resid 19   and name N   ) (segid "   A" and resid 19   and name CA  )
         (segid "   A" and resid 19   and name C   ) (segid "   A" and resid 20   and name N   )  1.00 -24.94 44.42 2

 ASSIGN  (segid "   A" and resid 18   and name C   ) (segid "   A" and resid 19   and name N   )
         (segid "   A" and resid 19   and name CA  ) (segid "   A" and resid 19   and name C   )  1.00 -94.73 40.18 2

 ASSIGN  (segid "   A" and resid 20   and name N   ) (segid "   A" and resid 20   and name CA  )
         (segid "   A" and resid 20   and name C   ) (segid "   A" and resid 21   and name N   )  1.00 141.53 29.53 2

 ASSIGN  (segid "   A" and resid 19   and name C   ) (segid "   A" and resid 20   and name N   )
         (segid "   A" and resid 20   and name CA  ) (segid "   A" and resid 20   and name C   )  1.00 -141.38 112.66 2

 ASSIGN  (segid "   A" and resid 21   and name N   ) (segid "   A" and resid 21   and name CA  )
         (segid "   A" and resid 21   and name C   ) (segid "   A" and resid 22   and name N   )  1.00 178.75 44.88 2

 ASSIGN  (segid "   A" and resid 20   and name C   ) (segid "   A" and resid 21   and name N   )
         (segid "   A" and resid 21   and name CA  ) (segid "   A" and resid 21   and name C   )  1.00 -176.46 46.94 2

 ASSIGN  (segid "   A" and resid 22   and name N   ) (segid "   A" and resid 22   and name CA  )
         (segid "   A" and resid 22   and name C   ) (segid "   A" and resid 23   and name N   )  1.00 160.88 15.00 2 

 ASSIGN  (segid "   A" and resid 21   and name C   ) (segid "   A" and resid 22   and name N   )
         (segid "   A" and resid 22   and name CA  ) (segid "   A" and resid 22   and name C   )  1.00 -134.81 15.00 2 

 ASSIGN  (segid "   A" and resid 23   and name N   ) (segid "   A" and resid 23   and name CA  )
         (segid "   A" and resid 23   and name C   ) (segid "   A" and resid 24   and name N   )  1.00 127.22 20.55 2

 ASSIGN  (segid "   A" and resid 22   and name C   ) (segid "   A" and resid 23   and name N   )
         (segid "   A" and resid 23   and name CA  ) (segid "   A" and resid 23   and name C   )  1.00 -119.76 42.05 2

 ASSIGN  (segid "   A" and resid 26   and name N   ) (segid "   A" and resid 26   and name CA  )
         (segid "   A" and resid 26   and name C   ) (segid "   A" and resid 27   and name N   )  1.00 -14.81 26.52 2

 ASSIGN  (segid "   A" and resid 25   and name C   ) (segid "   A" and resid 26   and name N   )
         (segid "   A" and resid 26   and name CA  ) (segid "   A" and resid 26   and name C   )  1.00 -86.00 20.00 2  

 ASSIGN  (segid "   A" and resid 27   and name N   ) (segid "   A" and resid 27   and name CA  )
         (segid "   A" and resid 27   and name C   ) (segid "   A" and resid 28   and name N   )  1.00 132.58 48.74 2

 ASSIGN  (segid "   A" and resid 26   and name C   ) (segid "   A" and resid 27   and name N   )
         (segid "   A" and resid 27   and name CA  ) (segid "   A" and resid 27   and name C   )  1.00 -99.67 26.76 2

 ASSIGN  (segid "   A" and resid 28   and name N   ) (segid "   A" and resid 28   and name CA  )
         (segid "   A" and resid 28   and name C   ) (segid "   A" and resid 29   and name N   )  1.00 121.27 27.03 2

 ASSIGN  (segid "   A" and resid 27   and name C   ) (segid "   A" and resid 28   and name N   )
         (segid "   A" and resid 28   and name CA  ) (segid "   A" and resid 28   and name C   )  1.00 -107.44 37.98 2

 ASSIGN  (segid "   A" and resid 29   and name N   ) (segid "   A" and resid 29   and name CA  )
         (segid "   A" and resid 29   and name C   ) (segid "   A" and resid 30   and name N   )  1.00 131.01 21.62 2

 ASSIGN  (segid "   A" and resid 28   and name C   ) (segid "   A" and resid 29   and name N   )
         (segid "   A" and resid 29   and name CA  ) (segid "   A" and resid 29   and name C   )  1.00 -121.49 28.50 2

 ASSIGN  (segid "   A" and resid 30   and name N   ) (segid "   A" and resid 30   and name CA  )
         (segid "   A" and resid 30   and name C   ) (segid "   A" and resid 31   and name N   )  1.00 162.29 47.29 2

 ASSIGN  (segid "   A" and resid 29   and name C   ) (segid "   A" and resid 30   and name N   )
         (segid "   A" and resid 30   and name CA  ) (segid "   A" and resid 30   and name C   )  1.00 -113.41 124.42 2

 ASSIGN  (segid "   A" and resid 31   and name N   ) (segid "   A" and resid 31   and name CA  )
         (segid "   A" and resid 31   and name C   ) (segid "   A" and resid 32   and name N   )  1.00 -37.30 17.29 2

 ASSIGN  (segid "   A" and resid 30   and name C   ) (segid "   A" and resid 31   and name N   )
         (segid "   A" and resid 31   and name CA  ) (segid "   A" and resid 31   and name C   )  1.00 -59.45 14.21 2

 ASSIGN  (segid "   A" and resid 32   and name N   ) (segid "   A" and resid 32   and name CA  )
         (segid "   A" and resid 32   and name C   ) (segid "   A" and resid 33   and name N   )  1.00 -38.77 12.98 2

 ASSIGN  (segid "   A" and resid 31   and name C   ) (segid "   A" and resid 32   and name N   )
         (segid "   A" and resid 32   and name CA  ) (segid "   A" and resid 32   and name C   )  1.00 -67.50 12.32 2

 ASSIGN  (segid "   A" and resid 33   and name N   ) (segid "   A" and resid 33   and name CA  )
         (segid "   A" and resid 33   and name C   ) (segid "   A" and resid 34   and name N   )  1.00 -46.14  9.84 2

 ASSIGN  (segid "   A" and resid 32   and name C   ) (segid "   A" and resid 33   and name N   )
         (segid "   A" and resid 33   and name CA  ) (segid "   A" and resid 33   and name C   )  1.00 -63.55  8.06 2

 ASSIGN  (segid "   A" and resid 34   and name N   ) (segid "   A" and resid 34   and name CA  )
         (segid "   A" and resid 34   and name C   ) (segid "   A" and resid 35   and name N   )  1.00 -45.99  6.05 2

 ASSIGN  (segid "   A" and resid 33   and name C   ) (segid "   A" and resid 34   and name N   )
         (segid "   A" and resid 34   and name CA  ) (segid "   A" and resid 34   and name C   )  1.00 -60.71  9.85 2

 ASSIGN  (segid "   A" and resid 35   and name N   ) (segid "   A" and resid 35   and name CA  )
         (segid "   A" and resid 35   and name C   ) (segid "   A" and resid 36   and name N   )  1.00 -39.87  5.30 2

 ASSIGN  (segid "   A" and resid 34   and name C   ) (segid "   A" and resid 35   and name N   )
         (segid "   A" and resid 35   and name CA  ) (segid "   A" and resid 35   and name C   )  1.00 -62.80  5.55 2

 ASSIGN  (segid "   A" and resid 36   and name N   ) (segid "   A" and resid 36   and name CA  )
         (segid "   A" and resid 36   and name C   ) (segid "   A" and resid 37   and name N   )  1.00 -41.57 13.57 2

 ASSIGN  (segid "   A" and resid 35   and name C   ) (segid "   A" and resid 36   and name N   )
         (segid "   A" and resid 36   and name CA  ) (segid "   A" and resid 36   and name C   )  1.00 -65.56  7.38 2

 ASSIGN  (segid "   A" and resid 37   and name N   ) (segid "   A" and resid 37   and name CA  )
         (segid "   A" and resid 37   and name C   ) (segid "   A" and resid 38   and name N   )  1.00 -42.62 10.74 2

 ASSIGN  (segid "   A" and resid 36   and name C   ) (segid "   A" and resid 37   and name N   )
         (segid "   A" and resid 37   and name CA  ) (segid "   A" and resid 37   and name C   )  1.00 -65.60  5.91 2

 ASSIGN  (segid "   A" and resid 38   and name N   ) (segid "   A" and resid 38   and name CA  )
         (segid "   A" and resid 38   and name C   ) (segid "   A" and resid 39   and name N   )  1.00 -40.84 12.00 2

 ASSIGN  (segid "   A" and resid 37   and name C   ) (segid "   A" and resid 38   and name N   )
         (segid "   A" and resid 38   and name CA  ) (segid "   A" and resid 38   and name C   )  1.00 -62.60  8.64 2

 ASSIGN  (segid "   A" and resid 39   and name N   ) (segid "   A" and resid 39   and name CA  )
         (segid "   A" and resid 39   and name C   ) (segid "   A" and resid 40   and name N   )  1.00 -33.50 38.97 2

 ASSIGN  (segid "   A" and resid 38   and name C   ) (segid "   A" and resid 39   and name N   )
         (segid "   A" and resid 39   and name CA  ) (segid "   A" and resid 39   and name C   )  1.00 -67.05 25.01 2

 ASSIGN  (segid "   A" and resid 40   and name N   ) (segid "   A" and resid 40   and name CA  )
         (segid "   A" and resid 40   and name C   ) (segid "   A" and resid 41   and name N   )  1.00 -40.82 22.13 2

 ASSIGN  (segid "   A" and resid 39   and name C   ) (segid "   A" and resid 40   and name N   )
         (segid "   A" and resid 40   and name CA  ) (segid "   A" and resid 40   and name C   )  1.00 -66.60 14.11 2

 ASSIGN  (segid "   A" and resid 41   and name N   ) (segid "   A" and resid 41   and name CA  )
         (segid "   A" and resid 41   and name C   ) (segid "   A" and resid 42   and name N   )  1.00 -37.83 24.35 2

 ASSIGN  (segid "   A" and resid 40   and name C   ) (segid "   A" and resid 41   and name N   )
         (segid "   A" and resid 41   and name CA  ) (segid "   A" and resid 41   and name C   )  1.00 -66.11 20.35 2

 ASSIGN  (segid "   A" and resid 42   and name N   ) (segid "   A" and resid 42   and name CA  )
         (segid "   A" and resid 42   and name C   ) (segid "   A" and resid 43   and name N   )  1.00   0.17 42.53 2

 ASSIGN  (segid "   A" and resid 41   and name C   ) (segid "   A" and resid 42   and name N   )
         (segid "   A" and resid 42   and name CA  ) (segid "   A" and resid 42   and name C   )  1.00 -102.44 30.58 2

# Restraints file 2: ambig.tbl


assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   15 and name   HA) 2.670 0.891 0.891 weight 1.000 ! spec=Expt_10, no=16, id=15, vol=2.175837e+08
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name   HA)
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   15 and name   HA) 2.670 0.891 0.891 weight 1.000 ! spec=Expt_10, no=16, id=15, vol=2.175837e+08
    or (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   11 and name   HA)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name   HA) 2.545 0.809 0.809 weight 1.000 ! spec=Expt_10, no=41, id=40, vol=2.906206e+08
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name   HA)
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   14 and name   HA) 2.545 0.809 0.809 weight 1.000 ! spec=Expt_10, no=41, id=40, vol=2.906206e+08
    or (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name   HA)
assign (segid "   A" and resid   13 and name   HN) (segid "   C" and resid   27 and name  HG2) 3.313 1.372 2.372 weight 1.000 ! spec=Expt_10, no=57, id=55, vol=5.969669e+07
    or (segid "   A" and resid   13 and name   HN) (segid "   C" and resid   27 and name  HB1)
assign (segid "   C" and resid   13 and name   HN) (segid "   A" and resid   27 and name  HG2) 3.313 1.372 2.372 weight 1.000 ! spec=Expt_10, no=57, id=55, vol=5.969669e+07
    or (segid "   C" and resid   13 and name   HN) (segid "   A" and resid   27 and name  HB1)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HB1) 2.468 0.761 0.761 weight 1.000 ! spec=Expt_10, no=68, id=63, vol=3.496018e+08
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HB2)
assign (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   15 and name  HB1) 2.468 0.761 0.761 weight 1.000 ! spec=Expt_10, no=68, id=63, vol=3.496018e+08
    or (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   15 and name  HB2)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HB2) 2.843 1.011 1.011 weight 1.000 ! spec=Expt_10, no=78, id=72, vol=1.492952e+08
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HB1)
assign (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   15 and name  HB2) 2.843 1.011 1.011 weight 1.000 ! spec=Expt_10, no=78, id=72, vol=1.492952e+08
    or (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   15 and name  HB1)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   27 and name  HB1) 3.654 1.669 1.669 weight 1.000 ! spec=Expt_10, no=168, id=151, vol=3.314347e+07
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   34 and name  HG1)
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   27 and name  HB1) 3.654 1.669 1.669 weight 1.000 ! spec=Expt_10, no=168, id=151, vol=3.314347e+07
    or (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   34 and name  HG1)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name   HB) 2.980 1.110 1.110 weight 1.000 ! spec=Expt_10, no=186, id=167, vol=1.126996e+08
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name HG12)
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   29 and name   HB) 2.980 1.110 1.110 weight 1.000 ! spec=Expt_10, no=186, id=167, vol=1.126996e+08
    or (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   29 and name HG12)
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   34 and name  HB1) 2.688 0.903 3.312 weight 1.000 ! spec=Expt_10, no=199, id=180, vol=2.093270e+08
    or (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   20 and name  HB2)
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   34 and name  HB1) 2.688 0.903 3.312 weight 1.000 ! spec=Expt_10, no=199, id=180, vol=2.093270e+08
    or (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   20 and name  HB2)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   36 and name  HG1) 3.319 1.377 1.377 weight 1.000 ! spec=Expt_10, no=228, id=208, vol=5.897954e+07
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   31 and name  HB1)
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   36 and name  HG1) 3.319 1.377 1.377 weight 1.000 ! spec=Expt_10, no=228, id=208, vol=5.897954e+07
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   31 and name  HB1)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   31 and name  HB1) 3.309 1.369 2.691 weight 1.000 ! spec=Expt_10, no=240, id=219, vol=6.005624e+07
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   31 and name   HG)
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   31 and name  HB1) 3.309 1.369 2.691 weight 1.000 ! spec=Expt_10, no=240, id=219, vol=6.005624e+07
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   31 and name   HG)
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name  HB2) 3.273 1.339 1.339 weight 1.000 ! spec=Expt_10, no=309, id=282, vol=6.417638e+07
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name  HB1)
assign (segid "   C" and resid   44 and name   HN) (segid "   C" and resid   43 and name  HB2) 3.273 1.339 1.339 weight 1.000 ! spec=Expt_10, no=309, id=282, vol=6.417638e+07
    or (segid "   C" and resid   44 and name   HN) (segid "   C" and resid   43 and name  HB1)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG12) 2.884 1.040 1.040 weight 1.000 ! spec=Expt_10, no=352, id=322, vol=1.370959e+08
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG11)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG13)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG22)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG23)
assign (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    5 and name HG12) 2.884 1.040 1.040 weight 1.000 ! spec=Expt_10, no=352, id=322, vol=1.370959e+08
    or (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    5 and name HG11)
    or (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    5 and name HG13)
    or (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    5 and name HG22)
    or (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    5 and name HG21)
    or (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    5 and name HG23)
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   29 and name HD12) 2.875 1.033 1.033 weight 1.000 ! spec=Expt_10, no=353, id=323, vol=1.397955e+08
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   29 and name HD11)
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   29 and name HD13)
    or (segid "   A" and resid   24 and name   HN) (segid "   C" and resid   13 and name HD12)
    or (segid "   A" and resid   24 and name   HN) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   24 and name   HN) (segid "   C" and resid   13 and name HD13)
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HD12)
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HD11)
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HD13)
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   29 and name HD12) 2.875 1.033 1.033 weight 1.000 ! spec=Expt_10, no=353, id=323, vol=1.397955e+08
    or (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   29 and name HD11)
    or (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   29 and name HD13)
    or (segid "   C" and resid   24 and name   HN) (segid "   A" and resid   13 and name HD12)
    or (segid "   C" and resid   24 and name   HN) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   24 and name   HN) (segid "   A" and resid   13 and name HD13)
    or (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   24 and name HD12)
    or (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   24 and name HD11)
    or (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   24 and name HD13)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    9 and name  HB1) 3.448 1.486 1.486 weight 1.000 ! spec=Expt_10, no=376, id=334, vol=4.696459e+07
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   18 and name  HG1)
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid    9 and name  HB1) 3.448 1.486 1.486 weight 1.000 ! spec=Expt_10, no=376, id=334, vol=4.696459e+07
    or (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   18 and name  HG1)
assign (segid "   A" and resid   16 and name HE21) (segid "   A" and resid   15 and name  HB1) 3.165 1.252 1.252 weight 1.000 ! spec=Expt_10, no=384, id=338, vol=7.848018e+07
    or (segid "   A" and resid   16 and name HE21) (segid "   A" and resid   15 and name  HB2)
assign (segid "   C" and resid   16 and name HE21) (segid "   C" and resid   15 and name  HB1) 3.165 1.252 1.252 weight 1.000 ! spec=Expt_10, no=384, id=338, vol=7.848018e+07
    or (segid "   C" and resid   16 and name HE21) (segid "   C" and resid   15 and name  HB2)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   29 and name HD12) 3.325 1.382 1.382 weight 1.000 ! spec=Expt_10, no=406, id=355, vol=5.836857e+07
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   29 and name HD11)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   29 and name HD13)
    or (segid "   A" and resid   28 and name   HN) (segid "   C" and resid   13 and name HD12)
    or (segid "   A" and resid   28 and name   HN) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   28 and name   HN) (segid "   C" and resid   13 and name HD13)
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   29 and name HD12) 3.325 1.382 1.382 weight 1.000 ! spec=Expt_10, no=406, id=355, vol=5.836857e+07
    or (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   29 and name HD11)
    or (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   29 and name HD13)
    or (segid "   C" and resid   28 and name   HN) (segid "   A" and resid   13 and name HD12)
    or (segid "   C" and resid   28 and name   HN) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   28 and name   HN) (segid "   A" and resid   13 and name HD13)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   13 and name HG11) 3.514 1.543 1.543 weight 1.000 ! spec=Expt_10, no=420, id=365, vol=4.192081e+07
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   13 and name HG22)
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   13 and name HG23)
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   13 and name HG11) 3.514 1.543 1.543 weight 1.000 ! spec=Expt_10, no=420, id=365, vol=4.192081e+07
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   13 and name HG22)
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   13 and name HG23)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   30 and name  HB1) 3.408 1.452 1.452 weight 1.000 ! spec=Expt_10, no=425, id=369, vol=5.032038e+07
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   32 and name  HB1)
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   30 and name  HB1) 3.408 1.452 1.452 weight 1.000 ! spec=Expt_10, no=425, id=369, vol=5.032038e+07
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   32 and name  HB1)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   29 and name HG22) 3.192 1.273 1.273 weight 1.000 ! spec=Expt_10, no=428, id=371, vol=7.464093e+07
    or (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   29 and name HG23)
    or (segid "   A" and resid   35 and name   HN) (segid "   C" and resid   24 and name HD12)
    or (segid "   A" and resid   35 and name   HN) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   35 and name   HN) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   29 and name HG22) 3.192 1.273 1.273 weight 1.000 ! spec=Expt_10, no=428, id=371, vol=7.464093e+07
    or (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   29 and name HG23)
    or (segid "   C" and resid   35 and name   HN) (segid "   A" and resid   24 and name HD12)
    or (segid "   C" and resid   35 and name   HN) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   35 and name   HN) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   36 and name   HN) (segid "   C" and resid   24 and name HD12) 3.143 1.235 1.235 weight 1.000 ! spec=Expt_10, no=429, id=372, vol=8.180416e+07
    or (segid "   A" and resid   36 and name   HN) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   36 and name   HN) (segid "   C" and resid   24 and name HD13)
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   29 and name HG22)
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   36 and name   HN) (segid "   A" and resid   24 and name HD12) 3.143 1.235 1.235 weight 1.000 ! spec=Expt_10, no=429, id=372, vol=8.180416e+07
    or (segid "   C" and resid   36 and name   HN) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   36 and name   HN) (segid "   A" and resid   24 and name HD13)
    or (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   29 and name HG22)
    or (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   12 and name   HN) (segid "   C" and resid   27 and name  HB1) 3.286 1.350 2.714 weight 1.000 ! spec=Expt_10, no=450, id=388, vol=6.268821e+07
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   18 and name  HG2)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   27 and name  HB1)
assign (segid "   C" and resid   12 and name   HN) (segid "   A" and resid   27 and name  HB1) 3.286 1.350 2.714 weight 1.000 ! spec=Expt_10, no=450, id=388, vol=6.268821e+07
    or (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   18 and name  HG2)
    or (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   27 and name  HB1)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   15 and name  HB1) 3.296 1.358 2.704 weight 1.000 ! spec=Expt_10, no=451, id=389, vol=6.150294e+07
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   15 and name  HB2)
assign (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   15 and name  HB1) 3.296 1.358 2.704 weight 1.000 ! spec=Expt_10, no=451, id=389, vol=6.150294e+07
    or (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   15 and name  HB2)
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name HD12) 2.558 0.818 3.442 weight 1.000 ! spec=Expt_10, no=485, id=409, vol=2.816243e+08
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name HD11)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name HD13)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name HG22)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name HD12) 2.558 0.818 3.442 weight 1.000 ! spec=Expt_10, no=485, id=409, vol=2.816243e+08
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name HD11)
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name HD13)
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name HG22)
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   37 and name HG22) 2.630 0.865 3.370 weight 1.000 ! spec=Expt_10, no=525, id=436, vol=2.384157e+08
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   37 and name HG23)
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   22 and name HG22)
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   22 and name HG21)
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   22 and name HG23)
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   37 and name HG22) 2.630 0.865 3.370 weight 1.000 ! spec=Expt_10, no=525, id=436, vol=2.384157e+08
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   37 and name HG21)
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   37 and name HG23)
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   22 and name HG22)
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   22 and name HG21)
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   22 and name HG23)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HG22) 2.476 0.766 0.766 weight 1.000 ! spec=Expt_10, no=562, id=462, vol=3.425809e+08
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HG23)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HG11)
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HG22) 2.476 0.766 0.766 weight 1.000 ! spec=Expt_10, no=562, id=462, vol=3.425809e+08
    or (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HG23)
    or (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HG11)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HG2) 2.395 0.717 1.317 weight 1.000 ! spec=Expt_10, no=577, id=468, vol=4.184445e+08
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB1)
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   18 and name  HG2) 2.395 0.717 1.317 weight 1.000 ! spec=Expt_10, no=577, id=468, vol=4.184445e+08
    or (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   18 and name  HB1)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   10 and name   HN) 3.515 1.544 1.544 weight 1.000 ! spec=Expt_10, no=579, id=469, vol=4.184357e+07
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid   18 and name   HN)
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   10 and name   HN) 3.515 1.544 1.544 weight 1.000 ! spec=Expt_10, no=579, id=469, vol=4.184357e+07
    or (segid "   C" and resid    9 and name   HN) (segid "   C" and resid   18 and name   HN)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   37 and name HG12) 3.261 1.330 2.739 weight 1.000 ! spec=Expt_10, no=595, id=480, vol=6.555913e+07
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   37 and name HG13)
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   22 and name HG22)
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   22 and name HG21)
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   22 and name HG23)
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   37 and name HG12) 3.261 1.330 2.739 weight 1.000 ! spec=Expt_10, no=595, id=480, vol=6.555913e+07
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   37 and name HG11)
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   37 and name HG13)
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   22 and name HG22)
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   22 and name HG21)
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   22 and name HG23)
assign (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HG11) 2.217 0.614 0.614 weight 1.000 ! spec=Expt_11, no=52, id=529, vol=1.094417e+09
    or (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HG22)
    or (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HG23)
assign (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HG11) 2.217 0.614 0.614 weight 1.000 ! spec=Expt_11, no=52, id=529, vol=1.094417e+09
    or (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HG22)
    or (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HG23)
assign (segid "   A" and resid   25 and name   HA) (segid "   C" and resid   13 and name HG22) 2.915 1.062 1.062 weight 1.000 ! spec=Expt_11, no=61, id=538, vol=2.119435e+08
    or (segid "   A" and resid   25 and name   HA) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   25 and name   HA) (segid "   C" and resid   13 and name HG23)
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   13 and name HG22)
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   13 and name HG23)
assign (segid "   C" and resid   25 and name   HA) (segid "   A" and resid   13 and name HG22) 2.915 1.062 1.062 weight 1.000 ! spec=Expt_11, no=61, id=538, vol=2.119435e+08
    or (segid "   C" and resid   25 and name   HA) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   25 and name   HA) (segid "   A" and resid   13 and name HG23)
    or (segid "   C" and resid   14 and name   HA) (segid "   C" and resid   13 and name HG22)
    or (segid "   C" and resid   14 and name   HA) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   14 and name   HA) (segid "   C" and resid   13 and name HG23)
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name  HB2) 2.177 0.592 0.592 weight 1.000 ! spec=Expt_11, no=66, id=543, vol=1.220781e+09
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name  HB1)
assign (segid "   C" and resid   15 and name   HA) (segid "   C" and resid   15 and name  HB2) 2.177 0.592 0.592 weight 1.000 ! spec=Expt_11, no=66, id=543, vol=1.220781e+09
    or (segid "   C" and resid   15 and name   HA) (segid "   C" and resid   15 and name  HB1)
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   22 and name HG22) 2.719 0.924 0.924 weight 1.000 ! spec=Expt_11, no=86, id=562, vol=3.220736e+08
    or (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   22 and name HG21)
    or (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   22 and name HG23)
    or (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   31 and name HD22)
    or (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   31 and name HD21)
    or (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   31 and name HD23)
assign (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   22 and name HG22) 2.719 0.924 0.924 weight 1.000 ! spec=Expt_11, no=86, id=562, vol=3.220736e+08
    or (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   22 and name HG21)
    or (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   22 and name HG23)
    or (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   31 and name HD22)
    or (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   31 and name HD21)
    or (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   31 and name HD23)
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name HD12) 2.284 0.652 0.652 weight 1.000 ! spec=Expt_11, no=109, id=583, vol=9.148629e+08
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name HD11)
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name HD13)
    or (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name HD12)
    or (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name HD11)
    or (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name HD13)
assign (segid "   C" and resid   24 and name  HB1) (segid "   C" and resid   24 and name HD12) 2.284 0.652 0.652 weight 1.000 ! spec=Expt_11, no=109, id=583, vol=9.148629e+08
    or (segid "   C" and resid   24 and name  HB1) (segid "   C" and resid   24 and name HD11)
    or (segid "   C" and resid   24 and name  HB1) (segid "   C" and resid   24 and name HD13)
    or (segid "   C" and resid   24 and name  HB2) (segid "   C" and resid   24 and name HD12)
    or (segid "   C" and resid   24 and name  HB2) (segid "   C" and resid   24 and name HD11)
    or (segid "   C" and resid   24 and name  HB2) (segid "   C" and resid   24 and name HD13)
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   18 and name  HB1) 2.539 0.806 0.806 weight 1.000 ! spec=Expt_11, no=130, id=602, vol=4.853245e+08
    or (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   18 and name  HG2)
assign (segid "   C" and resid   30 and name  HB2) (segid "   C" and resid   18 and name  HB1) 2.539 0.806 0.806 weight 1.000 ! spec=Expt_11, no=130, id=602, vol=4.853245e+08
    or (segid "   C" and resid   30 and name  HB2) (segid "   C" and resid   18 and name  HG2)
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name  HB1) 2.026 0.513 0.513 weight 1.000 ! spec=Expt_11, no=162, id=633, vol=1.882630e+09
    or (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name  HB2)
assign (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   35 and name  HB1) 2.026 0.513 0.513 weight 1.000 ! spec=Expt_11, no=162, id=633, vol=1.882630e+09
    or (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   35 and name  HB2)
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   35 and name   HA) 2.640 0.871 3.360 weight 1.000 ! spec=Expt_11, no=170, id=641, vol=3.836570e+08
    or (segid "   A" and resid   38 and name   HA) (segid "   C" and resid   35 and name   HA)
assign (segid "   C" and resid   38 and name   HA) (segid "   C" and resid   35 and name   HA) 2.640 0.871 3.360 weight 1.000 ! spec=Expt_11, no=170, id=641, vol=3.836570e+08
    or (segid "   C" and resid   38 and name   HA) (segid "   A" and resid   35 and name   HA)
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   37 and name   HB) 2.856 1.019 3.144 weight 1.000 ! spec=Expt_11, no=180, id=651, vol=2.396676e+08
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   37 and name   HB)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   37 and name   HB)
    or (segid "   A" and resid   38 and name HG22) (segid "   C" and resid   37 and name   HB)
    or (segid "   A" and resid   38 and name HG21) (segid "   C" and resid   37 and name   HB)
    or (segid "   A" and resid   38 and name HG23) (segid "   C" and resid   37 and name   HB)
assign (segid "   C" and resid   38 and name HG22) (segid "   C" and resid   37 and name   HB) 2.856 1.019 3.144 weight 1.000 ! spec=Expt_11, no=180, id=651, vol=2.396676e+08
    or (segid "   C" and resid   38 and name HG21) (segid "   C" and resid   37 and name   HB)
    or (segid "   C" and resid   38 and name HG23) (segid "   C" and resid   37 and name   HB)
    or (segid "   C" and resid   38 and name HG22) (segid "   A" and resid   37 and name   HB)
    or (segid "   C" and resid   38 and name HG21) (segid "   A" and resid   37 and name   HB)
    or (segid "   C" and resid   38 and name HG23) (segid "   A" and resid   37 and name   HB)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name  HB2) 2.039 0.520 0.520 weight 1.000 ! spec=Expt_11, no=186, id=657, vol=1.808206e+09
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name  HB1)
assign (segid "   C" and resid   39 and name   HA) (segid "   C" and resid   39 and name  HB2) 2.039 0.520 0.520 weight 1.000 ! spec=Expt_11, no=186, id=657, vol=1.808206e+09
    or (segid "   C" and resid   39 and name   HA) (segid "   C" and resid   39 and name  HB1)
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name HG21) 2.141 0.573 0.573 weight 1.000 ! spec=Expt_11, no=192, id=663, vol=1.350374e+09
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name HG22)
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name HG23)
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HG21)
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HG23)
assign (segid "   C" and resid   26 and name   HA) (segid "   C" and resid   26 and name HG21) 2.141 0.573 0.573 weight 1.000 ! spec=Expt_11, no=192, id=663, vol=1.350374e+09
    or (segid "   C" and resid   26 and name   HA) (segid "   C" and resid   26 and name HG22)
    or (segid "   C" and resid   26 and name   HA) (segid "   C" and resid   26 and name HG23)
    or (segid "   C" and resid   40 and name   HA) (segid "   C" and resid   40 and name HG21)
    or (segid "   C" and resid   40 and name   HA) (segid "   C" and resid   40 and name HG22)
    or (segid "   C" and resid   40 and name   HA) (segid "   C" and resid   40 and name HG23)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   41 and name  HB2) 2.920 1.066 3.080 weight 1.000 ! spec=Expt_11, no=196, id=667, vol=2.095736e+08
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   43 and name  HB2)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   43 and name  HB1)
assign (segid "   C" and resid   42 and name   HA) (segid "   C" and resid   41 and name  HB2) 2.920 1.066 3.080 weight 1.000 ! spec=Expt_11, no=196, id=667, vol=2.095736e+08
    or (segid "   C" and resid   42 and name   HA) (segid "   C" and resid   43 and name  HB2)
    or (segid "   C" and resid   42 and name   HA) (segid "   C" and resid   43 and name  HB1)
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name HD12) 2.024 0.512 0.512 weight 1.000 ! spec=Expt_11, no=254, id=722, vol=1.891018e+09
    or (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name HD11)
    or (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name HD13)
    or (segid "   A" and resid   24 and name HD12) (segid "   A" and resid   24 and name   HG)
    or (segid "   A" and resid   24 and name HD11) (segid "   A" and resid   24 and name   HG)
    or (segid "   A" and resid   24 and name HD13) (segid "   A" and resid   24 and name   HG)
assign (segid "   C" and resid   24 and name  HB2) (segid "   C" and resid   24 and name HD12) 2.024 0.512 0.512 weight 1.000 ! spec=Expt_11, no=254, id=722, vol=1.891018e+09
    or (segid "   C" and resid   24 and name  HB2) (segid "   C" and resid   24 and name HD11)
    or (segid "   C" and resid   24 and name  HB2) (segid "   C" and resid   24 and name HD13)
    or (segid "   C" and resid   24 and name HD12) (segid "   C" and resid   24 and name   HG)
    or (segid "   C" and resid   24 and name HD11) (segid "   C" and resid   24 and name   HG)
    or (segid "   C" and resid   24 and name HD13) (segid "   C" and resid   24 and name   HG)
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   43 and name  HB1) 2.035 0.518 0.518 weight 1.000 ! spec=Expt_11, no=258, id=726, vol=1.831913e+09
    or (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   43 and name  HB2)
assign (segid "   C" and resid   43 and name   HA) (segid "   C" and resid   43 and name  HB1) 2.035 0.518 0.518 weight 1.000 ! spec=Expt_11, no=258, id=726, vol=1.831913e+09
    or (segid "   C" and resid   43 and name   HA) (segid "   C" and resid   43 and name  HB2)
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HB1) 2.237 0.625 0.625 weight 1.000 ! spec=Expt_11, no=262, id=730, vol=1.037834e+09
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HG1)
assign (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   34 and name  HB1) 2.237 0.625 0.625 weight 1.000 ! spec=Expt_11, no=262, id=730, vol=1.037834e+09
    or (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   34 and name  HG1)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name   HB) 2.055 0.528 0.528 weight 1.000 ! spec=Expt_11, no=276, id=744, vol=1.725656e+09
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name   HB)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name   HB)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name HG12)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name HG12)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name HG12)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   29 and name   HB) 2.055 0.528 0.528 weight 1.000 ! spec=Expt_11, no=276, id=744, vol=1.725656e+09
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   29 and name   HB)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   29 and name   HB)
    or (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   29 and name HG12)
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   29 and name HG12)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   29 and name HG12)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name  HB1) 2.672 0.892 0.892 weight 1.000 ! spec=Expt_11, no=288, id=756, vol=3.574598e+08
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HB1)
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   33 and name  HB1) 2.672 0.892 0.892 weight 1.000 ! spec=Expt_11, no=288, id=756, vol=3.574598e+08
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   33 and name  HB1)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   35 and name  HB2) 2.317 0.671 3.683 weight 1.000 ! spec=Expt_11, no=316, id=780, vol=8.392841e+08
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   35 and name  HB2)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   35 and name  HB2)
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   35 and name  HB1)
assign (segid "   C" and resid   37 and name HG22) (segid "   C" and resid   35 and name  HB2) 2.317 0.671 3.683 weight 1.000 ! spec=Expt_11, no=316, id=780, vol=8.392841e+08
    or (segid "   C" and resid   37 and name HG21) (segid "   C" and resid   35 and name  HB2)
    or (segid "   C" and resid   37 and name HG23) (segid "   C" and resid   35 and name  HB2)
    or (segid "   C" and resid   37 and name HG22) (segid "   C" and resid   35 and name  HB1)
    or (segid "   C" and resid   37 and name HG21) (segid "   C" and resid   35 and name  HB1)
    or (segid "   C" and resid   37 and name HG23) (segid "   C" and resid   35 and name  HB1)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   37 and name   HA) 2.132 0.568 3.868 weight 1.000 ! spec=Expt_11, no=318, id=782, vol=1.385701e+09
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   37 and name   HA)
    or (segid "   A" and resid   37 and name HG22) (segid "   C" and resid   34 and name   HA)
    or (segid "   A" and resid   37 and name HG21) (segid "   C" and resid   34 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   C" and resid   34 and name   HA)
assign (segid "   C" and resid   37 and name HG22) (segid "   C" and resid   37 and name   HA) 2.132 0.568 3.868 weight 1.000 ! spec=Expt_11, no=318, id=782, vol=1.385701e+09
    or (segid "   C" and resid   37 and name HG21) (segid "   C" and resid   37 and name   HA)
    or (segid "   C" and resid   37 and name HG23) (segid "   C" and resid   37 and name   HA)
    or (segid "   C" and resid   37 and name HG22) (segid "   A" and resid   34 and name   HA)
    or (segid "   C" and resid   37 and name HG21) (segid "   A" and resid   34 and name   HA)
    or (segid "   C" and resid   37 and name HG23) (segid "   A" and resid   34 and name   HA)
assign (segid "   A" and resid   29 and name HD12) (segid "   A" and resid   29 and name   HA) 2.791 0.974 0.974 weight 1.000 ! spec=Expt_11, no=358, id=817, vol=2.747603e+08
    or (segid "   A" and resid   29 and name HD11) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   29 and name HD13) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   29 and name HD12) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   29 and name HD11) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   29 and name HD13) (segid "   A" and resid   28 and name   HA)
assign (segid "   C" and resid   29 and name HD12) (segid "   C" and resid   29 and name   HA) 2.791 0.974 0.974 weight 1.000 ! spec=Expt_11, no=358, id=817, vol=2.747603e+08
    or (segid "   C" and resid   29 and name HD11) (segid "   C" and resid   29 and name   HA)
    or (segid "   C" and resid   29 and name HD13) (segid "   C" and resid   29 and name   HA)
    or (segid "   C" and resid   29 and name HD12) (segid "   C" and resid   28 and name   HA)
    or (segid "   C" and resid   29 and name HD11) (segid "   C" and resid   28 and name   HA)
    or (segid "   C" and resid   29 and name HD13) (segid "   C" and resid   28 and name   HA)
assign (segid "   A" and resid   24 and name HD22) (segid "   A" and resid   24 and name  HB1) 2.031 0.516 0.516 weight 1.000 ! spec=Expt_11, no=370, id=827, vol=1.851601e+09
    or (segid "   A" and resid   24 and name HD21) (segid "   A" and resid   24 and name  HB1)
    or (segid "   A" and resid   24 and name HD23) (segid "   A" and resid   24 and name  HB1)
    or (segid "   A" and resid   24 and name HD22) (segid "   A" and resid   24 and name   HG)
    or (segid "   A" and resid   24 and name HD21) (segid "   A" and resid   24 and name   HG)
    or (segid "   A" and resid   24 and name HD23) (segid "   A" and resid   24 and name   HG)
assign (segid "   C" and resid   24 and name HD22) (segid "   C" and resid   24 and name  HB1) 2.031 0.516 0.516 weight 1.000 ! spec=Expt_11, no=370, id=827, vol=1.851601e+09
    or (segid "   C" and resid   24 and name HD21) (segid "   C" and resid   24 and name  HB1)
    or (segid "   C" and resid   24 and name HD23) (segid "   C" and resid   24 and name  HB1)
    or (segid "   C" and resid   24 and name HD22) (segid "   C" and resid   24 and name   HG)
    or (segid "   C" and resid   24 and name HD21) (segid "   C" and resid   24 and name   HG)
    or (segid "   C" and resid   24 and name HD23) (segid "   C" and resid   24 and name   HG)
assign (segid "   A" and resid   35 and name  HD2) (segid "   A" and resid   35 and name  HB2) 1.926 0.464 4.074 weight 1.000 ! spec=Expt_11, no=417, id=872, vol=2.543965e+09
    or (segid "   A" and resid   35 and name  HD2) (segid "   A" and resid   35 and name  HB1)
assign (segid "   C" and resid   35 and name  HD2) (segid "   C" and resid   35 and name  HB2) 1.926 0.464 4.074 weight 1.000 ! spec=Expt_11, no=417, id=872, vol=2.543965e+09
    or (segid "   C" and resid   35 and name  HD2) (segid "   C" and resid   35 and name  HB1)
assign (segid "   A" and resid   31 and name HD22) (segid "   A" and resid   31 and name   HG) 1.828 0.418 0.418 weight 1.000 ! spec=Expt_11, no=502, id=949, vol=3.488307e+09
    or (segid "   A" and resid   31 and name HD21) (segid "   A" and resid   31 and name   HG)
    or (segid "   A" and resid   31 and name HD23) (segid "   A" and resid   31 and name   HG)
    or (segid "   A" and resid   31 and name HD22) (segid "   A" and resid   31 and name  HB1)
    or (segid "   A" and resid   31 and name HD21) (segid "   A" and resid   31 and name  HB1)
    or (segid "   A" and resid   31 and name HD23) (segid "   A" and resid   31 and name  HB1)
assign (segid "   C" and resid   31 and name HD22) (segid "   C" and resid   31 and name   HG) 1.828 0.418 0.418 weight 1.000 ! spec=Expt_11, no=502, id=949, vol=3.488307e+09
    or (segid "   C" and resid   31 and name HD21) (segid "   C" and resid   31 and name   HG)
    or (segid "   C" and resid   31 and name HD23) (segid "   C" and resid   31 and name   HG)
    or (segid "   C" and resid   31 and name HD22) (segid "   C" and resid   31 and name  HB1)
    or (segid "   C" and resid   31 and name HD21) (segid "   C" and resid   31 and name  HB1)
    or (segid "   C" and resid   31 and name HD23) (segid "   C" and resid   31 and name  HB1)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name  HB2) 2.615 0.855 0.855 weight 1.000 ! spec=Expt_11, no=511, id=958, vol=4.062535e+08
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HB2)
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   33 and name  HB2) 2.615 0.855 0.855 weight 1.000 ! spec=Expt_11, no=511, id=958, vol=4.062535e+08
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   33 and name  HB2)
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   18 and name  HG2) 3.198 1.279 1.279 weight 1.000 ! spec=Expt_11, no=555, id=1002, vol=1.214884e+08
    or (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   18 and name  HD1)
assign (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   18 and name  HG2) 3.198 1.279 1.279 weight 1.000 ! spec=Expt_11, no=555, id=1002, vol=1.214884e+08
    or (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   18 and name  HD1)
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name HD12) 1.832 0.419 0.419 weight 1.000 ! spec=Expt_11, no=616, id=1058, vol=3.444033e+09
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name HD11)
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name HD13)
    or (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name HD12)
    or (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name HD11)
    or (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name HD13)
assign (segid "   C" and resid    7 and name  HB2) (segid "   C" and resid    7 and name HD12) 1.832 0.419 0.419 weight 1.000 ! spec=Expt_11, no=616, id=1058, vol=3.444033e+09
    or (segid "   C" and resid    7 and name  HB2) (segid "   C" and resid    7 and name HD11)
    or (segid "   C" and resid    7 and name  HB2) (segid "   C" and resid    7 and name HD13)
    or (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name HD12)
    or (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name HD11)
    or (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name HD13)
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   27 and name   HA) 2.411 0.727 3.589 weight 1.000 ! spec=Expt_11, no=664, id=1105, vol=6.612669e+08
    or (segid "   A" and resid   13 and name   HA) (segid "   C" and resid   27 and name   HA)
assign (segid "   C" and resid   26 and name   HA) (segid "   C" and resid   27 and name   HA) 2.411 0.727 3.589 weight 1.000 ! spec=Expt_11, no=664, id=1105, vol=6.612669e+08
    or (segid "   C" and resid   13 and name   HA) (segid "   A" and resid   27 and name   HA)
assign (segid "   A" and resid   13 and name   HA) (segid "   C" and resid   27 and name  HE2) 3.049 1.162 2.951 weight 1.000 ! spec=Expt_11, no=666, id=1107, vol=1.618622e+08
    or (segid "   A" and resid   13 and name   HA) (segid "   C" and resid   27 and name  HE1)
assign (segid "   C" and resid   13 and name   HA) (segid "   A" and resid   27 and name  HE2) 3.049 1.162 2.951 weight 1.000 ! spec=Expt_11, no=666, id=1107, vol=1.618622e+08
    or (segid "   C" and resid   13 and name   HA) (segid "   A" and resid   27 and name  HE1)
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   45 and name  HD2) 3.140 1.232 1.232 weight 1.000 ! spec=Expt_11, no=685, id=1124, vol=1.356718e+08
    or (segid "   A" and resid   45 and name  HD1) (segid "   A" and resid   44 and name  HB2)
assign (segid "   C" and resid   44 and name  HB2) (segid "   C" and resid   45 and name  HD2) 3.140 1.232 1.232 weight 1.000 ! spec=Expt_11, no=685, id=1124, vol=1.356718e+08
    or (segid "   C" and resid   45 and name  HD1) (segid "   C" and resid   44 and name  HB2)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   40 and name HG21) 3.222 1.298 2.778 weight 1.000 ! spec=Expt_11, no=703, id=1141, vol=1.161798e+08
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   40 and name HG23)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   42 and name HG21)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   42 and name HG22)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   42 and name HG23)
assign (segid "   C" and resid   39 and name   HA) (segid "   C" and resid   40 and name HG21) 3.222 1.298 2.778 weight 1.000 ! spec=Expt_11, no=703, id=1141, vol=1.161798e+08
    or (segid "   C" and resid   39 and name   HA) (segid "   C" and resid   40 and name HG22)
    or (segid "   C" and resid   39 and name   HA) (segid "   C" and resid   40 and name HG23)
    or (segid "   C" and resid   39 and name   HA) (segid "   C" and resid   42 and name HG21)
    or (segid "   C" and resid   39 and name   HA) (segid "   C" and resid   42 and name HG22)
    or (segid "   C" and resid   39 and name   HA) (segid "   C" and resid   42 and name HG23)
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid    8 and name  HB1) 3.155 1.245 2.845 weight 1.000 ! spec=Expt_11, no=734, id=1170, vol=1.317259e+08
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid    9 and name  HB2)
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid    8 and name  HB1) 3.155 1.245 2.845 weight 1.000 ! spec=Expt_11, no=734, id=1170, vol=1.317259e+08
    or (segid "   C" and resid   10 and name   HA) (segid "   C" and resid    9 and name  HB2)
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   18 and name  HG1) 3.380 1.428 1.428 weight 1.000 ! spec=Expt_11, no=740, id=1175, vol=8.717972e+07
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid    9 and name  HB1)
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   18 and name  HG1) 3.380 1.428 1.428 weight 1.000 ! spec=Expt_11, no=740, id=1175, vol=8.717972e+07
    or (segid "   C" and resid   10 and name   HA) (segid "   C" and resid    9 and name  HB1)
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   16 and name  HG1) 3.048 1.161 2.952 weight 1.000 ! spec=Expt_11, no=742, id=1177, vol=1.621874e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   16 and name  HG1)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   16 and name  HG1)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   18 and name  HB2)
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   18 and name  HB2)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   18 and name  HB2)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   16 and name  HG1) 3.048 1.161 2.952 weight 1.000 ! spec=Expt_11, no=742, id=1177, vol=1.621874e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   16 and name  HG1)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   16 and name  HG1)
    or (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   18 and name  HB2)
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   18 and name  HB2)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   18 and name  HB2)
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   17 and name  HB2) 2.733 0.934 3.267 weight 1.000 ! spec=Expt_11, no=746, id=1181, vol=3.119114e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   17 and name  HB2)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   17 and name  HB2)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   18 and name  HD1)
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   18 and name  HD1)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   18 and name  HD1)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   17 and name  HB2) 2.733 0.934 3.267 weight 1.000 ! spec=Expt_11, no=746, id=1181, vol=3.119114e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   17 and name  HB2)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   17 and name  HB2)
    or (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   18 and name  HD1)
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   18 and name  HD1)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   18 and name  HD1)
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid    9 and name  HB1) 2.759 0.952 3.241 weight 1.000 ! spec=Expt_11, no=748, id=1183, vol=2.945809e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid    9 and name  HB1)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid    9 and name  HB1)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   18 and name  HG1)
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   18 and name  HG1)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   18 and name  HG1)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid    9 and name  HB1) 2.759 0.952 3.241 weight 1.000 ! spec=Expt_11, no=748, id=1183, vol=2.945809e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid    9 and name  HB1)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid    9 and name  HB1)
    or (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   18 and name  HG1)
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   18 and name  HG1)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   18 and name  HG1)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   13 and name HD12) 2.128 0.566 3.872 weight 1.000 ! spec=Expt_11, no=761, id=1192, vol=1.399135e+09
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   13 and name HD13)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   13 and name HD12)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   13 and name HD13)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   13 and name HD12)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   13 and name HD13)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   29 and name HG22)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   29 and name HG23)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   29 and name HG22)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   29 and name HG23)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   29 and name HG22)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   13 and name HD12) 2.128 0.566 3.872 weight 1.000 ! spec=Expt_11, no=761, id=1192, vol=1.399135e+09
    or (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   13 and name HD13)
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   13 and name HD12)
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   13 and name HD13)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   13 and name HD12)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   13 and name HD13)
    or (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   29 and name HG22)
    or (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   29 and name HG23)
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   29 and name HG22)
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   29 and name HG23)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   29 and name HG22)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   13 and name HG22) 1.840 0.423 0.423 weight 1.000 ! spec=Expt_11, no=786, id=1209, vol=3.351177e+09
    or (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   13 and name HG23)
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   13 and name HG22)
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   13 and name HG23)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   13 and name HG22)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   13 and name HG23)
    or (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   13 and name HG11)
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   13 and name HG11)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   13 and name HG11)
assign (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   13 and name HG22) 1.840 0.423 0.423 weight 1.000 ! spec=Expt_11, no=786, id=1209, vol=3.351177e+09
    or (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   13 and name HG23)
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   13 and name HG22)
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   13 and name HG23)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   13 and name HG22)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   13 and name HG23)
    or (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   13 and name HG11)
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   13 and name HG11)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   13 and name HG11)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   24 and name   HA) 2.853 1.018 3.147 weight 1.000 ! spec=Expt_11, no=796, id=1217, vol=2.408390e+08
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   24 and name   HA)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   24 and name   HA)
    or (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   12 and name   HA)
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   12 and name   HA)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   12 and name   HA)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   24 and name   HA) 2.853 1.018 3.147 weight 1.000 ! spec=Expt_11, no=796, id=1217, vol=2.408390e+08
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   24 and name   HA)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   24 and name   HA)
    or (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   12 and name   HA)
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   12 and name   HA)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   12 and name   HA)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   27 and name  HE1) 3.005 1.128 1.128 weight 1.000 ! spec=Expt_11, no=799, id=1220, vol=1.767159e+08
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   27 and name  HE1)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   27 and name  HE1)
    or (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   27 and name  HE2)
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   27 and name  HE2)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   27 and name  HE2)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   27 and name  HE1) 3.005 1.128 1.128 weight 1.000 ! spec=Expt_11, no=799, id=1220, vol=1.767159e+08
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   27 and name  HE1)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   27 and name  HE1)
    or (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   27 and name  HE2)
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   27 and name  HE2)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   27 and name  HE2)
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name  HD1) 2.385 0.711 3.615 weight 1.000 ! spec=Expt_11, no=875, id=1288, vol=7.056695e+08
    or (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name  HG2)
assign (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   18 and name  HD1) 2.385 0.711 3.615 weight 1.000 ! spec=Expt_11, no=875, id=1288, vol=7.056695e+08
    or (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   18 and name  HG2)
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name  HD2) 2.502 0.782 0.782 weight 1.000 ! spec=Expt_11, no=876, id=1289, vol=5.302937e+08
    or (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   17 and name   HA)
assign (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   18 and name  HD2) 2.502 0.782 0.782 weight 1.000 ! spec=Expt_11, no=876, id=1289, vol=5.302937e+08
    or (segid "   C" and resid   17 and name  HG1) (segid "   C" and resid   17 and name   HA)
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid    8 and name  HB1) 3.156 1.245 2.844 weight 1.000 ! spec=Expt_11, no=892, id=1305, vol=1.316796e+08
    or (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   16 and name  HG2)
assign (segid "   C" and resid   17 and name  HG1) (segid "   C" and resid    8 and name  HB1) 3.156 1.245 2.844 weight 1.000 ! spec=Expt_11, no=892, id=1305, vol=1.316796e+08
    or (segid "   C" and resid   17 and name  HG1) (segid "   C" and resid   16 and name  HG2)
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   28 and name  HD1) 3.464 1.500 2.536 weight 1.000 ! spec=Expt_11, no=910, id=1320, vol=7.524190e+07
    or (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   28 and name  HD2)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   28 and name  HD1)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   19 and name   HA) (segid "   C" and resid   28 and name  HD1) 3.464 1.500 2.536 weight 1.000 ! spec=Expt_11, no=910, id=1320, vol=7.524190e+07
    or (segid "   C" and resid   19 and name   HA) (segid "   C" and resid   28 and name  HD2)
    or (segid "   C" and resid   18 and name   HA) (segid "   C" and resid   28 and name  HD1)
    or (segid "   C" and resid   18 and name   HA) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid    8 and name   HA) 3.044 1.158 2.956 weight 1.000 ! spec=Expt_11, no=934, id=1340, vol=1.634358e+08
    or (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   11 and name   HA)
assign (segid "   C" and resid   18 and name  HB1) (segid "   C" and resid    8 and name   HA) 3.044 1.158 2.956 weight 1.000 ! spec=Expt_11, no=934, id=1340, vol=1.634358e+08
    or (segid "   C" and resid   18 and name  HB1) (segid "   C" and resid   11 and name   HA)
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   18 and name  HE1) 3.290 1.353 1.353 weight 1.000 ! spec=Expt_11, no=939, id=1345, vol=1.025607e+08
    or (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   18 and name  HE2)
assign (segid "   C" and resid   18 and name  HB1) (segid "   C" and resid   18 and name  HE1) 3.290 1.353 1.353 weight 1.000 ! spec=Expt_11, no=939, id=1345, vol=1.025607e+08
    or (segid "   C" and resid   18 and name  HB1) (segid "   C" and resid   18 and name  HE2)
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid   18 and name  HB1) 2.818 0.992 3.182 weight 1.000 ! spec=Expt_11, no=1002, id=1399, vol=2.598359e+08
    or (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid   18 and name  HG2)
assign (segid "   C" and resid    8 and name  HB1) (segid "   C" and resid   18 and name  HB1) 2.818 0.992 3.182 weight 1.000 ! spec=Expt_11, no=1002, id=1399, vol=2.598359e+08
    or (segid "   C" and resid    8 and name  HB1) (segid "   C" and resid   18 and name  HG2)
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   21 and name  HA2) 3.264 1.332 1.332 weight 1.000 ! spec=Expt_11, no=1026, id=1420, vol=1.075258e+08
    or (segid "   A" and resid   21 and name  HA2) (segid "   A" and resid   34 and name  HB1)
assign (segid "   C" and resid   20 and name  HB2) (segid "   C" and resid   21 and name  HA2) 3.264 1.332 1.332 weight 1.000 ! spec=Expt_11, no=1026, id=1420, vol=1.075258e+08
    or (segid "   C" and resid   21 and name  HA2) (segid "   C" and resid   34 and name  HB1)
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   34 and name  HB1) 3.152 1.242 2.848 weight 1.000 ! spec=Expt_11, no=1027, id=1421, vol=1.324546e+08
    or (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   20 and name  HB2)
assign (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   34 and name  HB1) 3.152 1.242 2.848 weight 1.000 ! spec=Expt_11, no=1027, id=1421, vol=1.324546e+08
    or (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   20 and name  HB2)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   18 and name  HD2) 2.899 1.050 3.101 weight 1.000 ! spec=Expt_11, no=1035, id=1426, vol=2.191360e+08
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   34 and name  HG2)
assign (segid "   C" and resid   11 and name   HA) (segid "   C" and resid   18 and name  HD2) 2.899 1.050 3.101 weight 1.000 ! spec=Expt_11, no=1035, id=1426, vol=2.191360e+08
    or (segid "   C" and resid   22 and name   HA) (segid "   C" and resid   34 and name  HG2)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name   HN) 2.594 0.841 3.406 weight 1.000 ! spec=Expt_11, no=1037, id=1428, vol=4.265442e+08
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   11 and name   HA)
assign (segid "   C" and resid   11 and name   HA) (segid "   C" and resid   14 and name   HN) 2.594 0.841 3.406 weight 1.000 ! spec=Expt_11, no=1037, id=1428, vol=4.265442e+08
    or (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   11 and name   HA)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name   HB) 2.066 0.533 0.533 weight 1.000 ! spec=Expt_11, no=1039, id=1430, vol=1.674047e+09
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name   HB)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name   HB)
    or (segid "   A" and resid   22 and name HG11) (segid "   A" and resid   22 and name   HB)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   22 and name   HB) 2.066 0.533 0.533 weight 1.000 ! spec=Expt_11, no=1039, id=1430, vol=1.674047e+09
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   22 and name   HB)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   22 and name   HB)
    or (segid "   C" and resid   22 and name HG11) (segid "   C" and resid   22 and name   HB)
assign (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   28 and name   HA) 2.841 1.009 3.159 weight 1.000 ! spec=Expt_11, no=1053, id=1441, vol=2.471982e+08
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   29 and name   HA)
assign (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   28 and name   HA) 2.841 1.009 3.159 weight 1.000 ! spec=Expt_11, no=1053, id=1441, vol=2.471982e+08
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   28 and name   HA)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   28 and name   HA)
    or (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   29 and name   HA)
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   29 and name   HA)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   29 and name   HA)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   29 and name   HA) 2.760 0.952 3.240 weight 1.000 ! spec=Expt_11, no=1065, id=1452, vol=2.940150e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   28 and name   HA)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   29 and name   HA) 2.760 0.952 3.240 weight 1.000 ! spec=Expt_11, no=1065, id=1452, vol=2.940150e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   29 and name   HA)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   29 and name   HA)
    or (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   28 and name   HA)
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   28 and name   HA)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   28 and name   HA)
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   22 and name HD12) 3.011 1.134 1.134 weight 1.000 ! spec=Expt_11, no=1078, id=1464, vol=1.743321e+08
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   22 and name HD11)
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   22 and name HD13)
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   24 and name HD12)
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   24 and name HD11)
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   24 and name HD13)
assign (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   22 and name HD12) 3.011 1.134 1.134 weight 1.000 ! spec=Expt_11, no=1078, id=1464, vol=1.743321e+08
    or (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   22 and name HD11)
    or (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   22 and name HD13)
    or (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   24 and name HD12)
    or (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   24 and name HD11)
    or (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   24 and name HD13)
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   24 and name  HB2) 3.218 1.294 2.782 weight 1.000 ! spec=Expt_11, no=1081, id=1467, vol=1.171000e+08
    or (segid "   A" and resid   23 and name  HB2) (segid "   C" and resid   40 and name HG21)
    or (segid "   A" and resid   23 and name  HB2) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   23 and name  HB2) (segid "   C" and resid   40 and name HG23)
assign (segid "   C" and resid   23 and name  HB2) (segid "   C" and resid   24 and name  HB2) 3.218 1.294 2.782 weight 1.000 ! spec=Expt_11, no=1081, id=1467, vol=1.171000e+08
    or (segid "   C" and resid   23 and name  HB2) (segid "   A" and resid   40 and name HG21)
    or (segid "   C" and resid   23 and name  HB2) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   23 and name  HB2) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   22 and name HD12) 3.302 1.363 2.698 weight 1.000 ! spec=Expt_11, no=1082, id=1468, vol=1.002406e+08
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   22 and name HD11)
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   22 and name HD13)
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   24 and name HD12)
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   24 and name HD11)
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   24 and name HD13)
assign (segid "   C" and resid   23 and name  HB2) (segid "   C" and resid   22 and name HD12) 3.302 1.363 2.698 weight 1.000 ! spec=Expt_11, no=1082, id=1468, vol=1.002406e+08
    or (segid "   C" and resid   23 and name  HB2) (segid "   C" and resid   22 and name HD11)
    or (segid "   C" and resid   23 and name  HB2) (segid "   C" and resid   22 and name HD13)
    or (segid "   C" and resid   23 and name  HB2) (segid "   C" and resid   24 and name HD12)
    or (segid "   C" and resid   23 and name  HB2) (segid "   C" and resid   24 and name HD11)
    or (segid "   C" and resid   23 and name  HB2) (segid "   C" and resid   24 and name HD13)
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name   HA) 2.211 0.611 0.611 weight 1.000 ! spec=Expt_11, no=1084, id=1470, vol=1.112232e+09
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name   HA)
assign (segid "   C" and resid   24 and name  HB2) (segid "   C" and resid   24 and name   HA) 2.211 0.611 0.611 weight 1.000 ! spec=Expt_11, no=1084, id=1470, vol=1.112232e+09
    or (segid "   C" and resid   24 and name  HB1) (segid "   C" and resid   24 and name   HA)
assign (segid "   A" and resid   24 and name  HB1) (segid "   C" and resid   13 and name HD12) 2.294 0.658 0.658 weight 1.000 ! spec=Expt_11, no=1091, id=1475, vol=8.916715e+08
    or (segid "   A" and resid   24 and name  HB1) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   24 and name  HB1) (segid "   C" and resid   13 and name HD13)
    or (segid "   A" and resid   24 and name  HB2) (segid "   C" and resid   13 and name HD12)
    or (segid "   A" and resid   24 and name  HB2) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   24 and name  HB2) (segid "   C" and resid   13 and name HD13)
assign (segid "   C" and resid   24 and name  HB1) (segid "   A" and resid   13 and name HD12) 2.294 0.658 0.658 weight 1.000 ! spec=Expt_11, no=1091, id=1475, vol=8.916715e+08
    or (segid "   C" and resid   24 and name  HB1) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   24 and name  HB1) (segid "   A" and resid   13 and name HD13)
    or (segid "   C" and resid   24 and name  HB2) (segid "   A" and resid   13 and name HD12)
    or (segid "   C" and resid   24 and name  HB2) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   24 and name  HB2) (segid "   A" and resid   13 and name HD13)
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   27 and name  HB1) 3.297 1.359 1.359 weight 1.000 ! spec=Expt_11, no=1093, id=1477, vol=1.012625e+08
    or (segid "   A" and resid   24 and name  HB2) (segid "   C" and resid   36 and name  HB1)
    or (segid "   A" and resid   24 and name  HB1) (segid "   C" and resid   36 and name  HB1)
assign (segid "   C" and resid   24 and name  HB2) (segid "   C" and resid   27 and name  HB1) 3.297 1.359 1.359 weight 1.000 ! spec=Expt_11, no=1093, id=1477, vol=1.012625e+08
    or (segid "   C" and resid   24 and name  HB2) (segid "   A" and resid   36 and name  HB1)
    or (segid "   C" and resid   24 and name  HB1) (segid "   A" and resid   36 and name  HB1)
assign (segid "   A" and resid   24 and name  HB1) (segid "   C" and resid   36 and name  HB1) 3.233 1.307 2.767 weight 1.000 ! spec=Expt_11, no=1094, id=1478, vol=1.137941e+08
    or (segid "   A" and resid   24 and name  HB2) (segid "   C" and resid   36 and name  HB1)
assign (segid "   C" and resid   24 and name  HB1) (segid "   A" and resid   36 and name  HB1) 3.233 1.307 2.767 weight 1.000 ! spec=Expt_11, no=1094, id=1478, vol=1.137941e+08
    or (segid "   C" and resid   24 and name  HB2) (segid "   A" and resid   36 and name  HB1)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   36 and name  HG2) 2.457 0.755 3.543 weight 1.000 ! spec=Expt_11, no=1116, id=1500, vol=5.909461e+08
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   36 and name  HG2)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   36 and name  HG2)
    or (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   36 and name  HD2)
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   36 and name  HD2)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   36 and name  HD2)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   36 and name  HG2) 2.457 0.755 3.543 weight 1.000 ! spec=Expt_11, no=1116, id=1500, vol=5.909461e+08
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   36 and name  HG2)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   36 and name  HG2)
    or (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   36 and name  HD2)
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   36 and name  HD2)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   36 and name  HD2)
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name HD12) 2.055 0.528 0.528 weight 1.000 ! spec=Expt_11, no=1119, id=1502, vol=1.728324e+09
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name HD11)
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name HD13)
    or (segid "   A" and resid   24 and name HD12) (segid "   A" and resid   24 and name   HG)
    or (segid "   A" and resid   24 and name HD11) (segid "   A" and resid   24 and name   HG)
    or (segid "   A" and resid   24 and name HD13) (segid "   A" and resid   24 and name   HG)
assign (segid "   C" and resid   24 and name  HB1) (segid "   C" and resid   24 and name HD12) 2.055 0.528 0.528 weight 1.000 ! spec=Expt_11, no=1119, id=1502, vol=1.728324e+09
    or (segid "   C" and resid   24 and name  HB1) (segid "   C" and resid   24 and name HD11)
    or (segid "   C" and resid   24 and name  HB1) (segid "   C" and resid   24 and name HD13)
    or (segid "   C" and resid   24 and name HD12) (segid "   C" and resid   24 and name   HG)
    or (segid "   C" and resid   24 and name HD11) (segid "   C" and resid   24 and name   HG)
    or (segid "   C" and resid   24 and name HD13) (segid "   C" and resid   24 and name   HG)
assign (segid "   A" and resid   24 and name HD12) (segid "   A" and resid   25 and name   HA) 3.235 1.308 2.765 weight 1.000 ! spec=Expt_11, no=1137, id=1517, vol=1.133898e+08
    or (segid "   A" and resid   24 and name HD11) (segid "   A" and resid   25 and name   HA)
    or (segid "   A" and resid   24 and name HD13) (segid "   A" and resid   25 and name   HA)
    or (segid "   A" and resid   14 and name   HA) (segid "   C" and resid   24 and name HD12)
    or (segid "   A" and resid   14 and name   HA) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   14 and name   HA) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   24 and name HD12) (segid "   C" and resid   25 and name   HA) 3.235 1.308 2.765 weight 1.000 ! spec=Expt_11, no=1137, id=1517, vol=1.133898e+08
    or (segid "   C" and resid   24 and name HD11) (segid "   C" and resid   25 and name   HA)
    or (segid "   C" and resid   24 and name HD13) (segid "   C" and resid   25 and name   HA)
    or (segid "   C" and resid   14 and name   HA) (segid "   A" and resid   24 and name HD12)
    or (segid "   C" and resid   14 and name   HA) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   14 and name   HA) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   26 and name HG21) 2.891 1.045 1.045 weight 1.000 ! spec=Expt_11, no=1140, id=1520, vol=2.226752e+08
    or (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   26 and name HG22)
    or (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   26 and name HG23)
    or (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   24 and name  HB1)
assign (segid "   C" and resid   25 and name   HA) (segid "   C" and resid   26 and name HG21) 2.891 1.045 1.045 weight 1.000 ! spec=Expt_11, no=1140, id=1520, vol=2.226752e+08
    or (segid "   C" and resid   25 and name   HA) (segid "   C" and resid   26 and name HG22)
    or (segid "   C" and resid   25 and name   HA) (segid "   C" and resid   26 and name HG23)
    or (segid "   C" and resid   25 and name   HA) (segid "   C" and resid   24 and name  HB1)
assign (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   24 and name  HB2) 2.820 0.994 3.180 weight 1.000 ! spec=Expt_11, no=1178, id=1550, vol=2.586865e+08
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   26 and name HG21)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   26 and name HG22)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   26 and name HG23)
assign (segid "   C" and resid   27 and name  HB2) (segid "   C" and resid   24 and name  HB2) 2.820 0.994 3.180 weight 1.000 ! spec=Expt_11, no=1178, id=1550, vol=2.586865e+08
    or (segid "   C" and resid   27 and name  HB2) (segid "   C" and resid   26 and name HG21)
    or (segid "   C" and resid   27 and name  HB2) (segid "   C" and resid   26 and name HG22)
    or (segid "   C" and resid   27 and name  HB2) (segid "   C" and resid   26 and name HG23)
assign (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   27 and name  HE1) 2.851 1.016 1.016 weight 1.000 ! spec=Expt_11, no=1191, id=1559, vol=2.423448e+08
    or (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   27 and name  HE2)
assign (segid "   C" and resid   27 and name  HG2) (segid "   C" and resid   27 and name  HE1) 2.851 1.016 1.016 weight 1.000 ! spec=Expt_11, no=1191, id=1559, vol=2.423448e+08
    or (segid "   C" and resid   27 and name  HG2) (segid "   C" and resid   27 and name  HE2)
assign (segid "   A" and resid   27 and name  HE2) (segid "   A" and resid   27 and name  HD2) 2.314 0.669 0.669 weight 1.000 ! spec=Expt_11, no=1200, id=1567, vol=8.472440e+08
    or (segid "   A" and resid   27 and name  HE1) (segid "   A" and resid   27 and name  HD2)
assign (segid "   C" and resid   27 and name  HE2) (segid "   C" and resid   27 and name  HD2) 2.314 0.669 0.669 weight 1.000 ! spec=Expt_11, no=1200, id=1567, vol=8.472440e+08
    or (segid "   C" and resid   27 and name  HE1) (segid "   C" and resid   27 and name  HD2)
assign (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   28 and name   HA) 3.321 1.378 1.378 weight 1.000 ! spec=Expt_11, no=1239, id=1593, vol=9.693625e+07
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   29 and name   HA)
assign (segid "   C" and resid   28 and name  HE1) (segid "   C" and resid   28 and name   HA) 3.321 1.378 1.378 weight 1.000 ! spec=Expt_11, no=1239, id=1593, vol=9.693625e+07
    or (segid "   C" and resid   28 and name  HE2) (segid "   C" and resid   28 and name   HA)
    or (segid "   C" and resid   28 and name  HE1) (segid "   C" and resid   29 and name   HA)
    or (segid "   C" and resid   28 and name  HE2) (segid "   C" and resid   29 and name   HA)
assign (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   29 and name HD12) 2.076 0.539 0.539 weight 1.000 ! spec=Expt_11, no=1246, id=1599, vol=1.625143e+09
    or (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   29 and name HD11)
    or (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   29 and name HD13)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name   HB)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name   HB)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name   HB)
assign (segid "   C" and resid   29 and name   HB) (segid "   C" and resid   29 and name HD12) 2.076 0.539 0.539 weight 1.000 ! spec=Expt_11, no=1246, id=1599, vol=1.625143e+09
    or (segid "   C" and resid   29 and name   HB) (segid "   C" and resid   29 and name HD11)
    or (segid "   C" and resid   29 and name   HB) (segid "   C" and resid   29 and name HD13)
    or (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   29 and name   HB)
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   29 and name   HB)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   29 and name   HB)
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name HD12) 2.001 0.500 0.500 weight 1.000 ! spec=Expt_11, no=1249, id=1602, vol=2.028277e+09
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name HD11)
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name HD13)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name HG12)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name HG12)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name HG12)
assign (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   29 and name HD12) 2.001 0.500 0.500 weight 1.000 ! spec=Expt_11, no=1249, id=1602, vol=2.028277e+09
    or (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   29 and name HD11)
    or (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   29 and name HD13)
    or (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   29 and name HG12)
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   29 and name HG12)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   29 and name HG12)
assign (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   29 and name HD12) 1.999 0.499 0.499 weight 1.000 ! spec=Expt_11, no=1253, id=1605, vol=2.038848e+09
    or (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   29 and name HD11)
    or (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   29 and name HD13)
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name HD12)
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name HD11)
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name HD13)
assign (segid "   C" and resid   29 and name   HB) (segid "   C" and resid   29 and name HD12) 1.999 0.499 0.499 weight 1.000 ! spec=Expt_11, no=1253, id=1605, vol=2.038848e+09
    or (segid "   C" and resid   29 and name   HB) (segid "   C" and resid   29 and name HD11)
    or (segid "   C" and resid   29 and name   HB) (segid "   C" and resid   29 and name HD13)
    or (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   29 and name HD12)
    or (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   29 and name HD11)
    or (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   29 and name HD13)
assign (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   40 and name   HB) 3.049 1.162 2.951 weight 1.000 ! spec=Expt_11, no=1260, id=1611, vol=1.616846e+08
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   40 and name   HB)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   40 and name   HB)
    or (segid "   A" and resid   29 and name HD12) (segid "   A" and resid   31 and name   HA)
    or (segid "   A" and resid   29 and name HD11) (segid "   A" and resid   31 and name   HA)
    or (segid "   A" and resid   29 and name HD13) (segid "   A" and resid   31 and name   HA)
assign (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   40 and name   HB) 3.049 1.162 2.951 weight 1.000 ! spec=Expt_11, no=1260, id=1611, vol=1.616846e+08
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   40 and name   HB)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   40 and name   HB)
    or (segid "   C" and resid   29 and name HD12) (segid "   C" and resid   31 and name   HA)
    or (segid "   C" and resid   29 and name HD11) (segid "   C" and resid   31 and name   HA)
    or (segid "   C" and resid   29 and name HD13) (segid "   C" and resid   31 and name   HA)
assign (segid "   A" and resid   29 and name HG22) (segid "   C" and resid   12 and name   HB) 2.531 0.801 3.469 weight 1.000 ! spec=Expt_11, no=1267, id=1615, vol=4.947799e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   C" and resid   12 and name   HB)
    or (segid "   A" and resid   29 and name HG23) (segid "   C" and resid   12 and name   HB)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   12 and name   HB)
assign (segid "   C" and resid   29 and name HG22) (segid "   A" and resid   12 and name   HB) 2.531 0.801 3.469 weight 1.000 ! spec=Expt_11, no=1267, id=1615, vol=4.947799e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   A" and resid   12 and name   HB)
    or (segid "   C" and resid   29 and name HG23) (segid "   A" and resid   12 and name   HB)
    or (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   12 and name   HB)
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   12 and name   HB)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   12 and name   HB)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   13 and name   HB) 2.461 0.757 3.539 weight 1.000 ! spec=Expt_11, no=1268, id=1616, vol=5.856932e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   13 and name   HB)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   13 and name   HB)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   30 and name  HB1)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   30 and name  HB1)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   30 and name  HB1)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   13 and name   HB) 2.461 0.757 3.539 weight 1.000 ! spec=Expt_11, no=1268, id=1616, vol=5.856932e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   13 and name   HB)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   13 and name   HB)
    or (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   30 and name  HB1)
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   30 and name  HB1)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   30 and name  HB1)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   29 and name HG22) 3.285 1.349 1.349 weight 1.000 ! spec=Expt_11, no=1274, id=1622, vol=1.034787e+08
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   29 and name HG23)
    or (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   29 and name HG22)
    or (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   29 and name HG22) 3.285 1.349 1.349 weight 1.000 ! spec=Expt_11, no=1274, id=1622, vol=1.034787e+08
    or (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   29 and name HG23)
    or (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   29 and name HG22)
    or (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name HD22) 2.917 1.064 3.083 weight 1.000 ! spec=Expt_11, no=1281, id=1628, vol=2.109685e+08
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name HD21)
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name HD23)
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name HD12)
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name HD11)
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name HD13)
assign (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   31 and name HD22) 2.917 1.064 3.083 weight 1.000 ! spec=Expt_11, no=1281, id=1628, vol=2.109685e+08
    or (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   31 and name HD21)
    or (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   31 and name HD23)
    or (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   31 and name HD12)
    or (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   31 and name HD11)
    or (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   31 and name HD13)
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   30 and name  HB1) 2.569 0.825 3.431 weight 1.000 ! spec=Expt_11, no=1291, id=1636, vol=4.524900e+08
    or (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   18 and name  HD1)
assign (segid "   C" and resid   18 and name  HB1) (segid "   C" and resid   30 and name  HB1) 2.569 0.825 3.431 weight 1.000 ! spec=Expt_11, no=1291, id=1636, vol=4.524900e+08
    or (segid "   C" and resid   30 and name  HB1) (segid "   C" and resid   18 and name  HD1)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   33 and name   HA) 2.720 0.925 0.925 weight 1.000 ! spec=Expt_11, no=1334, id=1670, vol=3.210860e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   33 and name   HA)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   33 and name   HA)
    or (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   13 and name HD12)
    or (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   13 and name HD13)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   33 and name   HA) 2.720 0.925 0.925 weight 1.000 ! spec=Expt_11, no=1334, id=1670, vol=3.210860e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   33 and name   HA)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   33 and name   HA)
    or (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   13 and name HD12)
    or (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   13 and name HD13)
assign (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   35 and name   HN) 3.425 1.466 1.466 weight 1.000 ! spec=Expt_11, no=1343, id=1677, vol=8.055608e+07
    or (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   32 and name   HN)
assign (segid "   C" and resid   33 and name  HB2) (segid "   C" and resid   35 and name   HN) 3.425 1.466 1.466 weight 1.000 ! spec=Expt_11, no=1343, id=1677, vol=8.055608e+07
    or (segid "   C" and resid   33 and name  HB2) (segid "   C" and resid   32 and name   HN)
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   31 and name   HG) 3.242 1.314 2.758 weight 1.000 ! spec=Expt_11, no=1355, id=1686, vol=1.120078e+08
    or (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid   34 and name  HB2)
assign (segid "   C" and resid   34 and name  HB2) (segid "   C" and resid   31 and name   HG) 3.242 1.314 2.758 weight 1.000 ! spec=Expt_11, no=1355, id=1686, vol=1.120078e+08
    or (segid "   C" and resid   31 and name  HB1) (segid "   C" and resid   34 and name  HB2)
assign (segid "   A" and resid   29 and name HD12) (segid "   A" and resid   34 and name  HG1) 2.355 0.694 3.645 weight 1.000 ! spec=Expt_11, no=1370, id=1697, vol=7.611578e+08
    or (segid "   A" and resid   29 and name HD11) (segid "   A" and resid   34 and name  HG1)
    or (segid "   A" and resid   29 and name HD13) (segid "   A" and resid   34 and name  HG1)
    or (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   29 and name HG22)
    or (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   29 and name HD12) (segid "   C" and resid   34 and name  HG1) 2.355 0.694 3.645 weight 1.000 ! spec=Expt_11, no=1370, id=1697, vol=7.611578e+08
    or (segid "   C" and resid   29 and name HD11) (segid "   C" and resid   34 and name  HG1)
    or (segid "   C" and resid   29 and name HD13) (segid "   C" and resid   34 and name  HG1)
    or (segid "   C" and resid   34 and name  HG1) (segid "   C" and resid   29 and name HG22)
    or (segid "   C" and resid   34 and name  HG1) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   34 and name  HG1) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   34 and name  HG2) (segid "   C" and resid   37 and name HG22) 2.254 0.635 0.635 weight 1.000 ! spec=Expt_11, no=1375, id=1701, vol=9.924992e+08
    or (segid "   A" and resid   34 and name  HG2) (segid "   C" and resid   37 and name HG21)
    or (segid "   A" and resid   34 and name  HG2) (segid "   C" and resid   37 and name HG23)
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   34 and name  HG2)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   34 and name  HG2)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   34 and name  HG2)
assign (segid "   C" and resid   34 and name  HG2) (segid "   A" and resid   37 and name HG22) 2.254 0.635 0.635 weight 1.000 ! spec=Expt_11, no=1375, id=1701, vol=9.924992e+08
    or (segid "   C" and resid   34 and name  HG2) (segid "   A" and resid   37 and name HG21)
    or (segid "   C" and resid   34 and name  HG2) (segid "   A" and resid   37 and name HG23)
    or (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   34 and name  HG2)
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   34 and name  HG2)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   34 and name  HG2)
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name   HA) 2.026 0.513 3.974 weight 1.000 ! spec=Expt_11, no=1381, id=1706, vol=1.882630e+09
    or (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   38 and name   HB)
assign (segid "   C" and resid   35 and name  HG2) (segid "   C" and resid   35 and name   HA) 2.026 0.513 3.974 weight 1.000 ! spec=Expt_11, no=1381, id=1706, vol=1.882630e+09
    or (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   38 and name   HB)
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   35 and name   HA) 2.397 0.718 3.603 weight 1.000 ! spec=Expt_11, no=1383, id=1707, vol=6.857002e+08
    or (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   38 and name HG12)
assign (segid "   C" and resid   35 and name  HG1) (segid "   C" and resid   35 and name   HA) 2.397 0.718 3.603 weight 1.000 ! spec=Expt_11, no=1383, id=1707, vol=6.857002e+08
    or (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   38 and name HG12)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   36 and name  HB1) 3.062 1.172 1.172 weight 1.000 ! spec=Expt_11, no=1439, id=1757, vol=1.576290e+08
    or (segid "   A" and resid   37 and name   HA) (segid "   C" and resid   34 and name  HG1)
assign (segid "   C" and resid   37 and name   HA) (segid "   C" and resid   36 and name  HB1) 3.062 1.172 1.172 weight 1.000 ! spec=Expt_11, no=1439, id=1757, vol=1.576290e+08
    or (segid "   C" and resid   37 and name   HA) (segid "   A" and resid   34 and name  HG1)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   37 and name   HA) 1.984 0.492 4.016 weight 1.000 ! spec=Expt_11, no=1441, id=1759, vol=2.130933e+09
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   37 and name   HA)
    or (segid "   A" and resid   37 and name   HA) (segid "   C" and resid   22 and name HG22)
    or (segid "   A" and resid   37 and name   HA) (segid "   C" and resid   22 and name HG21)
    or (segid "   A" and resid   37 and name   HA) (segid "   C" and resid   22 and name HG23)
assign (segid "   C" and resid   37 and name HG22) (segid "   C" and resid   37 and name   HA) 1.984 0.492 4.016 weight 1.000 ! spec=Expt_11, no=1441, id=1759, vol=2.130933e+09
    or (segid "   C" and resid   37 and name HG21) (segid "   C" and resid   37 and name   HA)
    or (segid "   C" and resid   37 and name HG23) (segid "   C" and resid   37 and name   HA)
    or (segid "   C" and resid   37 and name   HA) (segid "   A" and resid   22 and name HG22)
    or (segid "   C" and resid   37 and name   HA) (segid "   A" and resid   22 and name HG21)
    or (segid "   C" and resid   37 and name   HA) (segid "   A" and resid   22 and name HG23)
assign (segid "   A" and resid   38 and name HD12) (segid "   C" and resid   39 and name   HA) 3.026 1.145 2.974 weight 1.000 ! spec=Expt_11, no=1463, id=1777, vol=1.691953e+08
    or (segid "   A" and resid   38 and name HD11) (segid "   C" and resid   39 and name   HA)
    or (segid "   A" and resid   38 and name HD13) (segid "   C" and resid   39 and name   HA)
    or (segid "   A" and resid   38 and name HD12) (segid "   A" and resid   39 and name   HA)
    or (segid "   A" and resid   38 and name HD11) (segid "   A" and resid   39 and name   HA)
    or (segid "   A" and resid   38 and name HD13) (segid "   A" and resid   39 and name   HA)
assign (segid "   C" and resid   38 and name HD12) (segid "   A" and resid   39 and name   HA) 3.026 1.145 2.974 weight 1.000 ! spec=Expt_11, no=1463, id=1777, vol=1.691953e+08
    or (segid "   C" and resid   38 and name HD11) (segid "   A" and resid   39 and name   HA)
    or (segid "   C" and resid   38 and name HD13) (segid "   A" and resid   39 and name   HA)
    or (segid "   C" and resid   38 and name HD12) (segid "   C" and resid   39 and name   HA)
    or (segid "   C" and resid   38 and name HD11) (segid "   C" and resid   39 and name   HA)
    or (segid "   C" and resid   38 and name HD13) (segid "   C" and resid   39 and name   HA)
assign (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   19 and name   HA) 2.907 1.056 3.093 weight 1.000 ! spec=Expt_14, no=62, id=1840, vol=9.605615e+07
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   19 and name   HA)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   18 and name   HA)
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   18 and name   HA)
assign (segid "   C" and resid   28 and name  HE1) (segid "   C" and resid   19 and name   HA) 2.907 1.056 3.093 weight 1.000 ! spec=Expt_14, no=62, id=1840, vol=9.605615e+07
    or (segid "   C" and resid   28 and name  HE2) (segid "   C" and resid   19 and name   HA)
    or (segid "   C" and resid   28 and name  HE1) (segid "   C" and resid   18 and name   HA)
    or (segid "   C" and resid   28 and name  HE2) (segid "   C" and resid   18 and name   HA)
# Restraints file 3: unambig.tbl


assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name   HN) 3.291 1.354 1.354 weight 1.000 ! spec=Expt_10, no=1, id=0, vol=6.208913e+07
assign (segid "   C" and resid   10 and name   HN) (segid "   C" and resid   11 and name   HN) 3.291 1.354 1.354 weight 1.000 ! spec=Expt_10, no=1, id=0, vol=6.208913e+07
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name HG21) 2.965 1.099 1.099 weight 1.000 ! spec=Expt_10, no=2, id=1, vol=1.160274e+08
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   10 and name   HN) (segid "   C" and resid   10 and name HG21) 2.965 1.099 1.099 weight 1.000 ! spec=Expt_10, no=2, id=1, vol=1.160274e+08
    or (segid "   C" and resid   10 and name   HN) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   10 and name   HN) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name   HA) 2.952 1.089 1.089 weight 1.000 ! spec=Expt_10, no=3, id=2, vol=1.191790e+08
assign (segid "   C" and resid   10 and name   HN) (segid "   C" and resid   10 and name   HA) 2.952 1.089 1.089 weight 1.000 ! spec=Expt_10, no=3, id=2, vol=1.191790e+08
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name   HA) 2.334 0.681 3.666 weight 1.000 ! spec=Expt_10, no=4, id=3, vol=4.885225e+08
assign (segid "   C" and resid   10 and name   HN) (segid "   C" and resid    9 and name   HA) 2.334 0.681 3.666 weight 1.000 ! spec=Expt_10, no=4, id=3, vol=4.885225e+08
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name   HB) 2.385 0.711 3.615 weight 1.000 ! spec=Expt_10, no=5, id=4, vol=4.284818e+08
assign (segid "   C" and resid   10 and name   HN) (segid "   C" and resid   10 and name   HB) 2.385 0.711 3.615 weight 1.000 ! spec=Expt_10, no=5, id=4, vol=4.284818e+08
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name  HB2) 2.649 0.877 3.351 weight 1.000 ! spec=Expt_10, no=6, id=5, vol=2.284036e+08
assign (segid "   C" and resid   10 and name   HN) (segid "   C" and resid    9 and name  HB2) 2.649 0.877 3.351 weight 1.000 ! spec=Expt_10, no=6, id=5, vol=2.284036e+08
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name  HB1) 2.897 1.049 1.049 weight 1.000 ! spec=Expt_10, no=7, id=6, vol=1.335351e+08
assign (segid "   C" and resid   10 and name   HN) (segid "   C" and resid    9 and name  HB1) 2.897 1.049 1.049 weight 1.000 ! spec=Expt_10, no=7, id=6, vol=1.335351e+08
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name   HN) 3.385 1.432 1.432 weight 1.000 ! spec=Expt_10, no=8, id=7, vol=5.249056e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   12 and name   HN) 3.385 1.432 1.432 weight 1.000 ! spec=Expt_10, no=8, id=7, vol=5.249056e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   30 and name   HN) 3.600 1.620 1.620 weight 1.000 ! spec=Expt_10, no=9, id=8, vol=3.623688e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   30 and name   HN) 3.600 1.620 1.620 weight 1.000 ! spec=Expt_10, no=9, id=8, vol=3.623688e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   15 and name   HN) 3.331 1.387 1.387 weight 1.000 ! spec=Expt_10, no=12, id=11, vol=5.773969e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   15 and name   HN) 3.331 1.387 1.387 weight 1.000 ! spec=Expt_10, no=12, id=11, vol=5.773969e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   28 and name  HE1) 3.425 1.466 1.466 weight 1.000 ! spec=Expt_10, no=13, id=12, vol=4.890183e+07
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   28 and name  HE1) 3.425 1.466 1.466 weight 1.000 ! spec=Expt_10, no=13, id=12, vol=4.890183e+07
    or (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   28 and name  HD1) 3.033 1.150 1.150 weight 1.000 ! spec=Expt_10, no=14, id=13, vol=1.012767e+08
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   28 and name  HD1) 3.033 1.150 1.150 weight 1.000 ! spec=Expt_10, no=14, id=13, vol=1.012767e+08
    or (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   17 and name   HA) 2.655 0.881 3.345 weight 1.000 ! spec=Expt_10, no=15, id=14, vol=2.254612e+08
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   17 and name   HA) 2.655 0.881 3.345 weight 1.000 ! spec=Expt_10, no=15, id=14, vol=2.254612e+08
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name   HA) 2.155 0.580 0.580 weight 1.000 ! spec=Expt_10, no=17, id=16, vol=7.880655e+08
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   10 and name   HA) 2.155 0.580 0.580 weight 1.000 ! spec=Expt_10, no=17, id=16, vol=7.880655e+08
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name   HB) 3.113 1.212 1.212 weight 1.000 ! spec=Expt_10, no=18, id=17, vol=8.663554e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   10 and name   HB) 3.113 1.212 1.212 weight 1.000 ! spec=Expt_10, no=18, id=17, vol=8.663554e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB2) 2.417 0.730 0.730 weight 1.000 ! spec=Expt_10, no=19, id=18, vol=3.956494e+08
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   11 and name  HB2) 2.417 0.730 0.730 weight 1.000 ! spec=Expt_10, no=19, id=18, vol=3.956494e+08
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   30 and name  HB2) 3.485 1.518 2.515 weight 1.000 ! spec=Expt_10, no=20, id=19, vol=4.406308e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   30 and name  HB2) 3.485 1.518 2.515 weight 1.000 ! spec=Expt_10, no=20, id=19, vol=4.406308e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB1) 2.454 0.753 0.753 weight 1.000 ! spec=Expt_10, no=21, id=20, vol=3.608888e+08
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   11 and name  HB1) 2.454 0.753 0.753 weight 1.000 ! spec=Expt_10, no=21, id=20, vol=3.608888e+08
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name HG21) 2.503 0.783 0.783 weight 1.000 ! spec=Expt_10, no=22, id=21, vol=3.212340e+08
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   10 and name HG21) 2.503 0.783 0.783 weight 1.000 ! spec=Expt_10, no=22, id=21, vol=3.212340e+08
    or (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   18 and name  HD1) 3.256 1.325 2.325 weight 1.000 ! spec=Expt_10, no=23, id=22, vol=6.624093e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   18 and name  HD1) 3.256 1.325 2.325 weight 1.000 ! spec=Expt_10, no=23, id=22, vol=6.624093e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   16 and name  HG1) 3.296 1.358 2.858 weight 1.000 ! spec=Expt_10, no=24, id=23, vol=6.151652e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   16 and name  HG1) 3.296 1.358 2.858 weight 1.000 ! spec=Expt_10, no=24, id=23, vol=6.151652e+07
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   29 and name   HN) 3.551 1.576 1.576 weight 1.000 ! spec=Expt_10, no=25, id=24, vol=3.934790e+07
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   29 and name   HN) 3.551 1.576 1.576 weight 1.000 ! spec=Expt_10, no=25, id=24, vol=3.934790e+07
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   28 and name  HD1) 2.847 1.013 1.013 weight 1.000 ! spec=Expt_10, no=26, id=25, vol=1.482446e+08
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   28 and name  HD1) 2.847 1.013 1.013 weight 1.000 ! spec=Expt_10, no=26, id=25, vol=1.482446e+08
    or (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name   HA) 2.281 0.650 0.650 weight 1.000 ! spec=Expt_10, no=28, id=27, vol=5.602208e+08
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   11 and name   HA) 2.281 0.650 0.650 weight 1.000 ! spec=Expt_10, no=28, id=27, vol=5.602208e+08
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   28 and name  HB2) 3.199 1.279 2.801 weight 1.000 ! spec=Expt_10, no=31, id=30, vol=7.357715e+07
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   28 and name  HB2) 3.199 1.279 2.801 weight 1.000 ! spec=Expt_10, no=31, id=30, vol=7.357715e+07
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name   HB) 2.487 0.773 3.513 weight 1.000 ! spec=Expt_10, no=32, id=31, vol=3.337457e+08
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   12 and name   HB) 2.487 0.773 3.513 weight 1.000 ! spec=Expt_10, no=32, id=31, vol=3.337457e+08
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name  HB1) 2.925 1.070 3.075 weight 1.000 ! spec=Expt_10, no=33, id=32, vol=1.258921e+08
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   11 and name  HB1) 2.925 1.070 3.075 weight 1.000 ! spec=Expt_10, no=33, id=32, vol=1.258921e+08
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG22) 2.368 0.701 0.701 weight 1.000 ! spec=Expt_10, no=35, id=34, vol=4.472445e+08
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG23)
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   12 and name HG22) 2.368 0.701 0.701 weight 1.000 ! spec=Expt_10, no=35, id=34, vol=4.472445e+08
    or (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   12 and name HG21)
    or (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   12 and name HG23)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name   HN) 2.367 0.700 3.633 weight 1.000 ! spec=Expt_10, no=37, id=36, vol=4.487186e+08
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name   HN) 2.367 0.700 3.633 weight 1.000 ! spec=Expt_10, no=37, id=36, vol=4.487186e+08
assign (segid "   A" and resid   14 and name   HN) (segid "   C" and resid   25 and name  HD1) 3.483 1.516 1.516 weight 1.000 ! spec=Expt_10, no=39, id=38, vol=4.421263e+07
    or (segid "   A" and resid   14 and name   HN) (segid "   C" and resid   25 and name  HD2)
assign (segid "   C" and resid   14 and name   HN) (segid "   A" and resid   25 and name  HD1) 3.483 1.516 1.516 weight 1.000 ! spec=Expt_10, no=39, id=38, vol=4.421263e+07
    or (segid "   C" and resid   14 and name   HN) (segid "   A" and resid   25 and name  HD2)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name   HA) 2.916 1.063 3.084 weight 1.000 ! spec=Expt_10, no=40, id=39, vol=1.282687e+08
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   15 and name   HA) 2.916 1.063 3.084 weight 1.000 ! spec=Expt_10, no=40, id=39, vol=1.282687e+08
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   11 and name  HB2) 2.859 1.022 1.022 weight 1.000 ! spec=Expt_10, no=42, id=41, vol=1.443906e+08
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   11 and name  HB2) 2.859 1.022 1.022 weight 1.000 ! spec=Expt_10, no=42, id=41, vol=1.443906e+08
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HB2) 2.710 0.918 3.290 weight 1.000 ! spec=Expt_10, no=43, id=42, vol=1.992651e+08
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   14 and name  HB2) 2.710 0.918 3.290 weight 1.000 ! spec=Expt_10, no=43, id=42, vol=1.992651e+08
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name   HB) 2.276 0.647 0.647 weight 1.000 ! spec=Expt_10, no=44, id=43, vol=5.678133e+08
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name   HB) 2.276 0.647 0.647 weight 1.000 ! spec=Expt_10, no=44, id=43, vol=5.678133e+08
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HB1) 2.664 0.887 0.887 weight 1.000 ! spec=Expt_10, no=45, id=44, vol=2.207167e+08
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   14 and name  HB1) 2.664 0.887 0.887 weight 1.000 ! spec=Expt_10, no=45, id=44, vol=2.207167e+08
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HG12) 3.099 1.201 1.201 weight 1.000 ! spec=Expt_10, no=46, id=45, vol=8.905973e+07
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HG12) 3.099 1.201 1.201 weight 1.000 ! spec=Expt_10, no=46, id=45, vol=8.905973e+07
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   29 and name   HA) 3.422 1.463 1.463 weight 1.000 ! spec=Expt_10, no=50, id=48, vol=4.917906e+07
assign (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   29 and name   HA) 3.422 1.463 1.463 weight 1.000 ! spec=Expt_10, no=50, id=48, vol=4.917906e+07
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   11 and name   HA) 3.035 1.151 2.151 weight 1.000 ! spec=Expt_10, no=51, id=49, vol=1.009831e+08
assign (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   11 and name   HA) 3.035 1.151 2.151 weight 1.000 ! spec=Expt_10, no=51, id=49, vol=1.009831e+08
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name   HA) 2.587 0.836 0.836 weight 1.000 ! spec=Expt_10, no=53, id=51, vol=2.634748e+08
assign (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   13 and name   HA) 2.587 0.836 0.836 weight 1.000 ! spec=Expt_10, no=53, id=51, vol=2.634748e+08
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   11 and name  HB2) 3.368 1.418 2.418 weight 1.000 ! spec=Expt_10, no=54, id=52, vol=5.403223e+07
assign (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   11 and name  HB2) 3.368 1.418 2.418 weight 1.000 ! spec=Expt_10, no=54, id=52, vol=5.403223e+07
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name   HB) 2.391 0.715 0.715 weight 1.000 ! spec=Expt_10, no=55, id=53, vol=4.223829e+08
assign (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   13 and name   HB) 2.391 0.715 0.715 weight 1.000 ! spec=Expt_10, no=55, id=53, vol=4.223829e+08
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name   HB) 3.049 1.162 2.951 weight 1.000 ! spec=Expt_10, no=56, id=54, vol=9.816521e+07
assign (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   12 and name   HB) 3.049 1.162 2.951 weight 1.000 ! spec=Expt_10, no=56, id=54, vol=9.816521e+07
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name HG12) 2.660 0.885 0.885 weight 1.000 ! spec=Expt_10, no=58, id=56, vol=2.225755e+08
assign (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   13 and name HG12) 2.660 0.885 0.885 weight 1.000 ! spec=Expt_10, no=58, id=56, vol=2.225755e+08
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   15 and name   HN) 3.006 1.129 1.129 weight 1.000 ! spec=Expt_10, no=62, id=57, vol=1.070348e+08
assign (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   15 and name   HN) 3.006 1.129 1.129 weight 1.000 ! spec=Expt_10, no=62, id=57, vol=1.070348e+08
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name   HN) 2.392 0.715 0.715 weight 1.000 ! spec=Expt_10, no=63, id=58, vol=4.210047e+08
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   15 and name   HN) 2.392 0.715 0.715 weight 1.000 ! spec=Expt_10, no=63, id=58, vol=4.210047e+08
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   16 and name   HN) 2.436 0.742 0.742 weight 1.000 ! spec=Expt_10, no=64, id=59, vol=3.773563e+08
assign (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   16 and name   HN) 2.436 0.742 0.742 weight 1.000 ! spec=Expt_10, no=64, id=59, vol=3.773563e+08
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name   HA) 2.014 0.507 0.507 weight 1.000 ! spec=Expt_10, no=65, id=60, vol=1.180745e+09
assign (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   15 and name   HA) 2.014 0.507 0.507 weight 1.000 ! spec=Expt_10, no=65, id=60, vol=1.180745e+09
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name   HA) 2.751 0.946 0.946 weight 1.000 ! spec=Expt_10, no=66, id=61, vol=1.819415e+08
assign (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   14 and name   HA) 2.751 0.946 0.946 weight 1.000 ! spec=Expt_10, no=66, id=61, vol=1.819415e+08
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   11 and name  HB2) 2.754 0.948 3.246 weight 1.000 ! spec=Expt_10, no=67, id=62, vol=1.808869e+08
assign (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   11 and name  HB2) 2.754 0.948 3.246 weight 1.000 ! spec=Expt_10, no=67, id=62, vol=1.808869e+08
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   16 and name   HN) 2.844 1.011 1.011 weight 1.000 ! spec=Expt_10, no=72, id=66, vol=1.492413e+08
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   16 and name   HN) 2.844 1.011 1.011 weight 1.000 ! spec=Expt_10, no=72, id=66, vol=1.492413e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   17 and name   HN) 3.099 1.200 1.200 weight 1.000 ! spec=Expt_10, no=73, id=67, vol=8.908107e+07
assign (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   17 and name   HN) 3.099 1.200 1.200 weight 1.000 ! spec=Expt_10, no=73, id=67, vol=8.908107e+07
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   42 and name   HN) 3.145 1.237 1.237 weight 1.000 ! spec=Expt_10, no=74, id=68, vol=8.148762e+07
assign (segid "   C" and resid   41 and name   HN) (segid "   C" and resid   42 and name   HN) 3.145 1.237 1.237 weight 1.000 ! spec=Expt_10, no=74, id=68, vol=8.148762e+07
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name   HN) 2.350 0.690 3.650 weight 1.000 ! spec=Expt_10, no=75, id=69, vol=4.684293e+08
assign (segid "   C" and resid   41 and name   HN) (segid "   C" and resid   40 and name   HN) 2.350 0.690 3.650 weight 1.000 ! spec=Expt_10, no=75, id=69, vol=4.684293e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name   HA) 2.280 0.650 0.650 weight 1.000 ! spec=Expt_10, no=76, id=70, vol=5.616734e+08
assign (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   16 and name   HA) 2.280 0.650 0.650 weight 1.000 ! spec=Expt_10, no=76, id=70, vol=5.616734e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   11 and name  HB2) 2.532 0.802 3.468 weight 1.000 ! spec=Expt_10, no=77, id=71, vol=2.992804e+08
assign (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   11 and name  HB2) 2.532 0.802 3.468 weight 1.000 ! spec=Expt_10, no=77, id=71, vol=2.992804e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name  HB2) 2.356 0.694 1.694 weight 1.000 ! spec=Expt_10, no=81, id=75, vol=4.619181e+08
assign (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   16 and name  HB2) 2.356 0.694 1.694 weight 1.000 ! spec=Expt_10, no=81, id=75, vol=4.619181e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name  HB1) 2.514 0.790 3.486 weight 1.000 ! spec=Expt_10, no=82, id=76, vol=3.125310e+08
assign (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   16 and name  HB1) 2.514 0.790 3.486 weight 1.000 ! spec=Expt_10, no=82, id=76, vol=3.125310e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   10 and name HG21) 2.895 1.048 1.048 weight 1.000 ! spec=Expt_10, no=84, id=77, vol=1.340770e+08
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   10 and name HG21) 2.895 1.048 1.048 weight 1.000 ! spec=Expt_10, no=84, id=77, vol=1.340770e+08
    or (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   18 and name   HN) 2.961 1.096 1.096 weight 1.000 ! spec=Expt_10, no=85, id=78, vol=1.171243e+08
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   18 and name   HN) 2.961 1.096 1.096 weight 1.000 ! spec=Expt_10, no=85, id=78, vol=1.171243e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name   HA) 2.643 0.873 0.873 weight 1.000 ! spec=Expt_10, no=86, id=79, vol=2.312880e+08
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   17 and name   HA) 2.643 0.873 0.873 weight 1.000 ! spec=Expt_10, no=86, id=79, vol=2.312880e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name   HA) 2.065 0.533 0.533 weight 1.000 ! spec=Expt_10, no=87, id=80, vol=1.018416e+09
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   16 and name   HA) 2.065 0.533 0.533 weight 1.000 ! spec=Expt_10, no=87, id=80, vol=1.018416e+09
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   10 and name   HA) 3.241 1.313 1.313 weight 1.000 ! spec=Expt_10, no=88, id=81, vol=6.814195e+07
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   10 and name   HA) 3.241 1.313 1.313 weight 1.000 ! spec=Expt_10, no=88, id=81, vol=6.814195e+07
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HB1) 2.285 0.653 1.653 weight 1.000 ! spec=Expt_10, no=90, id=83, vol=5.539636e+08
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   16 and name  HB1) 2.285 0.653 1.653 weight 1.000 ! spec=Expt_10, no=90, id=83, vol=5.539636e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HB2) 2.200 0.605 3.800 weight 1.000 ! spec=Expt_10, no=91, id=84, vol=6.967629e+08
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   17 and name  HB2) 2.200 0.605 3.800 weight 1.000 ! spec=Expt_10, no=91, id=84, vol=6.967629e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HB1) 2.353 0.692 3.647 weight 1.000 ! spec=Expt_10, no=92, id=85, vol=4.644424e+08
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   17 and name  HB1) 2.353 0.692 3.647 weight 1.000 ! spec=Expt_10, no=92, id=85, vol=4.644424e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   10 and name HG21) 3.252 1.322 1.322 weight 1.000 ! spec=Expt_10, no=93, id=86, vol=6.668947e+07
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   10 and name HG21) 3.252 1.322 1.322 weight 1.000 ! spec=Expt_10, no=93, id=86, vol=6.668947e+07
    or (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name   HA) 2.059 0.530 0.530 weight 1.000 ! spec=Expt_10, no=95, id=88, vol=1.036899e+09
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   17 and name   HA) 2.059 0.530 0.530 weight 1.000 ! spec=Expt_10, no=95, id=88, vol=1.036899e+09
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid    8 and name   HA) 2.950 1.088 1.588 weight 1.000 ! spec=Expt_10, no=96, id=89, vol=1.197649e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid    8 and name   HA) 2.950 1.088 1.588 weight 1.000 ! spec=Expt_10, no=96, id=89, vol=1.197649e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   10 and name   HA) 2.756 0.949 3.244 weight 1.000 ! spec=Expt_10, no=97, id=90, vol=1.801902e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   10 and name   HA) 2.756 0.949 3.244 weight 1.000 ! spec=Expt_10, no=97, id=90, vol=1.801902e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   11 and name  HB1) 3.344 1.398 2.656 weight 1.000 ! spec=Expt_10, no=98, id=91, vol=5.642197e+07
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   11 and name  HB1) 3.344 1.398 2.656 weight 1.000 ! spec=Expt_10, no=98, id=91, vol=5.642197e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid    8 and name  HB1) 2.906 1.056 1.056 weight 1.000 ! spec=Expt_10, no=99, id=92, vol=1.309432e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid    8 and name  HB1) 2.906 1.056 1.056 weight 1.000 ! spec=Expt_10, no=99, id=92, vol=1.309432e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HD2) 2.839 1.007 1.007 weight 1.000 ! spec=Expt_10, no=101, id=93, vol=1.507351e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   18 and name  HD2) 2.839 1.007 1.007 weight 1.000 ! spec=Expt_10, no=101, id=93, vol=1.507351e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HG1) 2.855 1.019 2.019 weight 1.000 ! spec=Expt_10, no=103, id=94, vol=1.458175e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   18 and name  HG1) 2.855 1.019 2.019 weight 1.000 ! spec=Expt_10, no=103, id=94, vol=1.458175e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   10 and name HG21) 3.330 1.386 1.386 weight 1.000 ! spec=Expt_10, no=104, id=95, vol=5.783242e+07
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   10 and name HG21) 3.330 1.386 1.386 weight 1.000 ! spec=Expt_10, no=104, id=95, vol=5.783242e+07
    or (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name   HA) 3.004 1.128 1.128 weight 1.000 ! spec=Expt_10, no=105, id=96, vol=1.073829e+08
assign (segid "   C" and resid   21 and name   HN) (segid "   C" and resid   20 and name   HA) 3.004 1.128 1.128 weight 1.000 ! spec=Expt_10, no=105, id=96, vol=1.073829e+08
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name  HA1) 3.362 1.413 1.413 weight 1.000 ! spec=Expt_10, no=106, id=97, vol=5.462006e+07
assign (segid "   C" and resid   21 and name   HN) (segid "   C" and resid   21 and name  HA1) 3.362 1.413 1.413 weight 1.000 ! spec=Expt_10, no=106, id=97, vol=5.462006e+07
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name   HN) 3.284 1.348 1.348 weight 1.000 ! spec=Expt_10, no=107, id=98, vol=6.296295e+07
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   21 and name   HN) 3.284 1.348 1.348 weight 1.000 ! spec=Expt_10, no=107, id=98, vol=6.296295e+07
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name   HN) 2.789 0.972 0.972 weight 1.000 ! spec=Expt_10, no=108, id=99, vol=1.676493e+08
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name   HN) 2.789 0.972 0.972 weight 1.000 ! spec=Expt_10, no=108, id=99, vol=1.676493e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   28 and name   HZ) 3.510 1.540 1.540 weight 1.000 ! spec=Expt_10, no=111, id=102, vol=4.219900e+07
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   28 and name   HZ) 3.510 1.540 1.540 weight 1.000 ! spec=Expt_10, no=111, id=102, vol=4.219900e+07
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   28 and name  HD1) 3.577 1.599 1.599 weight 1.000 ! spec=Expt_10, no=112, id=103, vol=3.769382e+07
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   28 and name  HD1) 3.577 1.599 1.599 weight 1.000 ! spec=Expt_10, no=112, id=103, vol=3.769382e+07
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name   HA) 2.686 0.902 0.902 weight 1.000 ! spec=Expt_10, no=113, id=104, vol=2.099521e+08
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   22 and name   HA) 2.686 0.902 0.902 weight 1.000 ! spec=Expt_10, no=113, id=104, vol=2.099521e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   30 and name   HA) 2.964 1.098 1.098 weight 1.000 ! spec=Expt_10, no=114, id=105, vol=1.162889e+08
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   30 and name   HA) 2.964 1.098 1.098 weight 1.000 ! spec=Expt_10, no=114, id=105, vol=1.162889e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name  HA2) 2.401 0.721 0.721 weight 1.000 ! spec=Expt_10, no=115, id=106, vol=4.116220e+08
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   21 and name  HA2) 2.401 0.721 0.721 weight 1.000 ! spec=Expt_10, no=115, id=106, vol=4.116220e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name  HA1) 2.446 0.748 0.748 weight 1.000 ! spec=Expt_10, no=116, id=107, vol=3.680743e+08
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   21 and name  HA1) 2.446 0.748 0.748 weight 1.000 ! spec=Expt_10, no=116, id=107, vol=3.680743e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name   HB) 3.023 1.142 1.142 weight 1.000 ! spec=Expt_10, no=117, id=108, vol=1.034028e+08
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   22 and name   HB) 3.023 1.142 1.142 weight 1.000 ! spec=Expt_10, no=117, id=108, vol=1.034028e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG12) 2.604 0.848 0.848 weight 1.000 ! spec=Expt_10, no=118, id=109, vol=2.531691e+08
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   22 and name HG12) 2.604 0.848 0.848 weight 1.000 ! spec=Expt_10, no=118, id=109, vol=2.531691e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG22) 2.240 0.627 0.627 weight 1.000 ! spec=Expt_10, no=119, id=110, vol=6.249110e+08
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG21)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG23)
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   22 and name HG22) 2.240 0.627 0.627 weight 1.000 ! spec=Expt_10, no=119, id=110, vol=6.249110e+08
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   22 and name HG21)
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   22 and name HG23)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HN) 3.244 1.315 1.315 weight 1.000 ! spec=Expt_10, no=120, id=111, vol=6.775994e+07
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name   HN) 3.244 1.315 1.315 weight 1.000 ! spec=Expt_10, no=120, id=111, vol=6.775994e+07
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   24 and name   HN) 3.205 1.284 1.284 weight 1.000 ! spec=Expt_10, no=121, id=112, vol=7.286648e+07
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   24 and name   HN) 3.205 1.284 1.284 weight 1.000 ! spec=Expt_10, no=121, id=112, vol=7.286648e+07
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name   HA) 2.829 1.000 1.000 weight 1.000 ! spec=Expt_10, no=123, id=114, vol=1.540522e+08
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   23 and name   HA) 2.829 1.000 1.000 weight 1.000 ! spec=Expt_10, no=123, id=114, vol=1.540522e+08
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HA) 2.179 0.593 3.821 weight 1.000 ! spec=Expt_10, no=124, id=115, vol=7.380834e+08
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name   HA) 2.179 0.593 3.821 weight 1.000 ! spec=Expt_10, no=124, id=115, vol=7.380834e+08
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HB2) 2.410 0.726 3.590 weight 1.000 ! spec=Expt_10, no=125, id=116, vol=4.029534e+08
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   23 and name  HB2) 2.410 0.726 3.590 weight 1.000 ! spec=Expt_10, no=125, id=116, vol=4.029534e+08
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HB) 2.341 0.685 3.659 weight 1.000 ! spec=Expt_10, no=126, id=117, vol=4.788703e+08
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name   HB) 2.341 0.685 3.659 weight 1.000 ! spec=Expt_10, no=126, id=117, vol=4.788703e+08
assign (segid "   A" and resid   23 and name   HN) (segid "   C" and resid   40 and name HG21) 3.069 1.177 2.931 weight 1.000 ! spec=Expt_10, no=127, id=118, vol=9.452424e+07
    or (segid "   A" and resid   23 and name   HN) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   23 and name   HN) (segid "   C" and resid   40 and name HG23)
assign (segid "   C" and resid   23 and name   HN) (segid "   A" and resid   40 and name HG21) 3.069 1.177 2.931 weight 1.000 ! spec=Expt_10, no=127, id=118, vol=9.452424e+07
    or (segid "   C" and resid   23 and name   HN) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   23 and name   HN) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   29 and name   HN) 3.401 1.446 2.599 weight 1.000 ! spec=Expt_10, no=132, id=121, vol=5.094501e+07
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   29 and name   HN) 3.401 1.446 2.599 weight 1.000 ! spec=Expt_10, no=132, id=121, vol=5.094501e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name   HA) 2.264 0.641 0.641 weight 1.000 ! spec=Expt_10, no=133, id=122, vol=5.852748e+08
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   23 and name   HA) 2.264 0.641 0.641 weight 1.000 ! spec=Expt_10, no=133, id=122, vol=5.852748e+08
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name  HB2) 2.733 0.933 3.267 weight 1.000 ! spec=Expt_10, no=136, id=125, vol=1.895330e+08
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   23 and name  HB2) 2.733 0.933 3.267 weight 1.000 ! spec=Expt_10, no=136, id=125, vol=1.895330e+08
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   27 and name  HB2) 3.337 1.392 2.663 weight 1.000 ! spec=Expt_10, no=137, id=126, vol=5.718117e+07
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   27 and name  HB2) 3.337 1.392 2.663 weight 1.000 ! spec=Expt_10, no=137, id=126, vol=5.718117e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   C" and resid   13 and name HG22) 3.524 1.552 1.552 weight 1.000 ! spec=Expt_10, no=138, id=127, vol=4.122577e+07
    or (segid "   A" and resid   24 and name   HN) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   24 and name   HN) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   24 and name   HN) (segid "   A" and resid   13 and name HG22) 3.524 1.552 1.552 weight 1.000 ! spec=Expt_10, no=138, id=127, vol=4.122577e+07
    or (segid "   C" and resid   24 and name   HN) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   24 and name   HN) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name   HA) 2.628 0.863 0.863 weight 1.000 ! spec=Expt_10, no=140, id=128, vol=2.396472e+08
assign (segid "   C" and resid   25 and name   HN) (segid "   C" and resid   24 and name   HA) 2.628 0.863 0.863 weight 1.000 ! spec=Expt_10, no=140, id=128, vol=2.396472e+08
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   27 and name   HN) 2.772 0.960 0.960 weight 1.000 ! spec=Expt_10, no=141, id=129, vol=1.740813e+08
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   27 and name   HN) 2.772 0.960 0.960 weight 1.000 ! spec=Expt_10, no=141, id=129, vol=1.740813e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   25 and name  HB1) 2.986 1.115 3.014 weight 1.000 ! spec=Expt_10, no=146, id=130, vol=1.112517e+08
assign (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   25 and name  HB1) 2.986 1.115 3.014 weight 1.000 ! spec=Expt_10, no=146, id=130, vol=1.112517e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB2) 2.438 0.743 3.562 weight 1.000 ! spec=Expt_10, no=147, id=131, vol=3.754791e+08
assign (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   27 and name  HB2) 2.438 0.743 3.562 weight 1.000 ! spec=Expt_10, no=147, id=131, vol=3.754791e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HG1) 2.541 0.807 3.459 weight 1.000 ! spec=Expt_10, no=148, id=132, vol=2.932296e+08
assign (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   27 and name  HG1) 2.541 0.807 3.459 weight 1.000 ! spec=Expt_10, no=148, id=132, vol=2.932296e+08
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   12 and name   HN) 3.385 1.433 2.615 weight 1.000 ! spec=Expt_10, no=149, id=133, vol=5.242712e+07
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   12 and name   HN) 3.385 1.433 2.615 weight 1.000 ! spec=Expt_10, no=149, id=133, vol=5.242712e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   29 and name   HN) 3.134 1.228 1.228 weight 1.000 ! spec=Expt_10, no=150, id=134, vol=8.322087e+07
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   29 and name   HN) 3.134 1.228 1.228 weight 1.000 ! spec=Expt_10, no=150, id=134, vol=8.322087e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HD1) 3.168 1.255 1.255 weight 1.000 ! spec=Expt_10, no=151, id=135, vol=7.800974e+07
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   28 and name  HD1) 3.168 1.255 1.255 weight 1.000 ! spec=Expt_10, no=151, id=135, vol=7.800974e+07
    or (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name   HA) 2.787 0.971 0.971 weight 1.000 ! spec=Expt_10, no=152, id=136, vol=1.685355e+08
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   28 and name   HA) 2.787 0.971 0.971 weight 1.000 ! spec=Expt_10, no=152, id=136, vol=1.685355e+08
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name   HA) 2.241 0.628 3.759 weight 1.000 ! spec=Expt_10, no=153, id=137, vol=6.222796e+08
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   27 and name   HA) 2.241 0.628 3.759 weight 1.000 ! spec=Expt_10, no=153, id=137, vol=6.222796e+08
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HB2) 2.511 0.788 3.489 weight 1.000 ! spec=Expt_10, no=154, id=138, vol=3.147683e+08
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   28 and name  HB2) 2.511 0.788 3.489 weight 1.000 ! spec=Expt_10, no=154, id=138, vol=3.147683e+08
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HB1) 2.512 0.789 3.488 weight 1.000 ! spec=Expt_10, no=155, id=139, vol=3.142393e+08
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   28 and name  HB1) 2.512 0.789 3.488 weight 1.000 ! spec=Expt_10, no=155, id=139, vol=3.142393e+08
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HB2) 2.949 1.087 1.087 weight 1.000 ! spec=Expt_10, no=156, id=140, vol=1.199148e+08
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   27 and name  HB2) 2.949 1.087 1.087 weight 1.000 ! spec=Expt_10, no=156, id=140, vol=1.199148e+08
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HB1) 2.511 0.788 0.788 weight 1.000 ! spec=Expt_10, no=157, id=141, vol=3.145796e+08
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   36 and name  HB1) 2.511 0.788 0.788 weight 1.000 ! spec=Expt_10, no=157, id=141, vol=3.145796e+08
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HD1) 2.908 1.057 1.057 weight 1.000 ! spec=Expt_10, no=162, id=145, vol=1.303844e+08
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   28 and name  HD1) 2.908 1.057 1.057 weight 1.000 ! spec=Expt_10, no=162, id=145, vol=1.303844e+08
    or (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   23 and name   HA) 2.954 1.091 3.046 weight 1.000 ! spec=Expt_10, no=163, id=146, vol=1.186894e+08
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   23 and name   HA) 2.954 1.091 3.046 weight 1.000 ! spec=Expt_10, no=163, id=146, vol=1.186894e+08
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name   HA) 2.246 0.631 0.631 weight 1.000 ! spec=Expt_10, no=164, id=147, vol=6.143168e+08
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   28 and name   HA) 2.246 0.631 0.631 weight 1.000 ! spec=Expt_10, no=164, id=147, vol=6.143168e+08
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   11 and name   HA) 2.981 1.111 3.019 weight 1.000 ! spec=Expt_10, no=165, id=148, vol=1.124094e+08
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   11 and name   HA) 2.981 1.111 3.019 weight 1.000 ! spec=Expt_10, no=165, id=148, vol=1.124094e+08
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HB2) 3.272 1.338 1.338 weight 1.000 ! spec=Expt_10, no=166, id=149, vol=6.434528e+07
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   28 and name  HB2) 3.272 1.338 1.338 weight 1.000 ! spec=Expt_10, no=166, id=149, vol=6.434528e+07
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HB1) 3.155 1.244 1.244 weight 1.000 ! spec=Expt_10, no=167, id=150, vol=8.002240e+07
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   28 and name  HB1) 3.155 1.244 1.244 weight 1.000 ! spec=Expt_10, no=167, id=150, vol=8.002240e+07
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   22 and name HG12) 2.948 1.087 1.087 weight 1.000 ! spec=Expt_10, no=170, id=152, vol=1.201022e+08
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   22 and name HG12) 2.948 1.087 1.087 weight 1.000 ! spec=Expt_10, no=170, id=152, vol=1.201022e+08
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   22 and name HG11) 2.697 0.909 3.303 weight 1.000 ! spec=Expt_10, no=171, id=153, vol=2.049386e+08
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   22 and name HG11) 2.697 0.909 3.303 weight 1.000 ! spec=Expt_10, no=171, id=153, vol=2.049386e+08
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   33 and name   HN) 3.294 1.357 1.357 weight 1.000 ! spec=Expt_10, no=173, id=154, vol=6.172578e+07
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   33 and name   HN) 3.294 1.357 1.357 weight 1.000 ! spec=Expt_10, no=173, id=154, vol=6.172578e+07
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name   HN) 3.400 1.445 1.445 weight 1.000 ! spec=Expt_10, no=175, id=156, vol=5.104315e+07
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   29 and name   HN) 3.400 1.445 1.445 weight 1.000 ! spec=Expt_10, no=175, id=156, vol=5.104315e+07
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   28 and name  HE1) 3.451 1.488 1.488 weight 1.000 ! spec=Expt_10, no=176, id=157, vol=4.674914e+07
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   28 and name  HE1) 3.451 1.488 1.488 weight 1.000 ! spec=Expt_10, no=176, id=157, vol=4.674914e+07
    or (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name   HA) 2.274 0.646 0.646 weight 1.000 ! spec=Expt_10, no=177, id=158, vol=5.713514e+08
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   29 and name   HA) 2.274 0.646 0.646 weight 1.000 ! spec=Expt_10, no=177, id=158, vol=5.713514e+08
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name   HA) 2.770 0.959 0.959 weight 1.000 ! spec=Expt_10, no=179, id=160, vol=1.745061e+08
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   30 and name   HA) 2.770 0.959 0.959 weight 1.000 ! spec=Expt_10, no=179, id=160, vol=1.745061e+08
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   11 and name  HB2) 3.074 1.181 1.181 weight 1.000 ! spec=Expt_10, no=180, id=161, vol=9.345467e+07
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   11 and name  HB2) 3.074 1.181 1.181 weight 1.000 ! spec=Expt_10, no=180, id=161, vol=9.345467e+07
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name  HB2) 2.825 0.997 0.997 weight 1.000 ! spec=Expt_10, no=181, id=162, vol=1.553612e+08
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   30 and name  HB2) 2.825 0.997 0.997 weight 1.000 ! spec=Expt_10, no=181, id=162, vol=1.553612e+08
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   33 and name  HB2) 2.994 1.121 1.621 weight 1.000 ! spec=Expt_10, no=182, id=163, vol=1.095440e+08
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   33 and name  HB2) 2.994 1.121 1.621 weight 1.000 ! spec=Expt_10, no=182, id=163, vol=1.095440e+08
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name  HB1) 2.470 0.763 2.763 weight 1.000 ! spec=Expt_10, no=183, id=164, vol=3.472733e+08
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   30 and name  HB1) 2.470 0.763 2.763 weight 1.000 ! spec=Expt_10, no=183, id=164, vol=3.472733e+08
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   33 and name  HB1) 2.987 1.116 3.013 weight 1.000 ! spec=Expt_10, no=184, id=165, vol=1.110102e+08
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   33 and name  HB1) 2.987 1.116 3.013 weight 1.000 ! spec=Expt_10, no=184, id=165, vol=1.110102e+08
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   31 and name   HN) 3.294 1.356 1.356 weight 1.000 ! spec=Expt_10, no=188, id=169, vol=6.180617e+07
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   31 and name   HN) 3.294 1.356 1.356 weight 1.000 ! spec=Expt_10, no=188, id=169, vol=6.180617e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   33 and name   HN) 3.552 1.577 1.577 weight 1.000 ! spec=Expt_10, no=190, id=171, vol=3.926910e+07
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   33 and name   HN) 3.552 1.577 1.577 weight 1.000 ! spec=Expt_10, no=190, id=171, vol=3.926910e+07
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   31 and name   HN) 3.386 1.433 1.433 weight 1.000 ! spec=Expt_10, no=191, id=172, vol=5.231955e+07
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   31 and name   HN) 3.386 1.433 1.433 weight 1.000 ! spec=Expt_10, no=191, id=172, vol=5.231955e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name   HA) 2.376 0.706 0.706 weight 1.000 ! spec=Expt_10, no=193, id=174, vol=4.385091e+08
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   30 and name   HA) 2.376 0.706 0.706 weight 1.000 ! spec=Expt_10, no=193, id=174, vol=4.385091e+08
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   21 and name  HA2) 2.724 0.927 0.927 weight 1.000 ! spec=Expt_10, no=195, id=176, vol=1.931575e+08
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   21 and name  HA2) 2.724 0.927 0.927 weight 1.000 ! spec=Expt_10, no=195, id=176, vol=1.931575e+08
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   21 and name  HA1) 2.760 0.952 0.952 weight 1.000 ! spec=Expt_10, no=196, id=177, vol=1.786386e+08
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   21 and name  HA1) 2.760 0.952 0.952 weight 1.000 ! spec=Expt_10, no=196, id=177, vol=1.786386e+08
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name  HB1) 2.776 0.963 3.224 weight 1.000 ! spec=Expt_10, no=198, id=179, vol=1.723801e+08
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   30 and name  HB1) 2.776 0.963 3.224 weight 1.000 ! spec=Expt_10, no=198, id=179, vol=1.723801e+08
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name  HB2) 2.413 0.728 3.587 weight 1.000 ! spec=Expt_10, no=200, id=181, vol=3.999924e+08
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   31 and name  HB2) 2.413 0.728 3.587 weight 1.000 ! spec=Expt_10, no=200, id=181, vol=3.999924e+08
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name HD22) 2.720 0.925 3.280 weight 1.000 ! spec=Expt_10, no=202, id=182, vol=1.948138e+08
    or (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name HD21)
    or (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name HD23)
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   31 and name HD22) 2.720 0.925 3.280 weight 1.000 ! spec=Expt_10, no=202, id=182, vol=1.948138e+08
    or (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   31 and name HD21)
    or (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   31 and name HD23)
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   32 and name   HN) 2.478 0.768 0.768 weight 1.000 ! spec=Expt_10, no=203, id=183, vol=3.404768e+08
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   32 and name   HN) 2.478 0.768 0.768 weight 1.000 ! spec=Expt_10, no=203, id=183, vol=3.404768e+08
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   33 and name   HN) 2.237 0.625 0.625 weight 1.000 ! spec=Expt_10, no=204, id=184, vol=6.304930e+08
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   33 and name   HN) 2.237 0.625 0.625 weight 1.000 ! spec=Expt_10, no=204, id=184, vol=6.304930e+08
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name   HA) 2.387 0.712 0.712 weight 1.000 ! spec=Expt_10, no=205, id=185, vol=4.261535e+08
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   32 and name   HA) 2.387 0.712 0.712 weight 1.000 ! spec=Expt_10, no=205, id=185, vol=4.261535e+08
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   21 and name  HA1) 3.650 1.666 1.666 weight 1.000 ! spec=Expt_10, no=207, id=187, vol=3.334552e+07
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   21 and name  HA1) 3.650 1.666 1.666 weight 1.000 ! spec=Expt_10, no=207, id=187, vol=3.334552e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   30 and name  HB2) 3.164 1.252 1.252 weight 1.000 ! spec=Expt_10, no=208, id=188, vol=7.860765e+07
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   30 and name  HB2) 3.164 1.252 1.252 weight 1.000 ! spec=Expt_10, no=208, id=188, vol=7.860765e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name  HB1) 2.389 0.713 0.713 weight 1.000 ! spec=Expt_10, no=210, id=190, vol=4.246988e+08
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   32 and name  HB1) 2.389 0.713 0.713 weight 1.000 ! spec=Expt_10, no=210, id=190, vol=4.246988e+08
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name  HB2) 2.618 0.857 3.382 weight 1.000 ! spec=Expt_10, no=212, id=192, vol=2.451563e+08
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   31 and name  HB2) 2.618 0.857 3.382 weight 1.000 ! spec=Expt_10, no=212, id=192, vol=2.451563e+08
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name   HG) 2.574 0.828 0.828 weight 1.000 ! spec=Expt_10, no=213, id=193, vol=2.710780e+08
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   31 and name   HG) 2.574 0.828 0.828 weight 1.000 ! spec=Expt_10, no=213, id=193, vol=2.710780e+08
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name HD22) 2.889 1.043 3.111 weight 1.000 ! spec=Expt_10, no=214, id=194, vol=1.358307e+08
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name HD21)
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name HD23)
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   31 and name HD22) 2.889 1.043 3.111 weight 1.000 ! spec=Expt_10, no=214, id=194, vol=1.358307e+08
    or (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   31 and name HD21)
    or (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   31 and name HD23)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   29 and name HG22) 3.524 1.553 1.553 weight 1.000 ! spec=Expt_10, no=215, id=195, vol=4.117893e+07
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   29 and name HG22) 3.524 1.553 1.553 weight 1.000 ! spec=Expt_10, no=215, id=195, vol=4.117893e+07
    or (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   36 and name   HN) 3.362 1.413 1.413 weight 1.000 ! spec=Expt_10, no=218, id=198, vol=5.459475e+07
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   36 and name   HN) 3.362 1.413 1.413 weight 1.000 ! spec=Expt_10, no=218, id=198, vol=5.459475e+07
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   31 and name   HA) 3.536 1.563 1.563 weight 1.000 ! spec=Expt_10, no=219, id=199, vol=4.033575e+07
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   31 and name   HA) 3.536 1.563 1.563 weight 1.000 ! spec=Expt_10, no=219, id=199, vol=4.033575e+07
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name   HA) 2.447 0.749 0.749 weight 1.000 ! spec=Expt_10, no=220, id=200, vol=3.671113e+08
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   33 and name   HA) 2.447 0.749 0.749 weight 1.000 ! spec=Expt_10, no=220, id=200, vol=3.671113e+08
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   34 and name   HA) 3.391 1.437 1.437 weight 1.000 ! spec=Expt_10, no=221, id=201, vol=5.188921e+07
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   34 and name   HA) 3.391 1.437 1.437 weight 1.000 ! spec=Expt_10, no=221, id=201, vol=5.188921e+07
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name  HB2) 2.321 0.673 1.673 weight 1.000 ! spec=Expt_10, no=222, id=202, vol=5.053156e+08
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   33 and name  HB2) 2.321 0.673 1.673 weight 1.000 ! spec=Expt_10, no=222, id=202, vol=5.053156e+08
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name  HB1) 2.566 0.823 0.823 weight 1.000 ! spec=Expt_10, no=223, id=203, vol=2.764275e+08
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   32 and name  HB1) 2.566 0.823 0.823 weight 1.000 ! spec=Expt_10, no=223, id=203, vol=2.764275e+08
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name  HB1) 2.528 0.799 3.472 weight 1.000 ! spec=Expt_10, no=224, id=204, vol=3.022775e+08
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   33 and name  HB1) 2.528 0.799 3.472 weight 1.000 ! spec=Expt_10, no=224, id=204, vol=3.022775e+08
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   34 and name  HB2) 3.339 1.394 1.394 weight 1.000 ! spec=Expt_10, no=225, id=205, vol=5.690553e+07
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   34 and name  HB2) 3.339 1.394 1.394 weight 1.000 ! spec=Expt_10, no=225, id=205, vol=5.690553e+07
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   35 and name   HN) 2.508 0.786 0.786 weight 1.000 ! spec=Expt_10, no=231, id=210, vol=3.167869e+08
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   35 and name   HN) 2.508 0.786 0.786 weight 1.000 ! spec=Expt_10, no=231, id=210, vol=3.167869e+08
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   31 and name   HA) 2.784 0.969 0.969 weight 1.000 ! spec=Expt_10, no=232, id=211, vol=1.696486e+08
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   31 and name   HA) 2.784 0.969 0.969 weight 1.000 ! spec=Expt_10, no=232, id=211, vol=1.696486e+08
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name   HA) 2.546 0.810 0.810 weight 1.000 ! spec=Expt_10, no=234, id=213, vol=2.896284e+08
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   34 and name   HA) 2.546 0.810 0.810 weight 1.000 ! spec=Expt_10, no=234, id=213, vol=2.896284e+08
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HB2) 2.755 0.949 0.949 weight 1.000 ! spec=Expt_10, no=235, id=214, vol=1.805068e+08
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   33 and name  HB2) 2.755 0.949 0.949 weight 1.000 ! spec=Expt_10, no=235, id=214, vol=1.805068e+08
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HB1) 2.935 1.077 1.077 weight 1.000 ! spec=Expt_10, no=236, id=215, vol=1.235176e+08
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   33 and name  HB1) 2.935 1.077 1.077 weight 1.000 ! spec=Expt_10, no=236, id=215, vol=1.235176e+08
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HB2) 2.429 0.737 0.737 weight 1.000 ! spec=Expt_10, no=237, id=216, vol=3.842365e+08
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   34 and name  HB2) 2.429 0.737 0.737 weight 1.000 ! spec=Expt_10, no=237, id=216, vol=3.842365e+08
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HG2) 2.722 0.926 3.278 weight 1.000 ! spec=Expt_10, no=238, id=217, vol=1.940307e+08
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   34 and name  HG2) 2.722 0.926 3.278 weight 1.000 ! spec=Expt_10, no=238, id=217, vol=1.940307e+08
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HB1) 2.287 0.654 0.654 weight 1.000 ! spec=Expt_10, no=239, id=218, vol=5.512658e+08
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   34 and name  HB1) 2.287 0.654 0.654 weight 1.000 ! spec=Expt_10, no=239, id=218, vol=5.512658e+08
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   29 and name HG22) 2.490 0.775 0.775 weight 1.000 ! spec=Expt_10, no=241, id=220, vol=3.309207e+08
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   29 and name HG22) 2.490 0.775 0.775 weight 1.000 ! spec=Expt_10, no=241, id=220, vol=3.309207e+08
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   37 and name   HN) 3.233 1.306 1.306 weight 1.000 ! spec=Expt_10, no=243, id=222, vol=6.916215e+07
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   37 and name   HN) 3.233 1.306 1.306 weight 1.000 ! spec=Expt_10, no=243, id=222, vol=6.916215e+07
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   36 and name   HN) 2.428 0.737 0.737 weight 1.000 ! spec=Expt_10, no=244, id=223, vol=3.853805e+08
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   36 and name   HN) 2.428 0.737 0.737 weight 1.000 ! spec=Expt_10, no=244, id=223, vol=3.853805e+08
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   32 and name   HA) 2.963 1.097 3.037 weight 1.000 ! spec=Expt_10, no=245, id=224, vol=1.166923e+08
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   32 and name   HA) 2.963 1.097 3.037 weight 1.000 ! spec=Expt_10, no=245, id=224, vol=1.166923e+08
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   31 and name   HA) 3.054 1.166 2.946 weight 1.000 ! spec=Expt_10, no=246, id=225, vol=9.725368e+07
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   31 and name   HA) 3.054 1.166 2.946 weight 1.000 ! spec=Expt_10, no=246, id=225, vol=9.725368e+07
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name   HA) 2.928 1.072 1.072 weight 1.000 ! spec=Expt_10, no=248, id=227, vol=1.251970e+08
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   34 and name   HA) 2.928 1.072 1.072 weight 1.000 ! spec=Expt_10, no=248, id=227, vol=1.251970e+08
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name  HD2) 3.006 1.130 2.994 weight 1.000 ! spec=Expt_10, no=249, id=228, vol=1.068874e+08
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   35 and name  HD2) 3.006 1.130 2.994 weight 1.000 ! spec=Expt_10, no=249, id=228, vol=1.068874e+08
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name  HB2) 2.512 0.789 3.488 weight 1.000 ! spec=Expt_10, no=250, id=229, vol=3.136911e+08
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   34 and name  HB2) 2.512 0.789 3.488 weight 1.000 ! spec=Expt_10, no=250, id=229, vol=3.136911e+08
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name  HB1) 2.076 0.539 3.924 weight 1.000 ! spec=Expt_10, no=251, id=230, vol=9.855606e+08
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   35 and name  HB1) 2.076 0.539 3.924 weight 1.000 ! spec=Expt_10, no=251, id=230, vol=9.855606e+08
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   37 and name HG12) 2.787 0.971 3.213 weight 1.000 ! spec=Expt_10, no=253, id=231, vol=1.684431e+08
    or (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   37 and name HG13)
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   37 and name HG12) 2.787 0.971 3.213 weight 1.000 ! spec=Expt_10, no=253, id=231, vol=1.684431e+08
    or (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   37 and name HG11)
    or (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   37 and name HG13)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name   HN) 2.445 0.747 0.747 weight 1.000 ! spec=Expt_10, no=255, id=233, vol=3.693896e+08
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   37 and name   HN) 2.445 0.747 0.747 weight 1.000 ! spec=Expt_10, no=255, id=233, vol=3.693896e+08
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name   HA) 2.503 0.783 0.783 weight 1.000 ! spec=Expt_10, no=258, id=236, vol=3.208126e+08
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   35 and name   HA) 2.503 0.783 0.783 weight 1.000 ! spec=Expt_10, no=258, id=236, vol=3.208126e+08
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   34 and name   HA) 3.284 1.348 1.348 weight 1.000 ! spec=Expt_10, no=259, id=237, vol=6.285694e+07
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   34 and name   HA) 3.284 1.348 1.348 weight 1.000 ! spec=Expt_10, no=259, id=237, vol=6.285694e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HE2) 3.505 1.536 2.495 weight 1.000 ! spec=Expt_10, no=261, id=239, vol=4.253060e+07
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   36 and name  HE2) 3.505 1.536 2.495 weight 1.000 ! spec=Expt_10, no=261, id=239, vol=4.253060e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HB2) 2.096 0.549 3.904 weight 1.000 ! spec=Expt_10, no=262, id=240, vol=9.313622e+08
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   36 and name  HB2) 2.096 0.549 3.904 weight 1.000 ! spec=Expt_10, no=262, id=240, vol=9.313622e+08
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name  HG2) 2.188 0.598 3.812 weight 1.000 ! spec=Expt_10, no=263, id=241, vol=7.193843e+08
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   35 and name  HG2) 2.188 0.598 3.812 weight 1.000 ! spec=Expt_10, no=263, id=241, vol=7.193843e+08
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HG1) 2.870 1.030 1.030 weight 1.000 ! spec=Expt_10, no=265, id=242, vol=1.410837e+08
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   36 and name  HG1) 2.870 1.030 1.030 weight 1.000 ! spec=Expt_10, no=265, id=242, vol=1.410837e+08
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   39 and name   HN) 3.250 1.320 1.320 weight 1.000 ! spec=Expt_10, no=267, id=243, vol=6.693866e+07
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   39 and name   HN) 3.250 1.320 1.320 weight 1.000 ! spec=Expt_10, no=267, id=243, vol=6.693866e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   38 and name   HN) 2.547 0.811 0.811 weight 1.000 ! spec=Expt_10, no=268, id=244, vol=2.888639e+08
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   38 and name   HN) 2.547 0.811 0.811 weight 1.000 ! spec=Expt_10, no=268, id=244, vol=2.888639e+08
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   33 and name   HA) 3.007 1.131 2.993 weight 1.000 ! spec=Expt_10, no=271, id=247, vol=1.066479e+08
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   33 and name   HA) 3.007 1.131 2.993 weight 1.000 ! spec=Expt_10, no=271, id=247, vol=1.066479e+08
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name   HA) 2.468 0.761 0.761 weight 1.000 ! spec=Expt_10, no=272, id=248, vol=3.490695e+08
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   37 and name   HA) 2.468 0.761 0.761 weight 1.000 ! spec=Expt_10, no=272, id=248, vol=3.490695e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HB2) 2.314 0.670 2.670 weight 1.000 ! spec=Expt_10, no=273, id=249, vol=5.133749e+08
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   16 and name  HB2) 2.314 0.670 2.670 weight 1.000 ! spec=Expt_10, no=273, id=249, vol=5.133749e+08
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HB2) 2.632 0.866 0.866 weight 1.000 ! spec=Expt_10, no=274, id=250, vol=2.375799e+08
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   36 and name  HB2) 2.632 0.866 0.866 weight 1.000 ! spec=Expt_10, no=274, id=250, vol=2.375799e+08
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HG1) 3.419 1.461 1.461 weight 1.000 ! spec=Expt_10, no=277, id=253, vol=4.939472e+07
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   36 and name  HG1) 3.419 1.461 1.461 weight 1.000 ! spec=Expt_10, no=277, id=253, vol=4.939472e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   C" and resid   24 and name HD22) 3.261 1.329 1.329 weight 1.000 ! spec=Expt_10, no=279, id=254, vol=6.559699e+07
    or (segid "   A" and resid   37 and name   HN) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   37 and name   HN) (segid "   C" and resid   24 and name HD23)
assign (segid "   C" and resid   37 and name   HN) (segid "   A" and resid   24 and name HD22) 3.261 1.329 1.329 weight 1.000 ! spec=Expt_10, no=279, id=254, vol=6.559699e+07
    or (segid "   C" and resid   37 and name   HN) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   37 and name   HN) (segid "   A" and resid   24 and name HD23)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   36 and name   HN) 3.229 1.303 1.303 weight 1.000 ! spec=Expt_10, no=282, id=257, vol=6.959566e+07
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   36 and name   HN) 3.229 1.303 1.303 weight 1.000 ! spec=Expt_10, no=282, id=257, vol=6.959566e+07
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   36 and name   HA) 3.356 1.408 1.408 weight 1.000 ! spec=Expt_10, no=283, id=258, vol=5.525148e+07
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   36 and name   HA) 3.356 1.408 1.408 weight 1.000 ! spec=Expt_10, no=283, id=258, vol=5.525148e+07
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   38 and name   HA) 2.557 0.818 0.818 weight 1.000 ! spec=Expt_10, no=285, id=260, vol=2.820541e+08
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   38 and name   HA) 2.557 0.818 0.818 weight 1.000 ! spec=Expt_10, no=285, id=260, vol=2.820541e+08
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name   HA) 2.853 1.017 1.017 weight 1.000 ! spec=Expt_10, no=286, id=261, vol=1.463055e+08
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   37 and name   HA) 2.853 1.017 1.017 weight 1.000 ! spec=Expt_10, no=286, id=261, vol=1.463055e+08
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   38 and name   HB) 2.277 0.648 1.648 weight 1.000 ! spec=Expt_10, no=288, id=262, vol=5.668245e+08
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   38 and name   HB) 2.277 0.648 1.648 weight 1.000 ! spec=Expt_10, no=288, id=262, vol=5.668245e+08
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   38 and name HG11) 2.552 0.814 0.814 weight 1.000 ! spec=Expt_10, no=290, id=264, vol=2.857591e+08
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   38 and name HG11) 2.552 0.814 0.814 weight 1.000 ! spec=Expt_10, no=290, id=264, vol=2.857591e+08
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   39 and name   HN) 2.558 0.818 0.818 weight 1.000 ! spec=Expt_10, no=292, id=265, vol=2.816282e+08
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   39 and name   HN) 2.558 0.818 0.818 weight 1.000 ! spec=Expt_10, no=292, id=265, vol=2.816282e+08
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   40 and name   HN) 2.778 0.965 0.965 weight 1.000 ! spec=Expt_10, no=293, id=266, vol=1.716960e+08
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   40 and name   HN) 2.778 0.965 0.965 weight 1.000 ! spec=Expt_10, no=293, id=266, vol=1.716960e+08
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HB1) 2.287 0.654 3.713 weight 1.000 ! spec=Expt_10, no=294, id=267, vol=5.513046e+08
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   39 and name  HB1) 2.287 0.654 3.713 weight 1.000 ! spec=Expt_10, no=294, id=267, vol=5.513046e+08
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name   HA) 2.499 0.780 0.780 weight 1.000 ! spec=Expt_10, no=295, id=268, vol=3.243541e+08
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   39 and name   HA) 2.499 0.780 0.780 weight 1.000 ! spec=Expt_10, no=295, id=268, vol=3.243541e+08
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name   HA) 2.931 1.074 1.074 weight 1.000 ! spec=Expt_10, no=296, id=269, vol=1.244328e+08
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   38 and name   HA) 2.931 1.074 1.074 weight 1.000 ! spec=Expt_10, no=296, id=269, vol=1.244328e+08
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name HG12) 3.107 1.207 1.207 weight 1.000 ! spec=Expt_10, no=298, id=271, vol=8.771945e+07
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   38 and name HG12) 3.107 1.207 1.207 weight 1.000 ! spec=Expt_10, no=298, id=271, vol=8.771945e+07
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name HG22) 2.594 0.841 3.406 weight 1.000 ! spec=Expt_10, no=299, id=272, vol=2.588818e+08
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name HG23)
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   38 and name HG22) 2.594 0.841 3.406 weight 1.000 ! spec=Expt_10, no=299, id=272, vol=2.588818e+08
    or (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   38 and name HG21)
    or (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   38 and name HG23)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name HG11) 3.266 1.334 1.334 weight 1.000 ! spec=Expt_10, no=300, id=273, vol=6.498457e+07
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   38 and name HG11) 3.266 1.334 1.334 weight 1.000 ! spec=Expt_10, no=300, id=273, vol=6.498457e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name   HB) 2.410 0.726 0.726 weight 1.000 ! spec=Expt_10, no=302, id=275, vol=4.032035e+08
assign (segid "   C" and resid   40 and name   HN) (segid "   C" and resid   40 and name   HB) 2.410 0.726 0.726 weight 1.000 ! spec=Expt_10, no=302, id=275, vol=4.032035e+08
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   39 and name  HB1) 3.020 1.140 1.140 weight 1.000 ! spec=Expt_10, no=303, id=276, vol=1.039622e+08
assign (segid "   C" and resid   40 and name   HN) (segid "   C" and resid   39 and name  HB1) 3.020 1.140 1.140 weight 1.000 ! spec=Expt_10, no=303, id=276, vol=1.039622e+08
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name HG21) 2.862 1.024 1.024 weight 1.000 ! spec=Expt_10, no=305, id=278, vol=1.437006e+08
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name HG23)
assign (segid "   C" and resid   40 and name   HN) (segid "   C" and resid   40 and name HG21) 2.862 1.024 1.024 weight 1.000 ! spec=Expt_10, no=305, id=278, vol=1.437006e+08
    or (segid "   C" and resid   40 and name   HN) (segid "   C" and resid   40 and name HG22)
    or (segid "   C" and resid   40 and name   HN) (segid "   C" and resid   40 and name HG23)
assign (segid "   A" and resid   40 and name   HN) (segid "   C" and resid   22 and name HD12) 3.261 1.329 1.329 weight 1.000 ! spec=Expt_10, no=306, id=279, vol=6.565532e+07
    or (segid "   A" and resid   40 and name   HN) (segid "   C" and resid   22 and name HD11)
    or (segid "   A" and resid   40 and name   HN) (segid "   C" and resid   22 and name HD13)
assign (segid "   C" and resid   40 and name   HN) (segid "   A" and resid   22 and name HD12) 3.261 1.329 1.329 weight 1.000 ! spec=Expt_10, no=306, id=279, vol=6.565532e+07
    or (segid "   C" and resid   40 and name   HN) (segid "   A" and resid   22 and name HD11)
    or (segid "   C" and resid   40 and name   HN) (segid "   A" and resid   22 and name HD13)
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   41 and name  HB2) 3.419 1.461 1.461 weight 1.000 ! spec=Expt_10, no=307, id=280, vol=4.937118e+07
assign (segid "   C" and resid   42 and name   HN) (segid "   C" and resid   41 and name  HB2) 3.419 1.461 1.461 weight 1.000 ! spec=Expt_10, no=307, id=280, vol=4.937118e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name   HA) 3.387 1.434 1.434 weight 1.000 ! spec=Expt_10, no=308, id=281, vol=5.224641e+07
assign (segid "   C" and resid   44 and name   HN) (segid "   C" and resid   43 and name   HA) 3.387 1.434 1.434 weight 1.000 ! spec=Expt_10, no=308, id=281, vol=5.224641e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name  HB2) 3.491 1.523 1.523 weight 1.000 ! spec=Expt_10, no=311, id=284, vol=4.358986e+07
assign (segid "   C" and resid   44 and name   HN) (segid "   C" and resid   44 and name  HB2) 3.491 1.523 1.523 weight 1.000 ! spec=Expt_10, no=311, id=284, vol=4.358986e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name  HB1) 3.556 1.581 1.581 weight 1.000 ! spec=Expt_10, no=312, id=285, vol=3.902532e+07
assign (segid "   C" and resid   44 and name   HN) (segid "   C" and resid   44 and name  HB1) 3.556 1.581 1.581 weight 1.000 ! spec=Expt_10, no=312, id=285, vol=3.902532e+07
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   46 and name   HA) 2.606 0.849 0.849 weight 1.000 ! spec=Expt_10, no=314, id=287, vol=2.519082e+08
assign (segid "   C" and resid   46 and name   HN) (segid "   C" and resid   46 and name   HA) 2.606 0.849 0.849 weight 1.000 ! spec=Expt_10, no=314, id=287, vol=2.519082e+08
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name   HA) 2.800 0.980 0.980 weight 1.000 ! spec=Expt_10, no=315, id=288, vol=1.638150e+08
assign (segid "   C" and resid   46 and name   HN) (segid "   C" and resid   45 and name   HA) 2.800 0.980 0.980 weight 1.000 ! spec=Expt_10, no=315, id=288, vol=1.638150e+08
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name  HD1) 3.274 1.340 2.726 weight 1.000 ! spec=Expt_10, no=316, id=289, vol=6.401872e+07
assign (segid "   C" and resid   46 and name   HN) (segid "   C" and resid   45 and name  HD1) 3.274 1.340 2.726 weight 1.000 ! spec=Expt_10, no=316, id=289, vol=6.401872e+07
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   46 and name  HB1) 2.694 0.907 3.306 weight 1.000 ! spec=Expt_10, no=317, id=290, vol=2.063022e+08
assign (segid "   C" and resid   46 and name   HN) (segid "   C" and resid   46 and name  HB1) 2.694 0.907 3.306 weight 1.000 ! spec=Expt_10, no=317, id=290, vol=2.063022e+08
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name  HG2) 3.477 1.511 1.511 weight 1.000 ! spec=Expt_10, no=320, id=292, vol=4.469249e+07
assign (segid "   C" and resid   46 and name   HN) (segid "   C" and resid   45 and name  HG2) 3.477 1.511 1.511 weight 1.000 ! spec=Expt_10, no=320, id=292, vol=4.469249e+07
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   47 and name   HN) 3.227 1.302 1.302 weight 1.000 ! spec=Expt_10, no=321, id=293, vol=6.981594e+07
assign (segid "   C" and resid   46 and name   HN) (segid "   C" and resid   47 and name   HN) 3.227 1.302 1.302 weight 1.000 ! spec=Expt_10, no=321, id=293, vol=6.981594e+07
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name  HD1) 3.161 1.249 1.249 weight 1.000 ! spec=Expt_10, no=323, id=295, vol=7.910342e+07
    or (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name  HD2)
assign (segid "   C" and resid   47 and name   HN) (segid "   C" and resid   47 and name  HD1) 3.161 1.249 1.249 weight 1.000 ! spec=Expt_10, no=323, id=295, vol=7.910342e+07
    or (segid "   C" and resid   47 and name   HN) (segid "   C" and resid   47 and name  HD2)
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name   HA) 2.403 0.722 3.597 weight 1.000 ! spec=Expt_10, no=324, id=296, vol=4.101653e+08
assign (segid "   C" and resid   47 and name   HN) (segid "   C" and resid   46 and name   HA) 2.403 0.722 3.597 weight 1.000 ! spec=Expt_10, no=324, id=296, vol=4.101653e+08
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name  HB2) 2.752 0.947 0.947 weight 1.000 ! spec=Expt_10, no=325, id=297, vol=1.817405e+08
assign (segid "   C" and resid   47 and name   HN) (segid "   C" and resid   47 and name  HB2) 2.752 0.947 0.947 weight 1.000 ! spec=Expt_10, no=325, id=297, vol=1.817405e+08
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name  HB1) 2.601 0.846 3.399 weight 1.000 ! spec=Expt_10, no=326, id=298, vol=2.548924e+08
assign (segid "   C" and resid   47 and name   HN) (segid "   C" and resid   47 and name  HB1) 2.601 0.846 3.399 weight 1.000 ! spec=Expt_10, no=326, id=298, vol=2.548924e+08
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name  HB1) 3.264 1.332 1.332 weight 1.000 ! spec=Expt_10, no=327, id=299, vol=6.520606e+07
assign (segid "   C" and resid   47 and name   HN) (segid "   C" and resid   46 and name  HB1) 3.264 1.332 1.332 weight 1.000 ! spec=Expt_10, no=327, id=299, vol=6.520606e+07
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   47 and name  HD1) 3.308 1.367 2.692 weight 1.000 ! spec=Expt_10, no=328, id=300, vol=6.027238e+07
    or (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   47 and name  HD2)
assign (segid "   C" and resid   48 and name   HN) (segid "   C" and resid   47 and name  HD1) 3.308 1.367 2.692 weight 1.000 ! spec=Expt_10, no=328, id=300, vol=6.027238e+07
    or (segid "   C" and resid   48 and name   HN) (segid "   C" and resid   47 and name  HD2)
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   47 and name   HA) 2.418 0.731 0.731 weight 1.000 ! spec=Expt_10, no=329, id=301, vol=3.951298e+08
assign (segid "   C" and resid   48 and name   HN) (segid "   C" and resid   47 and name   HA) 2.418 0.731 0.731 weight 1.000 ! spec=Expt_10, no=329, id=301, vol=3.951298e+08
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   48 and name   HA) 2.941 1.081 1.081 weight 1.000 ! spec=Expt_10, no=330, id=302, vol=1.219900e+08
assign (segid "   C" and resid   48 and name   HN) (segid "   C" and resid   48 and name   HA) 2.941 1.081 1.081 weight 1.000 ! spec=Expt_10, no=330, id=302, vol=1.219900e+08
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   47 and name  HB2) 3.326 1.383 1.383 weight 1.000 ! spec=Expt_10, no=331, id=303, vol=5.830995e+07
assign (segid "   C" and resid   48 and name   HN) (segid "   C" and resid   47 and name  HB2) 3.326 1.383 1.383 weight 1.000 ! spec=Expt_10, no=331, id=303, vol=5.830995e+07
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   47 and name  HB1) 3.361 1.412 1.412 weight 1.000 ! spec=Expt_10, no=332, id=304, vol=5.476008e+07
assign (segid "   C" and resid   48 and name   HN) (segid "   C" and resid   47 and name  HB1) 3.361 1.412 1.412 weight 1.000 ! spec=Expt_10, no=332, id=304, vol=5.476008e+07
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   48 and name  HB2) 2.669 0.891 0.891 weight 1.000 ! spec=Expt_10, no=333, id=305, vol=2.182418e+08
    or (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   48 and name  HB1)
    or (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   48 and name  HB3)
assign (segid "   C" and resid   48 and name   HN) (segid "   C" and resid   48 and name  HB2) 2.669 0.891 0.891 weight 1.000 ! spec=Expt_10, no=333, id=305, vol=2.182418e+08
    or (segid "   C" and resid   48 and name   HN) (segid "   C" and resid   48 and name  HB1)
    or (segid "   C" and resid   48 and name   HN) (segid "   C" and resid   48 and name  HB3)
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   48 and name   HN) 3.121 1.218 1.218 weight 1.000 ! spec=Expt_10, no=334, id=306, vol=8.537062e+07
assign (segid "   C" and resid   47 and name   HN) (segid "   C" and resid   48 and name   HN) 3.121 1.218 1.218 weight 1.000 ! spec=Expt_10, no=334, id=306, vol=8.537062e+07
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name  HB2) 3.042 1.157 1.157 weight 1.000 ! spec=Expt_10, no=335, id=307, vol=9.953387e+07
assign (segid "   C" and resid    9 and name   HN) (segid "   C" and resid    9 and name  HB2) 3.042 1.157 1.157 weight 1.000 ! spec=Expt_10, no=335, id=307, vol=9.953387e+07
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name  HB1) 3.186 1.269 1.269 weight 1.000 ! spec=Expt_10, no=336, id=308, vol=7.544304e+07
assign (segid "   C" and resid    9 and name   HN) (segid "   C" and resid    9 and name  HB1) 3.186 1.269 1.269 weight 1.000 ! spec=Expt_10, no=336, id=308, vol=7.544304e+07
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB2) 3.079 1.185 1.185 weight 1.000 ! spec=Expt_10, no=338, id=310, vol=9.253490e+07
assign (segid "   C" and resid    8 and name   HN) (segid "   C" and resid    8 and name  HB2) 3.079 1.185 1.185 weight 1.000 ! spec=Expt_10, no=338, id=310, vol=9.253490e+07
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name  HB1) 3.330 1.386 1.386 weight 1.000 ! spec=Expt_10, no=339, id=311, vol=5.791731e+07
assign (segid "   C" and resid    8 and name   HN) (segid "   C" and resid    7 and name  HB1) 3.330 1.386 1.386 weight 1.000 ! spec=Expt_10, no=339, id=311, vol=5.791731e+07
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name   HA) 2.813 0.989 0.989 weight 1.000 ! spec=Expt_10, no=341, id=313, vol=1.592435e+08
assign (segid "   C" and resid    7 and name   HN) (segid "   C" and resid    6 and name   HA) 2.813 0.989 0.989 weight 1.000 ! spec=Expt_10, no=341, id=313, vol=1.592435e+08
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HB2) 2.735 0.935 2.935 weight 1.000 ! spec=Expt_10, no=343, id=315, vol=1.884055e+08
assign (segid "   C" and resid    7 and name   HN) (segid "   C" and resid    7 and name  HB2) 2.735 0.935 2.935 weight 1.000 ! spec=Expt_10, no=343, id=315, vol=1.884055e+08
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HB1) 3.281 1.346 1.346 weight 1.000 ! spec=Expt_10, no=344, id=316, vol=6.325285e+07
assign (segid "   C" and resid    7 and name   HN) (segid "   C" and resid    7 and name  HB1) 3.281 1.346 1.346 weight 1.000 ! spec=Expt_10, no=344, id=316, vol=6.325285e+07
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name HD12) 3.434 1.474 1.474 weight 1.000 ! spec=Expt_10, no=345, id=317, vol=4.808509e+07
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name HD11)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name HD13)
assign (segid "   C" and resid    7 and name   HN) (segid "   C" and resid    7 and name HD12) 3.434 1.474 1.474 weight 1.000 ! spec=Expt_10, no=345, id=317, vol=4.808509e+07
    or (segid "   C" and resid    7 and name   HN) (segid "   C" and resid    7 and name HD11)
    or (segid "   C" and resid    7 and name   HN) (segid "   C" and resid    7 and name HD13)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name   HA) 2.786 0.970 0.970 weight 1.000 ! spec=Expt_10, no=346, id=318, vol=1.688407e+08
assign (segid "   C" and resid    6 and name   HN) (segid "   C" and resid    5 and name   HA) 2.786 0.970 0.970 weight 1.000 ! spec=Expt_10, no=346, id=318, vol=1.688407e+08
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HB1) 3.245 1.316 1.316 weight 1.000 ! spec=Expt_10, no=348, id=319, vol=6.764003e+07
assign (segid "   C" and resid    6 and name   HN) (segid "   C" and resid    6 and name  HB1) 3.245 1.316 1.316 weight 1.000 ! spec=Expt_10, no=348, id=319, vol=6.764003e+07
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name   HA) 2.998 1.124 1.124 weight 1.000 ! spec=Expt_10, no=349, id=320, vol=1.086505e+08
assign (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    4 and name   HA) 2.998 1.124 1.124 weight 1.000 ! spec=Expt_10, no=349, id=320, vol=1.086505e+08
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name   HB) 2.904 1.054 1.054 weight 1.000 ! spec=Expt_10, no=351, id=321, vol=1.315303e+08
assign (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    5 and name   HB) 2.904 1.054 1.054 weight 1.000 ! spec=Expt_10, no=351, id=321, vol=1.315303e+08
assign (segid "   A" and resid    8 and name HD21) (segid "   A" and resid    8 and name  HB2) 2.743 0.940 0.940 weight 1.000 ! spec=Expt_10, no=354, id=324, vol=1.854318e+08
assign (segid "   C" and resid    8 and name HD21) (segid "   C" and resid    8 and name  HB2) 2.743 0.940 0.940 weight 1.000 ! spec=Expt_10, no=354, id=324, vol=1.854318e+08
assign (segid "   A" and resid    8 and name HD21) (segid "   A" and resid    8 and name  HB1) 2.838 1.007 1.007 weight 1.000 ! spec=Expt_10, no=355, id=325, vol=1.508893e+08
assign (segid "   C" and resid    8 and name HD21) (segid "   C" and resid    8 and name  HB1) 2.838 1.007 1.007 weight 1.000 ! spec=Expt_10, no=355, id=325, vol=1.508893e+08
assign (segid "   A" and resid    8 and name HD22) (segid "   A" and resid    8 and name  HB1) 3.110 1.209 1.209 weight 1.000 ! spec=Expt_10, no=356, id=326, vol=8.726812e+07
assign (segid "   C" and resid    8 and name HD22) (segid "   C" and resid    8 and name  HB1) 3.110 1.209 1.209 weight 1.000 ! spec=Expt_10, no=356, id=326, vol=8.726812e+07
assign (segid "   A" and resid    8 and name HD22) (segid "   A" and resid    8 and name  HB2) 2.970 1.102 1.102 weight 1.000 ! spec=Expt_10, no=357, id=327, vol=1.150728e+08
assign (segid "   C" and resid    8 and name HD22) (segid "   C" and resid    8 and name  HB2) 2.970 1.102 1.102 weight 1.000 ! spec=Expt_10, no=357, id=327, vol=1.150728e+08
assign (segid "   A" and resid    8 and name HD21) (segid "   A" and resid    8 and name HD22) 2.078 0.540 0.540 weight 1.000 ! spec=Expt_10, no=370, id=329, vol=9.810333e+08
assign (segid "   C" and resid    8 and name HD21) (segid "   C" and resid    8 and name HD22) 2.078 0.540 0.540 weight 1.000 ! spec=Expt_10, no=370, id=329, vol=9.810333e+08
assign (segid "   A" and resid    8 and name HD21) (segid "   A" and resid   17 and name  HB1) 3.552 1.577 1.577 weight 1.000 ! spec=Expt_10, no=372, id=331, vol=3.927867e+07
assign (segid "   C" and resid    8 and name HD21) (segid "   C" and resid   17 and name  HB1) 3.552 1.577 1.577 weight 1.000 ! spec=Expt_10, no=372, id=331, vol=3.927867e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   18 and name  HD2) 3.410 1.453 1.453 weight 1.000 ! spec=Expt_10, no=375, id=333, vol=5.021060e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   18 and name  HD2) 3.410 1.453 1.453 weight 1.000 ! spec=Expt_10, no=375, id=333, vol=5.021060e+07
assign (segid "   A" and resid   14 and name   HN) (segid "   C" and resid   25 and name  HE1) 3.500 1.531 1.531 weight 1.000 ! spec=Expt_10, no=381, id=336, vol=4.292756e+07
    or (segid "   A" and resid   14 and name   HN) (segid "   C" and resid   25 and name  HE2)
assign (segid "   C" and resid   14 and name   HN) (segid "   A" and resid   25 and name  HE1) 3.500 1.531 1.531 weight 1.000 ! spec=Expt_10, no=381, id=336, vol=4.292756e+07
    or (segid "   C" and resid   14 and name   HN) (segid "   A" and resid   25 and name  HE2)
assign (segid "   A" and resid   16 and name HE21) (segid "   A" and resid   16 and name  HG1) 2.737 0.936 0.936 weight 1.000 ! spec=Expt_10, no=383, id=337, vol=1.878967e+08
assign (segid "   C" and resid   16 and name HE21) (segid "   C" and resid   16 and name  HG1) 2.737 0.936 0.936 weight 1.000 ! spec=Expt_10, no=383, id=337, vol=1.878967e+08
assign (segid "   A" and resid   16 and name HE22) (segid "   A" and resid   16 and name  HG1) 3.109 1.208 1.208 weight 1.000 ! spec=Expt_10, no=385, id=339, vol=8.743132e+07
assign (segid "   C" and resid   16 and name HE22) (segid "   C" and resid   16 and name  HG1) 3.109 1.208 1.208 weight 1.000 ! spec=Expt_10, no=385, id=339, vol=8.743132e+07
assign (segid "   A" and resid   16 and name HE22) (segid "   A" and resid   15 and name  HB1) 3.464 1.500 2.536 weight 1.000 ! spec=Expt_10, no=386, id=340, vol=4.569138e+07
assign (segid "   C" and resid   16 and name HE22) (segid "   C" and resid   15 and name  HB1) 3.464 1.500 2.536 weight 1.000 ! spec=Expt_10, no=386, id=340, vol=4.569138e+07
assign (segid "   A" and resid   16 and name HE21) (segid "   A" and resid   16 and name  HG2) 2.853 1.017 1.017 weight 1.000 ! spec=Expt_10, no=387, id=341, vol=1.464161e+08
assign (segid "   C" and resid   16 and name HE21) (segid "   C" and resid   16 and name  HG2) 2.853 1.017 1.017 weight 1.000 ! spec=Expt_10, no=387, id=341, vol=1.464161e+08
assign (segid "   A" and resid   16 and name HE22) (segid "   A" and resid   16 and name  HG2) 3.306 1.367 1.367 weight 1.000 ! spec=Expt_10, no=388, id=342, vol=6.038747e+07
assign (segid "   C" and resid   16 and name HE22) (segid "   C" and resid   16 and name  HG2) 3.306 1.367 1.367 weight 1.000 ! spec=Expt_10, no=388, id=342, vol=6.038747e+07
assign (segid "   A" and resid   16 and name HE21) (segid "   A" and resid   16 and name HE22) 1.888 0.446 0.446 weight 1.000 ! spec=Expt_10, no=389, id=343, vol=1.742565e+09
assign (segid "   C" and resid   16 and name HE21) (segid "   C" and resid   16 and name HE22) 1.888 0.446 0.446 weight 1.000 ! spec=Expt_10, no=389, id=343, vol=1.742565e+09
assign (segid "   A" and resid   19 and name HD21) (segid "   A" and resid   19 and name HD22) 3.171 1.257 1.257 weight 1.000 ! spec=Expt_10, no=393, id=346, vol=7.766271e+07
assign (segid "   C" and resid   19 and name HD21) (segid "   C" and resid   19 and name HD22) 3.171 1.257 1.257 weight 1.000 ! spec=Expt_10, no=393, id=346, vol=7.766271e+07
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name  HB2) 3.442 1.481 1.481 weight 1.000 ! spec=Expt_10, no=397, id=348, vol=4.746188e+07
assign (segid "   C" and resid   21 and name   HN) (segid "   C" and resid   20 and name  HB2) 3.442 1.481 1.481 weight 1.000 ! spec=Expt_10, no=397, id=348, vol=4.746188e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   27 and name  HG2) 3.407 1.451 2.451 weight 1.000 ! spec=Expt_10, no=398, id=349, vol=5.041288e+07
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   27 and name  HG2) 3.407 1.451 2.451 weight 1.000 ! spec=Expt_10, no=398, id=349, vol=5.041288e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HB2) 3.126 1.221 1.221 weight 1.000 ! spec=Expt_10, no=399, id=350, vol=8.456368e+07
assign (segid "   C" and resid   25 and name   HN) (segid "   C" and resid   24 and name  HB2) 3.126 1.221 1.221 weight 1.000 ! spec=Expt_10, no=399, id=350, vol=8.456368e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name HD22) 3.607 1.627 1.627 weight 1.000 ! spec=Expt_10, no=400, id=351, vol=3.581596e+07
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name HD21)
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name HD23)
assign (segid "   C" and resid   25 and name   HN) (segid "   C" and resid   24 and name HD22) 3.607 1.627 1.627 weight 1.000 ! spec=Expt_10, no=400, id=351, vol=3.581596e+07
    or (segid "   C" and resid   25 and name   HN) (segid "   C" and resid   24 and name HD21)
    or (segid "   C" and resid   25 and name   HN) (segid "   C" and resid   24 and name HD23)
assign (segid "   A" and resid   37 and name   HN) (segid "   C" and resid   24 and name HD12) 3.199 1.279 1.279 weight 1.000 ! spec=Expt_10, no=402, id=352, vol=7.365585e+07
    or (segid "   A" and resid   37 and name   HN) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   37 and name   HN) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   37 and name   HN) (segid "   A" and resid   24 and name HD12) 3.199 1.279 1.279 weight 1.000 ! spec=Expt_10, no=402, id=352, vol=7.365585e+07
    or (segid "   C" and resid   37 and name   HN) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   37 and name   HN) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   12 and name   HN) 3.264 1.331 1.331 weight 1.000 ! spec=Expt_10, no=407, id=356, vol=6.530239e+07
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   12 and name   HN) 3.264 1.331 1.331 weight 1.000 ! spec=Expt_10, no=407, id=356, vol=6.530239e+07
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   28 and name  HD1) 3.438 1.478 1.478 weight 1.000 ! spec=Expt_10, no=409, id=357, vol=4.778094e+07
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   28 and name  HD1) 3.438 1.478 1.478 weight 1.000 ! spec=Expt_10, no=409, id=357, vol=4.778094e+07
    or (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name HG11) 3.132 1.226 2.868 weight 1.000 ! spec=Expt_10, no=411, id=358, vol=8.366626e+07
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   29 and name HG11) 3.132 1.226 2.868 weight 1.000 ! spec=Expt_10, no=411, id=358, vol=8.366626e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   28 and name  HE1) 3.583 1.605 1.605 weight 1.000 ! spec=Expt_10, no=412, id=359, vol=3.730378e+07
    or (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   28 and name  HE1) 3.583 1.605 1.605 weight 1.000 ! spec=Expt_10, no=412, id=359, vol=3.730378e+07
    or (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   28 and name   HZ) 3.475 1.509 1.509 weight 1.000 ! spec=Expt_10, no=413, id=360, vol=4.482979e+07
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   28 and name   HZ) 3.475 1.509 1.509 weight 1.000 ! spec=Expt_10, no=413, id=360, vol=4.482979e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   32 and name  HB2) 3.362 1.413 2.638 weight 1.000 ! spec=Expt_10, no=414, id=361, vol=5.467440e+07
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   32 and name  HB2) 3.362 1.413 2.638 weight 1.000 ! spec=Expt_10, no=414, id=361, vol=5.467440e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   21 and name  HA2) 3.427 1.468 1.468 weight 1.000 ! spec=Expt_10, no=417, id=363, vol=4.872413e+07
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   21 and name  HA2) 3.427 1.468 1.468 weight 1.000 ! spec=Expt_10, no=417, id=363, vol=4.872413e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   33 and name   HA) 3.394 1.440 1.440 weight 1.000 ! spec=Expt_10, no=418, id=364, vol=5.161237e+07
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   33 and name   HA) 3.394 1.440 1.440 weight 1.000 ! spec=Expt_10, no=418, id=364, vol=5.161237e+07
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   36 and name  HD2) 3.373 1.422 2.627 weight 1.000 ! spec=Expt_10, no=421, id=366, vol=5.358369e+07
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   36 and name  HD2) 3.373 1.422 2.627 weight 1.000 ! spec=Expt_10, no=421, id=366, vol=5.358369e+07
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   32 and name   HA) 3.344 1.398 1.398 weight 1.000 ! spec=Expt_10, no=423, id=368, vol=5.645416e+07
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   32 and name   HA) 3.344 1.398 1.398 weight 1.000 ! spec=Expt_10, no=423, id=368, vol=5.645416e+07
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   36 and name  HG1) 3.437 1.477 2.477 weight 1.000 ! spec=Expt_10, no=427, id=370, vol=4.783723e+07
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   36 and name  HG1) 3.437 1.477 2.477 weight 1.000 ! spec=Expt_10, no=427, id=370, vol=4.783723e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   C" and resid   24 and name HD22) 3.471 1.506 1.506 weight 1.000 ! spec=Expt_10, no=430, id=373, vol=4.511082e+07
    or (segid "   A" and resid   36 and name   HN) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   36 and name   HN) (segid "   C" and resid   24 and name HD23)
assign (segid "   C" and resid   36 and name   HN) (segid "   A" and resid   24 and name HD22) 3.471 1.506 1.506 weight 1.000 ! spec=Expt_10, no=430, id=373, vol=4.511082e+07
    or (segid "   C" and resid   36 and name   HN) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   36 and name   HN) (segid "   A" and resid   24 and name HD23)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   33 and name  HB1) 3.532 1.559 1.559 weight 1.000 ! spec=Expt_10, no=431, id=374, vol=4.066257e+07
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   33 and name  HB1) 3.532 1.559 1.559 weight 1.000 ! spec=Expt_10, no=431, id=374, vol=4.066257e+07
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   39 and name   HA) 3.405 1.449 1.449 weight 1.000 ! spec=Expt_10, no=434, id=375, vol=5.060840e+07
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   39 and name   HA) 3.405 1.449 1.449 weight 1.000 ! spec=Expt_10, no=434, id=375, vol=5.060840e+07
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   37 and name   HA) 3.391 1.438 1.438 weight 1.000 ! spec=Expt_10, no=436, id=377, vol=5.187867e+07
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   37 and name   HA) 3.391 1.438 1.438 weight 1.000 ! spec=Expt_10, no=436, id=377, vol=5.187867e+07
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   36 and name   HA) 2.771 0.960 3.229 weight 1.000 ! spec=Expt_10, no=437, id=378, vol=1.742766e+08
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   36 and name   HA) 2.771 0.960 3.229 weight 1.000 ! spec=Expt_10, no=437, id=378, vol=1.742766e+08
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   38 and name   HA) 3.560 1.584 1.584 weight 1.000 ! spec=Expt_10, no=439, id=380, vol=3.876713e+07
assign (segid "   C" and resid   40 and name   HN) (segid "   C" and resid   38 and name   HA) 3.560 1.584 1.584 weight 1.000 ! spec=Expt_10, no=439, id=380, vol=3.876713e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   38 and name   HB) 3.604 1.624 1.624 weight 1.000 ! spec=Expt_10, no=440, id=381, vol=3.599753e+07
assign (segid "   C" and resid   40 and name   HN) (segid "   C" and resid   38 and name   HB) 3.604 1.624 1.624 weight 1.000 ! spec=Expt_10, no=440, id=381, vol=3.599753e+07
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HG21) 3.658 1.672 1.672 weight 1.000 ! spec=Expt_10, no=441, id=382, vol=3.295905e+07
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HG23)
assign (segid "   C" and resid   41 and name   HN) (segid "   C" and resid   40 and name HG21) 3.658 1.672 1.672 weight 1.000 ! spec=Expt_10, no=441, id=382, vol=3.295905e+07
    or (segid "   C" and resid   41 and name   HN) (segid "   C" and resid   40 and name HG22)
    or (segid "   C" and resid   41 and name   HN) (segid "   C" and resid   40 and name HG23)
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name  HB2) 2.741 0.939 0.939 weight 1.000 ! spec=Expt_10, no=442, id=383, vol=1.861089e+08
assign (segid "   C" and resid   41 and name   HN) (segid "   C" and resid   41 and name  HB2) 2.741 0.939 0.939 weight 1.000 ! spec=Expt_10, no=442, id=383, vol=1.861089e+08
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   34 and name   HN) 3.272 1.339 2.728 weight 1.000 ! spec=Expt_10, no=443, id=384, vol=6.425990e+07
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   34 and name   HN) 3.272 1.339 2.728 weight 1.000 ! spec=Expt_10, no=443, id=384, vol=6.425990e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   20 and name   HA) 3.584 1.606 2.416 weight 1.000 ! spec=Expt_10, no=445, id=385, vol=3.721904e+07
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   20 and name   HA) 3.584 1.606 2.416 weight 1.000 ! spec=Expt_10, no=445, id=385, vol=3.721904e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   17 and name  HG2) 3.525 1.553 2.475 weight 1.000 ! spec=Expt_10, no=449, id=387, vol=4.111281e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   17 and name  HG2) 3.525 1.553 2.475 weight 1.000 ! spec=Expt_10, no=449, id=387, vol=4.111281e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   C" and resid   22 and name HG22) 3.274 1.340 2.726 weight 1.000 ! spec=Expt_10, no=454, id=390, vol=6.410848e+07
    or (segid "   A" and resid   40 and name   HN) (segid "   C" and resid   22 and name HG21)
    or (segid "   A" and resid   40 and name   HN) (segid "   C" and resid   22 and name HG23)
assign (segid "   C" and resid   40 and name   HN) (segid "   A" and resid   22 and name HG22) 3.274 1.340 2.726 weight 1.000 ! spec=Expt_10, no=454, id=390, vol=6.410848e+07
    or (segid "   C" and resid   40 and name   HN) (segid "   A" and resid   22 and name HG21)
    or (segid "   C" and resid   40 and name   HN) (segid "   A" and resid   22 and name HG23)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   16 and name  HB2) 3.539 1.565 1.565 weight 1.000 ! spec=Expt_10, no=457, id=391, vol=4.018881e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   16 and name  HB2) 3.539 1.565 1.565 weight 1.000 ! spec=Expt_10, no=457, id=391, vol=4.018881e+07
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HD12) 2.892 1.046 3.108 weight 1.000 ! spec=Expt_10, no=460, id=393, vol=1.348119e+08
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HD13)
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HD12) 2.892 1.046 3.108 weight 1.000 ! spec=Expt_10, no=460, id=393, vol=1.348119e+08
    or (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HD13)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name   HA) 2.280 0.650 0.650 weight 1.000 ! spec=Expt_10, no=465, id=396, vol=5.616734e+08
assign (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   15 and name   HA) 2.280 0.650 0.650 weight 1.000 ! spec=Expt_10, no=465, id=396, vol=5.616734e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HG1) 2.770 0.959 3.230 weight 1.000 ! spec=Expt_10, no=468, id=397, vol=1.748341e+08
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   16 and name  HG1) 2.770 0.959 3.230 weight 1.000 ! spec=Expt_10, no=468, id=397, vol=1.748341e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HG2) 2.859 1.022 3.141 weight 1.000 ! spec=Expt_10, no=469, id=398, vol=1.444922e+08
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   16 and name  HG2) 2.859 1.022 3.141 weight 1.000 ! spec=Expt_10, no=469, id=398, vol=1.444922e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HG2) 2.290 0.655 3.710 weight 1.000 ! spec=Expt_10, no=471, id=399, vol=5.474720e+08
assign (segid "   C" and resid   17 and name   HN) (segid "   C" and resid   17 and name  HG2) 2.290 0.655 3.710 weight 1.000 ! spec=Expt_10, no=471, id=399, vol=5.474720e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   28 and name   HZ) 3.502 1.533 1.533 weight 1.000 ! spec=Expt_10, no=472, id=400, vol=4.279181e+07
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   28 and name   HZ) 3.502 1.533 1.533 weight 1.000 ! spec=Expt_10, no=472, id=400, vol=4.279181e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB2) 2.929 1.072 1.072 weight 1.000 ! spec=Expt_10, no=473, id=401, vol=1.250696e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   18 and name  HB2) 2.929 1.072 1.072 weight 1.000 ! spec=Expt_10, no=473, id=401, vol=1.250696e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid    8 and name  HB2) 3.110 1.209 1.209 weight 1.000 ! spec=Expt_10, no=474, id=402, vol=8.716991e+07
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid    8 and name  HB2) 3.110 1.209 1.209 weight 1.000 ! spec=Expt_10, no=474, id=402, vol=8.716991e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HG2) 2.987 1.115 3.013 weight 1.000 ! spec=Expt_10, no=475, id=403, vol=1.110692e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   17 and name  HG2) 2.987 1.115 3.013 weight 1.000 ! spec=Expt_10, no=475, id=403, vol=1.110692e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name  HB1) 2.876 1.034 3.124 weight 1.000 ! spec=Expt_10, no=476, id=404, vol=1.395310e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   16 and name  HB1) 2.876 1.034 3.124 weight 1.000 ! spec=Expt_10, no=476, id=404, vol=1.395310e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HB1) 2.632 0.866 1.866 weight 1.000 ! spec=Expt_10, no=478, id=405, vol=2.372986e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   17 and name  HB1) 2.632 0.866 1.866 weight 1.000 ! spec=Expt_10, no=478, id=405, vol=2.372986e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HB2) 2.705 0.915 1.915 weight 1.000 ! spec=Expt_10, no=479, id=406, vol=2.014591e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   17 and name  HB2) 2.705 0.915 1.915 weight 1.000 ! spec=Expt_10, no=479, id=406, vol=2.014591e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   28 and name   HA) 3.210 1.288 1.288 weight 1.000 ! spec=Expt_10, no=481, id=407, vol=7.218143e+07
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   28 and name   HA) 3.210 1.288 1.288 weight 1.000 ! spec=Expt_10, no=481, id=407, vol=7.218143e+07
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   31 and name   HA) 3.140 1.233 1.233 weight 1.000 ! spec=Expt_10, no=482, id=408, vol=8.228014e+07
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   31 and name   HA) 3.140 1.233 1.233 weight 1.000 ! spec=Expt_10, no=482, id=408, vol=8.228014e+07
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   28 and name   HA) 3.151 1.241 2.849 weight 1.000 ! spec=Expt_10, no=487, id=410, vol=8.056914e+07
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   28 and name   HA) 3.151 1.241 2.849 weight 1.000 ! spec=Expt_10, no=487, id=410, vol=8.056914e+07
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HG12) 3.125 1.220 1.220 weight 1.000 ! spec=Expt_10, no=488, id=411, vol=8.479759e+07
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name HG12) 3.125 1.220 1.220 weight 1.000 ! spec=Expt_10, no=488, id=411, vol=8.479759e+07
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HG11) 2.515 0.790 0.790 weight 1.000 ! spec=Expt_10, no=489, id=412, vol=3.120026e+08
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name HG11) 2.515 0.790 0.790 weight 1.000 ! spec=Expt_10, no=489, id=412, vol=3.120026e+08
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HD12) 2.704 0.914 0.914 weight 1.000 ! spec=Expt_10, no=490, id=413, vol=2.017338e+08
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HD11)
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HD13)
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name HD12) 2.704 0.914 0.914 weight 1.000 ! spec=Expt_10, no=490, id=413, vol=2.017338e+08
    or (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name HD11)
    or (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name HD13)
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   28 and name   HA) 3.156 1.245 1.245 weight 1.000 ! spec=Expt_10, no=491, id=414, vol=7.979224e+07
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   28 and name   HA) 3.156 1.245 1.245 weight 1.000 ! spec=Expt_10, no=491, id=414, vol=7.979224e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   22 and name HG11) 3.409 1.453 1.453 weight 1.000 ! spec=Expt_10, no=492, id=415, vol=5.025816e+07
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   22 and name HG11) 3.409 1.453 1.453 weight 1.000 ! spec=Expt_10, no=492, id=415, vol=5.025816e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name   HA) 2.794 0.976 0.976 weight 1.000 ! spec=Expt_10, no=497, id=418, vol=1.657985e+08
assign (segid "   C" and resid   25 and name   HN) (segid "   C" and resid   25 and name   HA) 2.794 0.976 0.976 weight 1.000 ! spec=Expt_10, no=497, id=418, vol=1.657985e+08
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HB1) 3.271 1.337 1.337 weight 1.000 ! spec=Expt_10, no=498, id=419, vol=6.445304e+07
assign (segid "   C" and resid   25 and name   HN) (segid "   C" and resid   24 and name  HB1) 3.271 1.337 1.337 weight 1.000 ! spec=Expt_10, no=498, id=419, vol=6.445304e+07
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   23 and name   HA) 3.336 1.391 1.391 weight 1.000 ! spec=Expt_10, no=499, id=420, vol=5.725787e+07
assign (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   23 and name   HA) 3.336 1.391 1.391 weight 1.000 ! spec=Expt_10, no=499, id=420, vol=5.725787e+07
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name   HA) 2.835 1.004 1.004 weight 1.000 ! spec=Expt_10, no=500, id=421, vol=1.521046e+08
assign (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   26 and name   HA) 2.835 1.004 1.004 weight 1.000 ! spec=Expt_10, no=500, id=421, vol=1.521046e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   25 and name   HA) 2.846 1.013 3.154 weight 1.000 ! spec=Expt_10, no=501, id=422, vol=1.484735e+08
assign (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   25 and name   HA) 2.846 1.013 3.154 weight 1.000 ! spec=Expt_10, no=501, id=422, vol=1.484735e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   28 and name   HA) 3.081 1.186 2.919 weight 1.000 ! spec=Expt_10, no=504, id=424, vol=9.233573e+07
assign (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   28 and name   HA) 3.081 1.186 2.919 weight 1.000 ! spec=Expt_10, no=504, id=424, vol=9.233573e+07
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name HD12) 2.465 0.759 0.759 weight 1.000 ! spec=Expt_10, no=508, id=427, vol=3.518539e+08
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name HD11)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name HD13)
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   29 and name HD12) 2.465 0.759 0.759 weight 1.000 ! spec=Expt_10, no=508, id=427, vol=3.518539e+08
    or (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   29 and name HD11)
    or (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   29 and name HD13)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name   HB) 2.346 0.688 0.688 weight 1.000 ! spec=Expt_10, no=511, id=428, vol=4.729631e+08
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   29 and name   HB) 2.346 0.688 0.688 weight 1.000 ! spec=Expt_10, no=511, id=428, vol=4.729631e+08
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   12 and name HG22) 3.581 1.603 2.419 weight 1.000 ! spec=Expt_10, no=514, id=430, vol=3.739648e+07
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   12 and name HG23)
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   12 and name HG22) 3.581 1.603 2.419 weight 1.000 ! spec=Expt_10, no=514, id=430, vol=3.739648e+07
    or (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   12 and name HG21)
    or (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   12 and name HG23)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   13 and name HG11) 3.656 1.671 1.671 weight 1.000 ! spec=Expt_10, no=515, id=431, vol=3.301655e+07
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   13 and name HG11) 3.656 1.671 1.671 weight 1.000 ! spec=Expt_10, no=515, id=431, vol=3.301655e+07
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name HG22) 2.501 0.782 0.782 weight 1.000 ! spec=Expt_10, no=518, id=432, vol=3.220673e+08
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   29 and name HG22) 2.501 0.782 0.782 weight 1.000 ! spec=Expt_10, no=518, id=432, vol=3.220673e+08
    or (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   34 and name   HN) 2.338 0.683 3.662 weight 1.000 ! spec=Expt_10, no=520, id=433, vol=4.827557e+08
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   34 and name   HN) 2.338 0.683 3.662 weight 1.000 ! spec=Expt_10, no=520, id=433, vol=4.827557e+08
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name   HA) 2.840 1.008 1.008 weight 1.000 ! spec=Expt_10, no=523, id=434, vol=1.504134e+08
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   32 and name   HA) 2.840 1.008 1.008 weight 1.000 ! spec=Expt_10, no=523, id=434, vol=1.504134e+08
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name  HB2) 2.438 0.743 3.562 weight 1.000 ! spec=Expt_10, no=524, id=435, vol=3.759045e+08
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   32 and name  HB2) 2.438 0.743 3.562 weight 1.000 ! spec=Expt_10, no=524, id=435, vol=3.759045e+08
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   37 and name HG12) 2.699 0.910 3.301 weight 1.000 ! spec=Expt_10, no=526, id=437, vol=2.043374e+08
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   37 and name HG13)
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   37 and name HG12) 2.699 0.910 3.301 weight 1.000 ! spec=Expt_10, no=526, id=437, vol=2.043374e+08
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   37 and name HG11)
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   37 and name HG13)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   36 and name   HA) 3.563 1.587 1.587 weight 1.000 ! spec=Expt_10, no=527, id=438, vol=3.858478e+07
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   36 and name   HA) 3.563 1.587 1.587 weight 1.000 ! spec=Expt_10, no=527, id=438, vol=3.858478e+07
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   36 and name   HN) 3.507 1.537 1.537 weight 1.000 ! spec=Expt_10, no=533, id=439, vol=4.242067e+07
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   36 and name   HN) 3.507 1.537 1.537 weight 1.000 ! spec=Expt_10, no=533, id=439, vol=4.242067e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name   HB) 3.163 1.250 2.837 weight 1.000 ! spec=Expt_10, no=534, id=440, vol=7.885650e+07
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   37 and name   HB) 3.163 1.250 2.837 weight 1.000 ! spec=Expt_10, no=534, id=440, vol=7.885650e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HG2) 2.423 0.734 3.577 weight 1.000 ! spec=Expt_10, no=535, id=441, vol=3.900735e+08
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   36 and name  HG2) 2.423 0.734 3.577 weight 1.000 ! spec=Expt_10, no=535, id=441, vol=3.900735e+08
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name HG12) 2.824 0.997 0.997 weight 1.000 ! spec=Expt_10, no=536, id=442, vol=1.555408e+08
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name HG13)
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   37 and name HG12) 2.824 0.997 0.997 weight 1.000 ! spec=Expt_10, no=536, id=442, vol=1.555408e+08
    or (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   37 and name HG11)
    or (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   37 and name HG13)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name   HA) 3.399 1.445 1.445 weight 1.000 ! spec=Expt_10, no=537, id=443, vol=5.112699e+07
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   37 and name   HA) 3.399 1.445 1.445 weight 1.000 ! spec=Expt_10, no=537, id=443, vol=5.112699e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   33 and name   HA) 2.502 0.783 0.783 weight 1.000 ! spec=Expt_10, no=538, id=444, vol=3.213495e+08
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   33 and name   HA) 2.502 0.783 0.783 weight 1.000 ! spec=Expt_10, no=538, id=444, vol=3.213495e+08
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   35 and name   HA) 3.098 1.200 1.200 weight 1.000 ! spec=Expt_10, no=539, id=445, vol=8.929435e+07
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   35 and name   HA) 3.098 1.200 1.200 weight 1.000 ! spec=Expt_10, no=539, id=445, vol=8.929435e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HG12) 2.139 0.572 0.572 weight 1.000 ! spec=Expt_10, no=541, id=447, vol=8.243881e+08
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HG13)
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   37 and name HG12) 2.139 0.572 0.572 weight 1.000 ! spec=Expt_10, no=541, id=447, vol=8.243881e+08
    or (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   37 and name HG11)
    or (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   37 and name HG13)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HG22) 2.139 0.572 0.572 weight 1.000 ! spec=Expt_10, no=542, id=448, vol=8.243881e+08
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   37 and name HG22) 2.139 0.572 0.572 weight 1.000 ! spec=Expt_10, no=542, id=448, vol=8.243881e+08
    or (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   37 and name HG21)
    or (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   37 and name HG23)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HG12) 2.223 0.618 3.777 weight 1.000 ! spec=Expt_10, no=543, id=449, vol=6.538657e+08
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HG13)
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   37 and name HG12) 2.223 0.618 3.777 weight 1.000 ! spec=Expt_10, no=543, id=449, vol=6.538657e+08
    or (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   37 and name HG11)
    or (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   37 and name HG13)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HG22) 2.320 0.673 0.673 weight 1.000 ! spec=Expt_10, no=544, id=450, vol=5.059807e+08
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   37 and name HG22) 2.320 0.673 0.673 weight 1.000 ! spec=Expt_10, no=544, id=450, vol=5.059807e+08
    or (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   37 and name HG21)
    or (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   37 and name HG23)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   37 and name   HB) 3.543 1.569 1.569 weight 1.000 ! spec=Expt_10, no=545, id=451, vol=3.989818e+07
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   37 and name   HB) 3.543 1.569 1.569 weight 1.000 ! spec=Expt_10, no=545, id=451, vol=3.989818e+07
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   40 and name HG21) 3.636 1.653 2.364 weight 1.000 ! spec=Expt_10, no=546, id=452, vol=3.412754e+07
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   40 and name HG23)
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   40 and name HG21) 3.636 1.653 2.364 weight 1.000 ! spec=Expt_10, no=546, id=452, vol=3.412754e+07
    or (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   40 and name HG22)
    or (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   40 and name HG23)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name HD12) 2.594 0.841 3.406 weight 1.000 ! spec=Expt_10, no=547, id=453, vol=2.588818e+08
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name HD11)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name HD13)
assign (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   38 and name HD12) 2.594 0.841 3.406 weight 1.000 ! spec=Expt_10, no=547, id=453, vol=2.588818e+08
    or (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   38 and name HD11)
    or (segid "   C" and resid   39 and name   HN) (segid "   C" and resid   38 and name HD13)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name   HA) 2.410 0.726 0.726 weight 1.000 ! spec=Expt_10, no=548, id=454, vol=4.027129e+08
assign (segid "   C" and resid   40 and name   HN) (segid "   C" and resid   40 and name   HA) 2.410 0.726 0.726 weight 1.000 ! spec=Expt_10, no=548, id=454, vol=4.027129e+08
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   46 and name  HB2) 2.749 0.945 0.945 weight 1.000 ! spec=Expt_10, no=549, id=455, vol=1.826989e+08
assign (segid "   C" and resid   46 and name   HN) (segid "   C" and resid   46 and name  HB2) 2.749 0.945 0.945 weight 1.000 ! spec=Expt_10, no=549, id=455, vol=1.826989e+08
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name   HA) 2.397 0.718 0.718 weight 1.000 ! spec=Expt_10, no=550, id=456, vol=4.165322e+08
assign (segid "   C" and resid   47 and name   HN) (segid "   C" and resid   47 and name   HA) 2.397 0.718 0.718 weight 1.000 ! spec=Expt_10, no=550, id=456, vol=4.165322e+08
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name  HB2) 3.399 1.444 1.444 weight 1.000 ! spec=Expt_10, no=551, id=457, vol=5.115902e+07
assign (segid "   C" and resid   47 and name   HN) (segid "   C" and resid   46 and name  HB2) 3.399 1.444 1.444 weight 1.000 ! spec=Expt_10, no=551, id=457, vol=5.115902e+07
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB1) 3.287 1.350 1.350 weight 1.000 ! spec=Expt_10, no=552, id=458, vol=6.261882e+07
assign (segid "   C" and resid    8 and name   HN) (segid "   C" and resid    8 and name  HB1) 3.287 1.350 1.350 weight 1.000 ! spec=Expt_10, no=552, id=458, vol=6.261882e+07
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid   18 and name   HN) 3.514 1.543 2.486 weight 1.000 ! spec=Expt_10, no=554, id=459, vol=4.191829e+07
assign (segid "   C" and resid    9 and name   HN) (segid "   C" and resid   18 and name   HN) 3.514 1.543 2.486 weight 1.000 ! spec=Expt_10, no=554, id=459, vol=4.191829e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   16 and name  HB1) 3.447 1.485 2.553 weight 1.000 ! spec=Expt_10, no=555, id=460, vol=4.705522e+07
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   16 and name  HB1) 3.447 1.485 2.553 weight 1.000 ! spec=Expt_10, no=555, id=460, vol=4.705522e+07
assign (segid "   A" and resid   15 and name   HN) (segid "   C" and resid   25 and name  HE1) 3.747 1.755 1.755 weight 1.000 ! spec=Expt_10, no=566, id=464, vol=2.850605e+07
    or (segid "   A" and resid   15 and name   HN) (segid "   C" and resid   25 and name  HE2)
assign (segid "   C" and resid   15 and name   HN) (segid "   A" and resid   25 and name  HE1) 3.747 1.755 1.755 weight 1.000 ! spec=Expt_10, no=566, id=464, vol=2.850605e+07
    or (segid "   C" and resid   15 and name   HN) (segid "   A" and resid   25 and name  HE2)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   10 and name HG21) 2.720 0.925 3.280 weight 1.000 ! spec=Expt_10, no=569, id=465, vol=1.946898e+08
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   10 and name HG21) 2.720 0.925 3.280 weight 1.000 ! spec=Expt_10, no=569, id=465, vol=1.946898e+08
    or (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name  HB1) 3.030 1.147 2.970 weight 1.000 ! spec=Expt_10, no=570, id=466, vol=1.020495e+08
assign (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   14 and name  HB1) 3.030 1.147 2.970 weight 1.000 ! spec=Expt_10, no=570, id=466, vol=1.020495e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   31 and name  HB1) 2.994 1.121 3.006 weight 1.000 ! spec=Expt_10, no=581, id=470, vol=1.094722e+08
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   31 and name  HB1) 2.994 1.121 3.006 weight 1.000 ! spec=Expt_10, no=581, id=470, vol=1.094722e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name   HB) 2.834 1.004 3.166 weight 1.000 ! spec=Expt_10, no=582, id=471, vol=1.522080e+08
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name   HB) 2.834 1.004 3.166 weight 1.000 ! spec=Expt_10, no=582, id=471, vol=1.522080e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HG2) 2.354 0.693 3.646 weight 1.000 ! spec=Expt_10, no=583, id=472, vol=4.636957e+08
assign (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   27 and name  HG2) 2.354 0.693 3.646 weight 1.000 ! spec=Expt_10, no=583, id=472, vol=4.636957e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   C" and resid   13 and name HG22) 3.339 1.394 1.394 weight 1.000 ! spec=Expt_10, no=584, id=473, vol=5.689526e+07
    or (segid "   A" and resid   27 and name   HN) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   27 and name   HN) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   27 and name   HN) (segid "   A" and resid   13 and name HG22) 3.339 1.394 1.394 weight 1.000 ! spec=Expt_10, no=584, id=473, vol=5.689526e+07
    or (segid "   C" and resid   27 and name   HN) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   27 and name   HN) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   12 and name HG22) 3.388 1.435 2.435 weight 1.000 ! spec=Expt_10, no=587, id=474, vol=5.215724e+07
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   12 and name HG23)
assign (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   12 and name HG22) 3.388 1.435 2.435 weight 1.000 ! spec=Expt_10, no=587, id=474, vol=5.215724e+07
    or (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   12 and name HG21)
    or (segid "   C" and resid   29 and name   HN) (segid "   C" and resid   12 and name HG23)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name HG22) 2.820 0.994 0.994 weight 1.000 ! spec=Expt_10, no=588, id=475, vol=1.567558e+08
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   37 and name HG22) 2.820 0.994 0.994 weight 1.000 ! spec=Expt_10, no=588, id=475, vol=1.567558e+08
    or (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   37 and name HG21)
    or (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   37 and name HG23)
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name  HB2) 2.520 0.794 0.794 weight 1.000 ! spec=Expt_10, no=589, id=476, vol=3.079644e+08
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   24 and name  HB2) 2.520 0.794 0.794 weight 1.000 ! spec=Expt_10, no=589, id=476, vol=3.079644e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HD2) 2.313 0.669 0.669 weight 1.000 ! spec=Expt_10, no=590, id=477, vol=5.153143e+08
assign (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   27 and name  HD2) 2.313 0.669 0.669 weight 1.000 ! spec=Expt_10, no=590, id=477, vol=5.153143e+08
assign (segid "   A" and resid    3 and name   HA) (segid "   A" and resid    3 and name  HB2) 2.596 0.842 0.842 weight 1.000 ! spec=Expt_11, no=4, id=485, vol=4.251710e+08
assign (segid "   C" and resid    3 and name   HA) (segid "   C" and resid    3 and name  HB2) 2.596 0.842 0.842 weight 1.000 ! spec=Expt_11, no=4, id=485, vol=4.251710e+08
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name HG22) 2.389 0.713 0.713 weight 1.000 ! spec=Expt_11, no=9, id=490, vol=6.994553e+08
    or (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name HG23)
assign (segid "   C" and resid    5 and name   HA) (segid "   C" and resid    5 and name HG22) 2.389 0.713 0.713 weight 1.000 ! spec=Expt_11, no=9, id=490, vol=6.994553e+08
    or (segid "   C" and resid    5 and name   HA) (segid "   C" and resid    5 and name HG21)
    or (segid "   C" and resid    5 and name   HA) (segid "   C" and resid    5 and name HG23)
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name  HB1) 2.269 0.643 0.643 weight 1.000 ! spec=Expt_11, no=11, id=492, vol=9.529242e+08
assign (segid "   C" and resid    6 and name   HA) (segid "   C" and resid    6 and name  HB1) 2.269 0.643 0.643 weight 1.000 ! spec=Expt_11, no=11, id=492, vol=9.529242e+08
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name  HG2) 2.528 0.799 3.472 weight 1.000 ! spec=Expt_11, no=12, id=493, vol=4.982451e+08
assign (segid "   C" and resid    6 and name   HA) (segid "   C" and resid    6 and name  HG2) 2.528 0.799 3.472 weight 1.000 ! spec=Expt_11, no=12, id=493, vol=4.982451e+08
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name HD12) 2.254 0.635 1.635 weight 1.000 ! spec=Expt_11, no=16, id=497, vol=9.911297e+08
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name HD11)
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name HD13)
assign (segid "   C" and resid    7 and name  HB2) (segid "   C" and resid    7 and name HD12) 2.254 0.635 1.635 weight 1.000 ! spec=Expt_11, no=16, id=497, vol=9.911297e+08
    or (segid "   C" and resid    7 and name  HB2) (segid "   C" and resid    7 and name HD11)
    or (segid "   C" and resid    7 and name  HB2) (segid "   C" and resid    7 and name HD13)
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name  HB1) 2.380 0.708 0.708 weight 1.000 ! spec=Expt_11, no=18, id=499, vol=7.146297e+08
assign (segid "   C" and resid    8 and name   HA) (segid "   C" and resid    8 and name  HB1) 2.380 0.708 0.708 weight 1.000 ! spec=Expt_11, no=18, id=499, vol=7.146297e+08
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   17 and name   HA) 2.299 0.661 0.661 weight 1.000 ! spec=Expt_11, no=22, id=503, vol=8.796262e+08
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   17 and name   HA) 2.299 0.661 0.661 weight 1.000 ! spec=Expt_11, no=22, id=503, vol=8.796262e+08
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name   HB) 2.707 0.916 0.916 weight 1.000 ! spec=Expt_11, no=23, id=504, vol=3.303207e+08
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   10 and name   HB) 2.707 0.916 0.916 weight 1.000 ! spec=Expt_11, no=23, id=504, vol=3.303207e+08
assign (segid "   A" and resid   10 and name   HB) (segid "   A" and resid    9 and name   HA) 2.810 0.987 3.190 weight 1.000 ! spec=Expt_11, no=27, id=507, vol=2.643075e+08
assign (segid "   C" and resid   10 and name   HB) (segid "   C" and resid    9 and name   HA) 2.810 0.987 3.190 weight 1.000 ! spec=Expt_11, no=27, id=507, vol=2.643075e+08
assign (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG21) 2.132 0.568 0.568 weight 1.000 ! spec=Expt_11, no=29, id=509, vol=1.383518e+09
    or (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   10 and name   HB) (segid "   C" and resid   10 and name HG21) 2.132 0.568 0.568 weight 1.000 ! spec=Expt_11, no=29, id=509, vol=1.383518e+09
    or (segid "   C" and resid   10 and name   HB) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   10 and name   HB) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HG21) 2.145 0.575 0.575 weight 1.000 ! spec=Expt_11, no=30, id=510, vol=1.334409e+09
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   10 and name HG21) 2.145 0.575 0.575 weight 1.000 ! spec=Expt_11, no=30, id=510, vol=1.334409e+09
    or (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   17 and name  HG2) 2.767 0.957 0.957 weight 1.000 ! spec=Expt_11, no=34, id=513, vol=2.894099e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   17 and name  HG2)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   17 and name  HG2)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   17 and name  HG2) 2.767 0.957 0.957 weight 1.000 ! spec=Expt_11, no=34, id=513, vol=2.894099e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   17 and name  HG2)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   17 and name  HG2)
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   18 and name  HG2) 2.698 0.910 3.302 weight 1.000 ! spec=Expt_11, no=35, id=514, vol=3.373303e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   18 and name  HG2)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   18 and name  HG2)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   18 and name  HG2) 2.698 0.910 3.302 weight 1.000 ! spec=Expt_11, no=35, id=514, vol=3.373303e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   18 and name  HG2)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   18 and name  HG2)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   11 and name  HB1) 2.622 0.859 0.859 weight 1.000 ! spec=Expt_11, no=38, id=517, vol=4.004093e+08
assign (segid "   C" and resid   11 and name   HA) (segid "   C" and resid   11 and name  HB1) 2.622 0.859 0.859 weight 1.000 ! spec=Expt_11, no=38, id=517, vol=4.004093e+08
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   11 and name  HB1) 2.176 0.592 0.592 weight 1.000 ! spec=Expt_11, no=39, id=518, vol=1.223283e+09
assign (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   11 and name  HB1) 2.176 0.592 0.592 weight 1.000 ! spec=Expt_11, no=39, id=518, vol=1.223283e+09
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   15 and name   HA) 2.737 0.937 3.263 weight 1.000 ! spec=Expt_11, no=40, id=519, vol=3.090573e+08
assign (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   15 and name   HA) 2.737 0.937 3.263 weight 1.000 ! spec=Expt_11, no=40, id=519, vol=3.090573e+08
assign (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   12 and name   HB) 2.041 0.521 0.521 weight 1.000 ! spec=Expt_11, no=44, id=521, vol=1.800316e+09
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   12 and name   HB)
assign (segid "   C" and resid   12 and name HG22) (segid "   C" and resid   12 and name   HB) 2.041 0.521 0.521 weight 1.000 ! spec=Expt_11, no=44, id=521, vol=1.800316e+09
    or (segid "   C" and resid   12 and name HG21) (segid "   C" and resid   12 and name   HB)
    or (segid "   C" and resid   12 and name HG23) (segid "   C" and resid   12 and name   HB)
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name   HB) 2.147 0.576 0.576 weight 1.000 ! spec=Expt_11, no=48, id=525, vol=1.327102e+09
assign (segid "   C" and resid   12 and name   HA) (segid "   C" and resid   12 and name   HB) 2.147 0.576 0.576 weight 1.000 ! spec=Expt_11, no=48, id=525, vol=1.327102e+09
assign (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   12 and name   HA) 2.066 0.533 3.934 weight 1.000 ! spec=Expt_11, no=49, id=526, vol=1.672593e+09
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   12 and name   HA)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   12 and name   HA)
assign (segid "   C" and resid   12 and name HG22) (segid "   C" and resid   12 and name   HA) 2.066 0.533 3.934 weight 1.000 ! spec=Expt_11, no=49, id=526, vol=1.672593e+09
    or (segid "   C" and resid   12 and name HG21) (segid "   C" and resid   12 and name   HA)
    or (segid "   C" and resid   12 and name HG23) (segid "   C" and resid   12 and name   HA)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name   HA) 2.749 0.945 0.945 weight 1.000 ! spec=Expt_11, no=57, id=534, vol=3.009325e+08
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   14 and name   HA) 2.749 0.945 0.945 weight 1.000 ! spec=Expt_11, no=57, id=534, vol=3.009325e+08
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name  HB2) 2.225 0.619 0.619 weight 1.000 ! spec=Expt_11, no=59, id=536, vol=1.070823e+09
assign (segid "   C" and resid   14 and name   HA) (segid "   C" and resid   14 and name  HB2) 2.225 0.619 0.619 weight 1.000 ! spec=Expt_11, no=59, id=536, vol=1.070823e+09
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name  HB1) 2.285 0.653 0.653 weight 1.000 ! spec=Expt_11, no=60, id=537, vol=9.122437e+08
assign (segid "   C" and resid   14 and name   HA) (segid "   C" and resid   14 and name  HB1) 2.285 0.653 0.653 weight 1.000 ! spec=Expt_11, no=60, id=537, vol=9.122437e+08
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   14 and name  HB1) 2.026 0.513 0.513 weight 1.000 ! spec=Expt_11, no=62, id=539, vol=1.881537e+09
assign (segid "   C" and resid   14 and name  HB2) (segid "   C" and resid   14 and name  HB1) 2.026 0.513 0.513 weight 1.000 ! spec=Expt_11, no=62, id=539, vol=1.881537e+09
assign (segid "   A" and resid   14 and name  HB2) (segid "   C" and resid   25 and name  HE1) 2.989 1.117 1.117 weight 1.000 ! spec=Expt_11, no=64, id=541, vol=1.824275e+08
    or (segid "   A" and resid   14 and name  HB2) (segid "   C" and resid   25 and name  HE2)
assign (segid "   C" and resid   14 and name  HB2) (segid "   A" and resid   25 and name  HE1) 2.989 1.117 1.117 weight 1.000 ! spec=Expt_11, no=64, id=541, vol=1.824275e+08
    or (segid "   C" and resid   14 and name  HB2) (segid "   A" and resid   25 and name  HE2)
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   19 and name  HB1) 2.234 0.624 0.624 weight 1.000 ! spec=Expt_11, no=68, id=545, vol=1.046529e+09
assign (segid "   C" and resid   19 and name   HA) (segid "   C" and resid   19 and name  HB1) 2.234 0.624 0.624 weight 1.000 ! spec=Expt_11, no=68, id=545, vol=1.046529e+09
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name  HB2) 2.454 0.753 0.753 weight 1.000 ! spec=Expt_11, no=69, id=546, vol=5.952127e+08
assign (segid "   C" and resid   18 and name   HA) (segid "   C" and resid   18 and name  HB2) 2.454 0.753 0.753 weight 1.000 ! spec=Expt_11, no=69, id=546, vol=5.952127e+08
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name  HG1) 2.628 0.863 3.372 weight 1.000 ! spec=Expt_11, no=71, id=547, vol=3.945942e+08
assign (segid "   C" and resid   18 and name   HA) (segid "   C" and resid   18 and name  HG1) 2.628 0.863 3.372 weight 1.000 ! spec=Expt_11, no=71, id=547, vol=3.945942e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name   HA) 2.858 1.021 1.021 weight 1.000 ! spec=Expt_11, no=72, id=548, vol=2.387343e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   18 and name   HA) 2.858 1.021 1.021 weight 1.000 ! spec=Expt_11, no=72, id=548, vol=2.387343e+08
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name  HB2) 2.199 0.604 3.801 weight 1.000 ! spec=Expt_11, no=74, id=550, vol=1.151096e+09
assign (segid "   C" and resid   20 and name   HA) (segid "   C" and resid   20 and name  HB2) 2.199 0.604 3.801 weight 1.000 ! spec=Expt_11, no=74, id=550, vol=1.151096e+09
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   21 and name  HA2) 2.621 0.859 3.379 weight 1.000 ! spec=Expt_11, no=81, id=557, vol=4.009464e+08
assign (segid "   C" and resid   20 and name  HB2) (segid "   C" and resid   21 and name  HA2) 2.621 0.859 3.379 weight 1.000 ! spec=Expt_11, no=81, id=557, vol=4.009464e+08
assign (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name   HN) 2.600 0.845 3.400 weight 1.000 ! spec=Expt_11, no=82, id=558, vol=4.212887e+08
assign (segid "   C" and resid   27 and name  HB1) (segid "   C" and resid   27 and name   HN) 2.600 0.845 3.400 weight 1.000 ! spec=Expt_11, no=82, id=558, vol=4.212887e+08
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   21 and name  HA2) 2.255 0.636 0.636 weight 1.000 ! spec=Expt_11, no=83, id=559, vol=9.874530e+08
assign (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   21 and name  HA2) 2.255 0.636 0.636 weight 1.000 ! spec=Expt_11, no=83, id=559, vol=9.874530e+08
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   30 and name   HA) 2.663 0.886 0.886 weight 1.000 ! spec=Expt_11, no=84, id=560, vol=3.644866e+08
assign (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   30 and name   HA) 2.663 0.886 0.886 weight 1.000 ! spec=Expt_11, no=84, id=560, vol=3.644866e+08
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   31 and name  HB1) 2.836 1.005 2.005 weight 1.000 ! spec=Expt_11, no=85, id=561, vol=2.500365e+08
assign (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   31 and name  HB1) 2.836 1.005 2.005 weight 1.000 ! spec=Expt_11, no=85, id=561, vol=2.500365e+08
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name HG12) 2.393 0.716 0.716 weight 1.000 ! spec=Expt_11, no=92, id=568, vol=6.926807e+08
assign (segid "   C" and resid   22 and name   HB) (segid "   C" and resid   22 and name HG12) 2.393 0.716 0.716 weight 1.000 ! spec=Expt_11, no=92, id=568, vol=6.926807e+08
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name   HA) 2.334 0.681 0.681 weight 1.000 ! spec=Expt_11, no=94, id=569, vol=8.032734e+08
assign (segid "   C" and resid   22 and name   HB) (segid "   C" and resid   22 and name   HA) 2.334 0.681 0.681 weight 1.000 ! spec=Expt_11, no=94, id=569, vol=8.032734e+08
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   23 and name  HB2) 2.437 0.743 0.743 weight 1.000 ! spec=Expt_11, no=96, id=571, vol=6.200045e+08
assign (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   23 and name  HB2) 2.437 0.743 0.743 weight 1.000 ! spec=Expt_11, no=96, id=571, vol=6.200045e+08
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name HD12) 2.370 0.702 3.630 weight 1.000 ! spec=Expt_11, no=103, id=577, vol=7.328981e+08
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name HD11)
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name HD13)
assign (segid "   C" and resid   24 and name   HA) (segid "   C" and resid   24 and name HD12) 2.370 0.702 3.630 weight 1.000 ! spec=Expt_11, no=103, id=577, vol=7.328981e+08
    or (segid "   C" and resid   24 and name   HA) (segid "   C" and resid   24 and name HD11)
    or (segid "   C" and resid   24 and name   HA) (segid "   C" and resid   24 and name HD13)
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name   HA) 2.840 1.008 1.008 weight 1.000 ! spec=Expt_11, no=104, id=578, vol=2.477124e+08
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   24 and name   HA) 2.840 1.008 1.008 weight 1.000 ! spec=Expt_11, no=104, id=578, vol=2.477124e+08
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   29 and name   HA) 2.740 0.938 0.938 weight 1.000 ! spec=Expt_11, no=114, id=588, vol=3.073915e+08
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   29 and name   HA) 2.740 0.938 0.938 weight 1.000 ! spec=Expt_11, no=114, id=588, vol=3.073915e+08
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name   HN) 2.768 0.958 0.958 weight 1.000 ! spec=Expt_11, no=115, id=589, vol=2.888941e+08
assign (segid "   C" and resid   29 and name   HA) (segid "   C" and resid   29 and name   HN) 2.768 0.958 0.958 weight 1.000 ! spec=Expt_11, no=115, id=589, vol=2.888941e+08
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name   HB) 2.501 0.782 0.782 weight 1.000 ! spec=Expt_11, no=116, id=590, vol=5.310939e+08
assign (segid "   C" and resid   29 and name   HA) (segid "   C" and resid   29 and name   HB) 2.501 0.782 0.782 weight 1.000 ! spec=Expt_11, no=116, id=590, vol=5.310939e+08
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   18 and name  HG2) 2.573 0.827 3.427 weight 1.000 ! spec=Expt_11, no=122, id=594, vol=4.481261e+08
assign (segid "   C" and resid   30 and name  HB1) (segid "   C" and resid   18 and name  HG2) 2.573 0.827 3.427 weight 1.000 ! spec=Expt_11, no=122, id=594, vol=4.481261e+08
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   18 and name  HB2) 2.966 1.099 3.034 weight 1.000 ! spec=Expt_11, no=123, id=595, vol=1.910987e+08
assign (segid "   C" and resid   30 and name  HB1) (segid "   C" and resid   18 and name  HB2) 2.966 1.099 3.034 weight 1.000 ! spec=Expt_11, no=123, id=595, vol=1.910987e+08
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   30 and name  HB2) 2.276 0.648 0.648 weight 1.000 ! spec=Expt_11, no=128, id=600, vol=9.342767e+08
assign (segid "   C" and resid   30 and name  HB1) (segid "   C" and resid   30 and name  HB2) 2.276 0.648 0.648 weight 1.000 ! spec=Expt_11, no=128, id=600, vol=9.342767e+08
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   18 and name  HB2) 2.980 1.110 3.020 weight 1.000 ! spec=Expt_11, no=129, id=601, vol=1.857452e+08
assign (segid "   C" and resid   30 and name  HB2) (segid "   C" and resid   18 and name  HB2) 2.980 1.110 3.020 weight 1.000 ! spec=Expt_11, no=129, id=601, vol=1.857452e+08
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   31 and name   HG) 2.979 1.109 2.709 weight 1.000 ! spec=Expt_11, no=131, id=603, vol=1.861541e+08
assign (segid "   C" and resid   30 and name  HB2) (segid "   C" and resid   31 and name   HG) 2.979 1.109 2.709 weight 1.000 ! spec=Expt_11, no=131, id=603, vol=1.861541e+08
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   30 and name   HA) 2.622 0.860 0.860 weight 1.000 ! spec=Expt_11, no=132, id=604, vol=3.997775e+08
assign (segid "   C" and resid   30 and name  HB2) (segid "   C" and resid   30 and name   HA) 2.622 0.860 0.860 weight 1.000 ! spec=Expt_11, no=132, id=604, vol=3.997775e+08
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   21 and name  HA1) 2.906 1.056 3.094 weight 1.000 ! spec=Expt_11, no=135, id=607, vol=2.157410e+08
assign (segid "   C" and resid   31 and name   HA) (segid "   C" and resid   21 and name  HA1) 2.906 1.056 3.094 weight 1.000 ! spec=Expt_11, no=135, id=607, vol=2.157410e+08
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   30 and name  HB2) 3.062 1.172 2.938 weight 1.000 ! spec=Expt_11, no=136, id=608, vol=1.576226e+08
assign (segid "   C" and resid   31 and name   HA) (segid "   C" and resid   30 and name  HB2) 3.062 1.172 2.938 weight 1.000 ! spec=Expt_11, no=136, id=608, vol=1.576226e+08
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   34 and name  HB2) 2.431 0.739 3.569 weight 1.000 ! spec=Expt_11, no=137, id=609, vol=6.292223e+08
assign (segid "   C" and resid   31 and name   HA) (segid "   C" and resid   34 and name  HB2) 2.431 0.739 3.569 weight 1.000 ! spec=Expt_11, no=137, id=609, vol=6.292223e+08
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   34 and name  HB1) 2.377 0.706 0.706 weight 1.000 ! spec=Expt_11, no=138, id=610, vol=7.204508e+08
assign (segid "   C" and resid   31 and name   HA) (segid "   C" and resid   34 and name  HB1) 2.377 0.706 0.706 weight 1.000 ! spec=Expt_11, no=138, id=610, vol=7.204508e+08
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name  HB1) 2.206 0.608 0.608 weight 1.000 ! spec=Expt_11, no=139, id=611, vol=1.127237e+09
assign (segid "   C" and resid   31 and name   HA) (segid "   C" and resid   31 and name  HB1) 2.206 0.608 0.608 weight 1.000 ! spec=Expt_11, no=139, id=611, vol=1.127237e+09
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HD22) 2.239 0.627 3.761 weight 1.000 ! spec=Expt_11, no=140, id=612, vol=1.031805e+09
    or (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HD21)
    or (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HD23)
assign (segid "   C" and resid   31 and name   HA) (segid "   C" and resid   31 and name HD22) 2.239 0.627 3.761 weight 1.000 ! spec=Expt_11, no=140, id=612, vol=1.031805e+09
    or (segid "   C" and resid   31 and name   HA) (segid "   C" and resid   31 and name HD21)
    or (segid "   C" and resid   31 and name   HA) (segid "   C" and resid   31 and name HD23)
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name   HA) 2.532 0.802 0.802 weight 1.000 ! spec=Expt_11, no=141, id=613, vol=4.929378e+08
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   31 and name   HA) 2.532 0.802 0.802 weight 1.000 ! spec=Expt_11, no=141, id=613, vol=4.929378e+08
assign (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid   31 and name HD12) 2.255 0.636 3.745 weight 1.000 ! spec=Expt_11, no=143, id=615, vol=9.881016e+08
    or (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid   31 and name HD11)
    or (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid   31 and name HD13)
assign (segid "   C" and resid   31 and name  HB1) (segid "   C" and resid   31 and name HD12) 2.255 0.636 3.745 weight 1.000 ! spec=Expt_11, no=143, id=615, vol=9.881016e+08
    or (segid "   C" and resid   31 and name  HB1) (segid "   C" and resid   31 and name HD11)
    or (segid "   C" and resid   31 and name  HB1) (segid "   C" and resid   31 and name HD13)
assign (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid   31 and name   HN) 2.543 0.808 0.808 weight 1.000 ! spec=Expt_11, no=145, id=617, vol=4.805644e+08
assign (segid "   C" and resid   31 and name  HB1) (segid "   C" and resid   31 and name   HN) 2.543 0.808 0.808 weight 1.000 ! spec=Expt_11, no=145, id=617, vol=4.805644e+08
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   33 and name  HB2) 2.584 0.835 0.835 weight 1.000 ! spec=Expt_11, no=149, id=621, vol=4.363768e+08
assign (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   33 and name  HB2) 2.584 0.835 0.835 weight 1.000 ! spec=Expt_11, no=149, id=621, vol=4.363768e+08
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   33 and name  HB1) 2.512 0.789 0.789 weight 1.000 ! spec=Expt_11, no=150, id=622, vol=5.179079e+08
assign (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   33 and name  HB1) 2.512 0.789 0.789 weight 1.000 ! spec=Expt_11, no=150, id=622, vol=5.179079e+08
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   36 and name  HB2) 2.349 0.689 1.689 weight 1.000 ! spec=Expt_11, no=151, id=623, vol=7.746557e+08
assign (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   36 and name  HB2) 2.349 0.689 1.689 weight 1.000 ! spec=Expt_11, no=151, id=623, vol=7.746557e+08
assign (segid "   A" and resid   33 and name   HA) (segid "   C" and resid   24 and name HD12) 2.646 0.875 1.875 weight 1.000 ! spec=Expt_11, no=153, id=625, vol=3.786329e+08
    or (segid "   A" and resid   33 and name   HA) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   33 and name   HA) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   33 and name   HA) (segid "   A" and resid   24 and name HD12) 2.646 0.875 1.875 weight 1.000 ! spec=Expt_11, no=153, id=625, vol=3.786329e+08
    or (segid "   C" and resid   33 and name   HA) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   33 and name   HA) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name  HB1) 2.088 0.545 0.545 weight 1.000 ! spec=Expt_11, no=156, id=628, vol=1.566802e+09
assign (segid "   C" and resid   34 and name  HB2) (segid "   C" and resid   34 and name  HB1) 2.088 0.545 0.545 weight 1.000 ! spec=Expt_11, no=156, id=628, vol=1.566802e+09
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   38 and name HG22) 2.349 0.690 3.651 weight 1.000 ! spec=Expt_11, no=163, id=634, vol=7.731716e+08
    or (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   38 and name HG23)
assign (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   38 and name HG22) 2.349 0.690 3.651 weight 1.000 ! spec=Expt_11, no=163, id=634, vol=7.731716e+08
    or (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   38 and name HG21)
    or (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   38 and name HG23)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name   HA) 2.456 0.754 0.754 weight 1.000 ! spec=Expt_11, no=164, id=635, vol=5.922847e+08
assign (segid "   C" and resid   35 and name   HN) (segid "   C" and resid   35 and name   HA) 2.456 0.754 0.754 weight 1.000 ! spec=Expt_11, no=164, id=635, vol=5.922847e+08
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   35 and name   HA) 2.641 0.872 3.359 weight 1.000 ! spec=Expt_11, no=165, id=636, vol=3.831408e+08
assign (segid "   C" and resid   36 and name   HA) (segid "   C" and resid   35 and name   HA) 2.641 0.872 3.359 weight 1.000 ! spec=Expt_11, no=165, id=636, vol=3.831408e+08
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name  HB1) 2.211 0.611 0.611 weight 1.000 ! spec=Expt_11, no=166, id=637, vol=1.112351e+09
assign (segid "   C" and resid   36 and name   HA) (segid "   C" and resid   36 and name  HB1) 2.211 0.611 0.611 weight 1.000 ! spec=Expt_11, no=166, id=637, vol=1.112351e+09
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name  HG1) 2.503 0.783 1.783 weight 1.000 ! spec=Expt_11, no=168, id=639, vol=5.292249e+08
assign (segid "   C" and resid   36 and name   HA) (segid "   C" and resid   36 and name  HG1) 2.503 0.783 1.783 weight 1.000 ! spec=Expt_11, no=168, id=639, vol=5.292249e+08
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name HG22) 2.082 0.542 0.542 weight 1.000 ! spec=Expt_11, no=171, id=642, vol=1.596434e+09
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name HG23)
assign (segid "   C" and resid   38 and name   HA) (segid "   C" and resid   38 and name HG22) 2.082 0.542 0.542 weight 1.000 ! spec=Expt_11, no=171, id=642, vol=1.596434e+09
    or (segid "   C" and resid   38 and name   HA) (segid "   C" and resid   38 and name HG21)
    or (segid "   C" and resid   38 and name   HA) (segid "   C" and resid   38 and name HG23)
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name HG11) 2.371 0.702 3.629 weight 1.000 ! spec=Expt_11, no=173, id=644, vol=7.325118e+08
assign (segid "   C" and resid   38 and name   HA) (segid "   C" and resid   38 and name HG11) 2.371 0.702 3.629 weight 1.000 ! spec=Expt_11, no=173, id=644, vol=7.325118e+08
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   38 and name   HB) 2.043 0.522 0.522 weight 1.000 ! spec=Expt_11, no=179, id=650, vol=1.788726e+09
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   38 and name   HB)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   38 and name   HB)
assign (segid "   C" and resid   38 and name HG22) (segid "   C" and resid   38 and name   HB) 2.043 0.522 0.522 weight 1.000 ! spec=Expt_11, no=179, id=650, vol=1.788726e+09
    or (segid "   C" and resid   38 and name HG21) (segid "   C" and resid   38 and name   HB)
    or (segid "   C" and resid   38 and name HG23) (segid "   C" and resid   38 and name   HB)
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   39 and name   HA) 2.695 0.908 3.305 weight 1.000 ! spec=Expt_11, no=183, id=654, vol=3.391784e+08
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   39 and name   HA)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   39 and name   HA)
assign (segid "   C" and resid   38 and name HG22) (segid "   C" and resid   39 and name   HA) 2.695 0.908 3.305 weight 1.000 ! spec=Expt_11, no=183, id=654, vol=3.391784e+08
    or (segid "   C" and resid   38 and name HG21) (segid "   C" and resid   39 and name   HA)
    or (segid "   C" and resid   38 and name HG23) (segid "   C" and resid   39 and name   HA)
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   38 and name   HN) 2.498 0.780 3.502 weight 1.000 ! spec=Expt_11, no=184, id=655, vol=5.348323e+08
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   38 and name   HN)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   38 and name   HN)
assign (segid "   C" and resid   38 and name HG22) (segid "   C" and resid   38 and name   HN) 2.498 0.780 3.502 weight 1.000 ! spec=Expt_11, no=184, id=655, vol=5.348323e+08
    or (segid "   C" and resid   38 and name HG21) (segid "   C" and resid   38 and name   HN)
    or (segid "   C" and resid   38 and name HG23) (segid "   C" and resid   38 and name   HN)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name  HB2) 2.161 0.584 3.839 weight 1.000 ! spec=Expt_11, no=189, id=660, vol=1.275772e+09
assign (segid "   C" and resid   39 and name   HA) (segid "   C" and resid   39 and name  HB2) 2.161 0.584 3.839 weight 1.000 ! spec=Expt_11, no=189, id=660, vol=1.275772e+09
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name   HN) 2.529 0.799 0.799 weight 1.000 ! spec=Expt_11, no=191, id=662, vol=4.971974e+08
assign (segid "   C" and resid   39 and name  HB2) (segid "   C" and resid   39 and name   HN) 2.529 0.799 0.799 weight 1.000 ! spec=Expt_11, no=191, id=662, vol=4.971974e+08
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name  HB2) 2.154 0.580 0.580 weight 1.000 ! spec=Expt_11, no=194, id=665, vol=1.300171e+09
assign (segid "   C" and resid   41 and name   HA) (segid "   C" and resid   41 and name  HB2) 2.154 0.580 0.580 weight 1.000 ! spec=Expt_11, no=194, id=665, vol=1.300171e+09
assign (segid "   A" and resid   41 and name   HA) (segid "   C" and resid   22 and name HG22) 2.782 0.968 3.218 weight 1.000 ! spec=Expt_11, no=195, id=666, vol=2.803679e+08
    or (segid "   A" and resid   41 and name   HA) (segid "   C" and resid   22 and name HG21)
    or (segid "   A" and resid   41 and name   HA) (segid "   C" and resid   22 and name HG23)
assign (segid "   C" and resid   41 and name   HA) (segid "   A" and resid   22 and name HG22) 2.782 0.968 3.218 weight 1.000 ! spec=Expt_11, no=195, id=666, vol=2.803679e+08
    or (segid "   C" and resid   41 and name   HA) (segid "   A" and resid   22 and name HG21)
    or (segid "   C" and resid   41 and name   HA) (segid "   A" and resid   22 and name HG23)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HG21) 2.266 0.642 0.642 weight 1.000 ! spec=Expt_11, no=197, id=668, vol=9.591252e+08
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HG22)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HG23)
assign (segid "   C" and resid   42 and name   HA) (segid "   C" and resid   42 and name HG21) 2.266 0.642 0.642 weight 1.000 ! spec=Expt_11, no=197, id=668, vol=9.591252e+08
    or (segid "   C" and resid   42 and name   HA) (segid "   C" and resid   42 and name HG22)
    or (segid "   C" and resid   42 and name   HA) (segid "   C" and resid   42 and name HG23)
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HD2) 2.594 0.841 3.406 weight 1.000 ! spec=Expt_11, no=198, id=669, vol=4.270835e+08
assign (segid "   C" and resid   45 and name   HA) (segid "   C" and resid   45 and name  HD2) 2.594 0.841 3.406 weight 1.000 ! spec=Expt_11, no=198, id=669, vol=4.270835e+08
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HB2) 2.291 0.656 0.656 weight 1.000 ! spec=Expt_11, no=199, id=670, vol=8.983258e+08
assign (segid "   C" and resid   45 and name   HA) (segid "   C" and resid   45 and name  HB2) 2.291 0.656 0.656 weight 1.000 ! spec=Expt_11, no=199, id=670, vol=8.983258e+08
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HG2) 2.462 0.757 3.538 weight 1.000 ! spec=Expt_11, no=200, id=671, vol=5.843058e+08
assign (segid "   C" and resid   45 and name   HA) (segid "   C" and resid   45 and name  HG2) 2.462 0.757 3.538 weight 1.000 ! spec=Expt_11, no=200, id=671, vol=5.843058e+08
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name   HA) 2.275 0.647 0.647 weight 1.000 ! spec=Expt_11, no=206, id=677, vol=9.365124e+08
assign (segid "   C" and resid   47 and name  HB1) (segid "   C" and resid   47 and name   HA) 2.275 0.647 0.647 weight 1.000 ! spec=Expt_11, no=206, id=677, vol=9.365124e+08
assign (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   47 and name  HB1) 1.811 0.410 0.410 weight 1.000 ! spec=Expt_11, no=210, id=681, vol=3.690998e+09
assign (segid "   C" and resid   47 and name  HB2) (segid "   C" and resid   47 and name  HB1) 1.811 0.410 0.410 weight 1.000 ! spec=Expt_11, no=210, id=681, vol=3.690998e+09
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name   HA) 2.565 0.823 0.823 weight 1.000 ! spec=Expt_11, no=211, id=682, vol=4.561993e+08
    or (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   48 and name   HA)
    or (segid "   A" and resid   48 and name  HB3) (segid "   A" and resid   48 and name   HA)
assign (segid "   C" and resid   48 and name  HB2) (segid "   C" and resid   48 and name   HA) 2.565 0.823 0.823 weight 1.000 ! spec=Expt_11, no=211, id=682, vol=4.561993e+08
    or (segid "   C" and resid   48 and name  HB1) (segid "   C" and resid   48 and name   HA)
    or (segid "   C" and resid   48 and name  HB3) (segid "   C" and resid   48 and name   HA)
assign (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name  HB2) 2.146 0.576 0.576 weight 1.000 ! spec=Expt_11, no=215, id=685, vol=1.329568e+09
assign (segid "   C" and resid   27 and name  HB1) (segid "   C" and resid   27 and name  HB2) 2.146 0.576 0.576 weight 1.000 ! spec=Expt_11, no=215, id=685, vol=1.329568e+09
assign (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name   HA) 3.041 1.156 1.156 weight 1.000 ! spec=Expt_11, no=217, id=687, vol=1.645055e+08
assign (segid "   C" and resid   27 and name  HB2) (segid "   C" and resid   27 and name   HA) 3.041 1.156 1.156 weight 1.000 ! spec=Expt_11, no=217, id=687, vol=1.645055e+08
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   45 and name  HD2) 2.905 1.055 3.095 weight 1.000 ! spec=Expt_11, no=223, id=693, vol=2.162698e+08
assign (segid "   C" and resid   44 and name  HB2) (segid "   C" and resid   45 and name  HD2) 2.905 1.055 3.095 weight 1.000 ! spec=Expt_11, no=223, id=693, vol=2.162698e+08
assign (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid    8 and name  HB1) 3.246 1.317 2.754 weight 1.000 ! spec=Expt_11, no=225, id=695, vol=1.111939e+08
assign (segid "   C" and resid   17 and name  HG2) (segid "   C" and resid    8 and name  HB1) 3.246 1.317 2.754 weight 1.000 ! spec=Expt_11, no=225, id=695, vol=1.111939e+08
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   36 and name  HG2) 1.793 0.402 0.402 weight 1.000 ! spec=Expt_11, no=230, id=699, vol=3.909518e+09
assign (segid "   C" and resid   36 and name  HG1) (segid "   C" and resid   36 and name  HG2) 1.793 0.402 0.402 weight 1.000 ! spec=Expt_11, no=230, id=699, vol=3.909518e+09
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   36 and name  HE2) 2.733 0.934 0.934 weight 1.000 ! spec=Expt_11, no=231, id=700, vol=3.117497e+08
assign (segid "   C" and resid   36 and name  HG1) (segid "   C" and resid   36 and name  HE2) 2.733 0.934 0.934 weight 1.000 ! spec=Expt_11, no=231, id=700, vol=3.117497e+08
assign (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   22 and name HG12) 1.974 0.487 0.487 weight 1.000 ! spec=Expt_11, no=234, id=702, vol=2.194989e+09
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   22 and name HG12)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   22 and name HG12)
assign (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   22 and name HG12) 1.974 0.487 0.487 weight 1.000 ! spec=Expt_11, no=234, id=702, vol=2.194989e+09
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   22 and name HG12)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   22 and name HG12)
assign (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   22 and name   HN) 2.837 1.006 1.006 weight 1.000 ! spec=Expt_11, no=239, id=707, vol=2.493320e+08
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   22 and name   HN)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   22 and name   HN)
assign (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   22 and name   HN) 2.837 1.006 1.006 weight 1.000 ! spec=Expt_11, no=239, id=707, vol=2.493320e+08
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   22 and name   HN)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   22 and name   HN)
assign (segid "   A" and resid   27 and name  HG1) (segid "   A" and resid   27 and name  HB2) 2.789 0.972 0.972 weight 1.000 ! spec=Expt_11, no=241, id=709, vol=2.761762e+08
assign (segid "   C" and resid   27 and name  HG1) (segid "   C" and resid   27 and name  HB2) 2.789 0.972 0.972 weight 1.000 ! spec=Expt_11, no=241, id=709, vol=2.761762e+08
assign (segid "   A" and resid   27 and name  HG1) (segid "   A" and resid   27 and name   HA) 2.784 0.969 3.216 weight 1.000 ! spec=Expt_11, no=243, id=711, vol=2.792516e+08
assign (segid "   C" and resid   27 and name  HG1) (segid "   C" and resid   27 and name   HA) 2.784 0.969 3.216 weight 1.000 ! spec=Expt_11, no=243, id=711, vol=2.792516e+08
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name HG11) 1.986 0.493 0.493 weight 1.000 ! spec=Expt_11, no=246, id=714, vol=2.116434e+09
assign (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   29 and name HG11) 1.986 0.493 0.493 weight 1.000 ! spec=Expt_11, no=246, id=714, vol=2.116434e+09
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name   HA) 2.789 0.972 0.972 weight 1.000 ! spec=Expt_11, no=247, id=715, vol=2.762616e+08
assign (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   29 and name   HA) 2.789 0.972 0.972 weight 1.000 ! spec=Expt_11, no=247, id=715, vol=2.762616e+08
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name   HN) 3.006 1.129 1.129 weight 1.000 ! spec=Expt_11, no=248, id=716, vol=1.762920e+08
assign (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   29 and name   HN) 3.006 1.129 1.129 weight 1.000 ! spec=Expt_11, no=248, id=716, vol=1.762920e+08
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   36 and name  HD2) 2.076 0.539 3.924 weight 1.000 ! spec=Expt_11, no=252, id=720, vol=1.625898e+09
assign (segid "   C" and resid   36 and name  HE2) (segid "   C" and resid   36 and name  HD2) 2.076 0.539 3.924 weight 1.000 ! spec=Expt_11, no=252, id=720, vol=1.625898e+09
assign (segid "   A" and resid   36 and name  HE2) (segid "   C" and resid   24 and name HD12) 2.812 0.989 3.188 weight 1.000 ! spec=Expt_11, no=253, id=721, vol=2.628050e+08
    or (segid "   A" and resid   36 and name  HE2) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   36 and name  HE2) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   36 and name  HE2) (segid "   A" and resid   24 and name HD12) 2.812 0.989 3.188 weight 1.000 ! spec=Expt_11, no=253, id=721, vol=2.628050e+08
    or (segid "   C" and resid   36 and name  HE2) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   36 and name  HE2) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   36 and name  HE2) 2.842 1.010 3.158 weight 1.000 ! spec=Expt_11, no=255, id=723, vol=2.467477e+08
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   36 and name  HE2)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   36 and name  HE2)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   36 and name  HE2) 2.842 1.010 3.158 weight 1.000 ! spec=Expt_11, no=255, id=723, vol=2.467477e+08
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   36 and name  HE2)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   36 and name  HE2)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   37 and name   HA) 2.774 0.962 1.962 weight 1.000 ! spec=Expt_11, no=256, id=724, vol=2.856233e+08
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   37 and name   HA)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   37 and name   HA)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   37 and name   HA) 2.774 0.962 1.962 weight 1.000 ! spec=Expt_11, no=256, id=724, vol=2.856233e+08
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   37 and name   HA)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   37 and name   HA)
assign (segid "   A" and resid   34 and name   HA) (segid "   C" and resid   37 and name   HB) 2.333 0.680 3.667 weight 1.000 ! spec=Expt_11, no=261, id=729, vol=8.060288e+08
assign (segid "   C" and resid   34 and name   HA) (segid "   A" and resid   37 and name   HB) 2.333 0.680 3.667 weight 1.000 ! spec=Expt_11, no=261, id=729, vol=8.060288e+08
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG22) 2.144 0.575 0.575 weight 1.000 ! spec=Expt_11, no=263, id=731, vol=1.338902e+09
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG23)
assign (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   37 and name HG22) 2.144 0.575 0.575 weight 1.000 ! spec=Expt_11, no=263, id=731, vol=1.338902e+09
    or (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   37 and name HG21)
    or (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   37 and name HG23)
assign (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   18 and name  HB2) 2.730 0.932 0.932 weight 1.000 ! spec=Expt_11, no=267, id=735, vol=3.139357e+08
assign (segid "   C" and resid   18 and name  HG2) (segid "   C" and resid   18 and name  HB2) 2.730 0.932 0.932 weight 1.000 ! spec=Expt_11, no=267, id=735, vol=3.139357e+08
assign (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid   18 and name  HB1) 2.151 0.578 0.578 weight 1.000 ! spec=Expt_11, no=269, id=737, vol=1.314361e+09
assign (segid "   C" and resid   18 and name  HB2) (segid "   C" and resid   18 and name  HB1) 2.151 0.578 0.578 weight 1.000 ! spec=Expt_11, no=269, id=737, vol=1.314361e+09
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HG12) 1.984 0.492 0.492 weight 1.000 ! spec=Expt_11, no=273, id=741, vol=2.130933e+09
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HG13)
assign (segid "   C" and resid   37 and name   HA) (segid "   C" and resid   37 and name HG12) 1.984 0.492 0.492 weight 1.000 ! spec=Expt_11, no=273, id=741, vol=2.130933e+09
    or (segid "   C" and resid   37 and name   HA) (segid "   C" and resid   37 and name HG11)
    or (segid "   C" and resid   37 and name   HA) (segid "   C" and resid   37 and name HG13)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   40 and name   HB) 2.949 1.087 1.087 weight 1.000 ! spec=Expt_11, no=274, id=742, vol=1.976296e+08
assign (segid "   C" and resid   37 and name   HA) (segid "   C" and resid   40 and name   HB) 2.949 1.087 1.087 weight 1.000 ! spec=Expt_11, no=274, id=742, vol=1.976296e+08
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   33 and name  HB1) 2.482 0.770 0.770 weight 1.000 ! spec=Expt_11, no=278, id=746, vol=5.560854e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   33 and name  HB1)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   33 and name  HB1)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   33 and name  HB1) 2.482 0.770 0.770 weight 1.000 ! spec=Expt_11, no=278, id=746, vol=5.560854e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   33 and name  HB1)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   33 and name  HB1)
assign (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   29 and name HG22) 2.490 0.775 0.775 weight 1.000 ! spec=Expt_11, no=279, id=747, vol=5.452769e+08
    or (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   33 and name  HB2) (segid "   C" and resid   29 and name HG22) 2.490 0.775 0.775 weight 1.000 ! spec=Expt_11, no=279, id=747, vol=5.452769e+08
    or (segid "   C" and resid   33 and name  HB2) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   33 and name  HB2) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name   HN) 2.925 1.069 1.069 weight 1.000 ! spec=Expt_11, no=282, id=750, vol=2.077969e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name   HN)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   29 and name   HN) 2.925 1.069 1.069 weight 1.000 ! spec=Expt_11, no=282, id=750, vol=2.077969e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   29 and name   HN)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   29 and name   HN)
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   33 and name  HB2) 2.135 0.570 0.570 weight 1.000 ! spec=Expt_11, no=284, id=752, vol=1.372318e+09
assign (segid "   C" and resid   33 and name  HB1) (segid "   C" and resid   33 and name  HB2) 2.135 0.570 0.570 weight 1.000 ! spec=Expt_11, no=284, id=752, vol=1.372318e+09
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   13 and name HG22) 2.803 0.982 0.982 weight 1.000 ! spec=Expt_11, no=286, id=754, vol=2.683298e+08
    or (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   13 and name HG23)
assign (segid "   C" and resid   33 and name  HB1) (segid "   C" and resid   13 and name HG22) 2.803 0.982 0.982 weight 1.000 ! spec=Expt_11, no=286, id=754, vol=2.683298e+08
    or (segid "   C" and resid   33 and name  HB1) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   33 and name  HB1) (segid "   C" and resid   13 and name HG23)
assign (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   13 and name HG12) 2.152 0.579 0.579 weight 1.000 ! spec=Expt_11, no=290, id=757, vol=1.307752e+09
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   13 and name HG12)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   13 and name HG12)
assign (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   13 and name HG12) 2.152 0.579 0.579 weight 1.000 ! spec=Expt_11, no=290, id=757, vol=1.307752e+09
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   13 and name HG12)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   13 and name HG12)
assign (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   33 and name  HB2) 2.648 0.877 2.877 weight 1.000 ! spec=Expt_11, no=291, id=758, vol=3.770227e+08
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   33 and name  HB2)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   33 and name  HB2)
assign (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   33 and name  HB2) 2.648 0.877 2.877 weight 1.000 ! spec=Expt_11, no=291, id=758, vol=3.770227e+08
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   33 and name  HB2)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   33 and name  HB2)
assign (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   29 and name   HA) 2.930 1.073 1.073 weight 1.000 ! spec=Expt_11, no=293, id=760, vol=2.054887e+08
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   29 and name   HA)
assign (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   29 and name   HA) 2.930 1.073 1.073 weight 1.000 ! spec=Expt_11, no=293, id=760, vol=2.054887e+08
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   29 and name   HA)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   29 and name   HA)
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid    8 and name   HA) 2.634 0.867 3.366 weight 1.000 ! spec=Expt_11, no=298, id=764, vol=3.896289e+08
assign (segid "   C" and resid   19 and name  HB1) (segid "   C" and resid    8 and name   HA) 2.634 0.867 3.366 weight 1.000 ! spec=Expt_11, no=298, id=764, vol=3.896289e+08
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name   HB) 2.553 0.815 0.815 weight 1.000 ! spec=Expt_11, no=299, id=765, vol=4.697456e+08
assign (segid "   C" and resid   37 and name   HA) (segid "   C" and resid   37 and name   HB) 2.553 0.815 0.815 weight 1.000 ! spec=Expt_11, no=299, id=765, vol=4.697456e+08
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name   HB) 2.499 0.781 0.781 weight 1.000 ! spec=Expt_11, no=301, id=767, vol=5.334492e+08
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   37 and name   HB) 2.499 0.781 0.781 weight 1.000 ! spec=Expt_11, no=301, id=767, vol=5.334492e+08
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   12 and name   HB) 2.021 0.511 0.511 weight 1.000 ! spec=Expt_11, no=304, id=769, vol=1.908073e+09
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   12 and name   HB)
assign (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   12 and name   HB) 2.021 0.511 0.511 weight 1.000 ! spec=Expt_11, no=304, id=769, vol=1.908073e+09
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   12 and name   HB)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   12 and name   HB)
assign (segid "   A" and resid   42 and name HG21) (segid "   A" and resid   42 and name   HB) 1.835 0.421 0.421 weight 1.000 ! spec=Expt_11, no=305, id=770, vol=3.400852e+09
    or (segid "   A" and resid   42 and name HG22) (segid "   A" and resid   42 and name   HB)
    or (segid "   A" and resid   42 and name HG23) (segid "   A" and resid   42 and name   HB)
assign (segid "   C" and resid   42 and name HG21) (segid "   C" and resid   42 and name   HB) 1.835 0.421 0.421 weight 1.000 ! spec=Expt_11, no=305, id=770, vol=3.400852e+09
    or (segid "   C" and resid   42 and name HG22) (segid "   C" and resid   42 and name   HB)
    or (segid "   C" and resid   42 and name HG23) (segid "   C" and resid   42 and name   HB)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   12 and name HG12) 2.543 0.809 1.809 weight 1.000 ! spec=Expt_11, no=306, id=771, vol=4.801797e+08
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   12 and name HG13)
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   12 and name HG12) 2.543 0.809 1.809 weight 1.000 ! spec=Expt_11, no=306, id=771, vol=4.801797e+08
    or (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   12 and name HG11)
    or (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   12 and name HG13)
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name  HB2) 2.219 0.615 0.615 weight 1.000 ! spec=Expt_11, no=309, id=773, vol=1.090201e+09
assign (segid "   C" and resid   34 and name  HG1) (segid "   C" and resid   34 and name  HB2) 2.219 0.615 0.615 weight 1.000 ! spec=Expt_11, no=309, id=773, vol=1.090201e+09
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HG1) 2.604 0.848 3.396 weight 1.000 ! spec=Expt_11, no=310, id=774, vol=4.167965e+08
assign (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   34 and name  HG1) 2.604 0.848 3.396 weight 1.000 ! spec=Expt_11, no=310, id=774, vol=4.167965e+08
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name   HN) 2.947 1.085 3.053 weight 1.000 ! spec=Expt_11, no=311, id=775, vol=1.985725e+08
assign (segid "   C" and resid   34 and name  HG1) (segid "   C" and resid   34 and name   HN) 2.947 1.085 3.053 weight 1.000 ! spec=Expt_11, no=311, id=775, vol=1.985725e+08
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   37 and name   HB) 1.994 0.497 0.497 weight 1.000 ! spec=Expt_11, no=317, id=781, vol=2.070827e+09
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HB)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   37 and name   HB)
assign (segid "   C" and resid   37 and name HG22) (segid "   C" and resid   37 and name   HB) 1.994 0.497 0.497 weight 1.000 ! spec=Expt_11, no=317, id=781, vol=2.070827e+09
    or (segid "   C" and resid   37 and name HG21) (segid "   C" and resid   37 and name   HB)
    or (segid "   C" and resid   37 and name HG23) (segid "   C" and resid   37 and name   HB)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   38 and name   HA) 2.705 0.915 0.915 weight 1.000 ! spec=Expt_11, no=319, id=783, vol=3.317600e+08
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   38 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   38 and name   HA)
assign (segid "   C" and resid   37 and name HG22) (segid "   C" and resid   38 and name   HA) 2.705 0.915 0.915 weight 1.000 ! spec=Expt_11, no=319, id=783, vol=3.317600e+08
    or (segid "   C" and resid   37 and name HG21) (segid "   C" and resid   38 and name   HA)
    or (segid "   C" and resid   37 and name HG23) (segid "   C" and resid   38 and name   HA)
assign (segid "   A" and resid   31 and name   HG) (segid "   A" and resid   31 and name   HA) 2.749 0.945 0.945 weight 1.000 ! spec=Expt_11, no=322, id=786, vol=3.013580e+08
assign (segid "   C" and resid   31 and name   HG) (segid "   C" and resid   31 and name   HA) 2.749 0.945 0.945 weight 1.000 ! spec=Expt_11, no=322, id=786, vol=3.013580e+08
assign (segid "   A" and resid   31 and name   HG) (segid "   A" and resid   31 and name   HN) 2.764 0.955 0.955 weight 1.000 ! spec=Expt_11, no=323, id=787, vol=2.913601e+08
assign (segid "   C" and resid   31 and name   HG) (segid "   C" and resid   31 and name   HN) 2.764 0.955 0.955 weight 1.000 ! spec=Expt_11, no=323, id=787, vol=2.913601e+08
assign (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HG12) 2.686 0.902 0.902 weight 1.000 ! spec=Expt_11, no=327, id=789, vol=3.460238e+08
assign (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HG12) 2.686 0.902 0.902 weight 1.000 ! spec=Expt_11, no=327, id=789, vol=3.460238e+08
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid    9 and name  HB2) 2.163 0.585 0.585 weight 1.000 ! spec=Expt_11, no=330, id=792, vol=1.268845e+09
assign (segid "   C" and resid    9 and name  HB1) (segid "   C" and resid    9 and name  HB2) 2.163 0.585 0.585 weight 1.000 ! spec=Expt_11, no=330, id=792, vol=1.268845e+09
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name   HA) 2.235 0.624 0.624 weight 1.000 ! spec=Expt_11, no=332, id=794, vol=1.043245e+09
assign (segid "   C" and resid    7 and name  HB1) (segid "   C" and resid    7 and name   HA) 2.235 0.624 0.624 weight 1.000 ! spec=Expt_11, no=332, id=794, vol=1.043245e+09
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name   HA) 2.841 1.009 1.009 weight 1.000 ! spec=Expt_11, no=333, id=795, vol=2.471250e+08
assign (segid "   C" and resid    8 and name   HN) (segid "   C" and resid    7 and name   HA) 2.841 1.009 1.009 weight 1.000 ! spec=Expt_11, no=333, id=795, vol=2.471250e+08
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name   HN) 2.569 0.825 0.825 weight 1.000 ! spec=Expt_11, no=337, id=799, vol=4.518386e+08
assign (segid "   C" and resid   36 and name  HB1) (segid "   C" and resid   36 and name   HN) 2.569 0.825 0.825 weight 1.000 ! spec=Expt_11, no=337, id=799, vol=4.518386e+08
assign (segid "   A" and resid   36 and name  HB1) (segid "   C" and resid   24 and name HD12) 2.442 0.746 0.746 weight 1.000 ! spec=Expt_11, no=339, id=801, vol=6.124530e+08
    or (segid "   A" and resid   36 and name  HB1) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   36 and name  HB1) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   36 and name  HB1) (segid "   A" and resid   24 and name HD12) 2.442 0.746 0.746 weight 1.000 ! spec=Expt_11, no=339, id=801, vol=6.124530e+08
    or (segid "   C" and resid   36 and name  HB1) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   36 and name  HB1) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   18 and name  HG1) 2.067 0.534 0.534 weight 1.000 ! spec=Expt_11, no=341, id=803, vol=1.664751e+09
assign (segid "   C" and resid   18 and name  HG2) (segid "   C" and resid   18 and name  HG1) 2.067 0.534 0.534 weight 1.000 ! spec=Expt_11, no=341, id=803, vol=1.664751e+09
assign (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid   18 and name  HG1) 2.745 0.942 0.942 weight 1.000 ! spec=Expt_11, no=342, id=804, vol=3.035786e+08
assign (segid "   C" and resid   18 and name  HB2) (segid "   C" and resid   18 and name  HG1) 2.745 0.942 0.942 weight 1.000 ! spec=Expt_11, no=342, id=804, vol=3.035786e+08
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name   HA) 2.805 0.984 0.984 weight 1.000 ! spec=Expt_11, no=350, id=810, vol=2.667664e+08
assign (segid "   C" and resid   35 and name  HG2) (segid "   C" and resid   35 and name   HA) 2.805 0.984 0.984 weight 1.000 ! spec=Expt_11, no=350, id=810, vol=2.667664e+08
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name  HD2) 2.784 0.969 3.216 weight 1.000 ! spec=Expt_11, no=355, id=814, vol=2.794300e+08
assign (segid "   C" and resid   20 and name   HA) (segid "   C" and resid   20 and name  HD2) 2.784 0.969 3.216 weight 1.000 ! spec=Expt_11, no=355, id=814, vol=2.794300e+08
assign (segid "   A" and resid   29 and name HD12) (segid "   A" and resid   34 and name  HG1) 2.736 0.936 3.264 weight 1.000 ! spec=Expt_11, no=356, id=815, vol=3.099773e+08
    or (segid "   A" and resid   29 and name HD11) (segid "   A" and resid   34 and name  HG1)
    or (segid "   A" and resid   29 and name HD13) (segid "   A" and resid   34 and name  HG1)
assign (segid "   C" and resid   29 and name HD12) (segid "   C" and resid   34 and name  HG1) 2.736 0.936 3.264 weight 1.000 ! spec=Expt_11, no=356, id=815, vol=3.099773e+08
    or (segid "   C" and resid   29 and name HD11) (segid "   C" and resid   34 and name  HG1)
    or (segid "   C" and resid   29 and name HD13) (segid "   C" and resid   34 and name  HG1)
assign (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   37 and name   HB) 2.769 0.958 3.231 weight 1.000 ! spec=Expt_11, no=357, id=816, vol=2.884987e+08
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   37 and name   HB)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   37 and name   HB)
assign (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   37 and name   HB) 2.769 0.958 3.231 weight 1.000 ! spec=Expt_11, no=357, id=816, vol=2.884987e+08
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   37 and name   HB)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   37 and name   HB)
assign (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   29 and name   HA) 2.876 1.034 1.034 weight 1.000 ! spec=Expt_11, no=362, id=821, vol=2.299018e+08
assign (segid "   C" and resid   29 and name HG11) (segid "   C" and resid   29 and name   HA) 2.876 1.034 1.034 weight 1.000 ! spec=Expt_11, no=362, id=821, vol=2.299018e+08
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name   HA) 2.685 0.901 0.901 weight 1.000 ! spec=Expt_11, no=364, id=823, vol=3.471304e+08
assign (segid "   C" and resid   34 and name  HG2) (segid "   C" and resid   34 and name   HA) 2.685 0.901 0.901 weight 1.000 ! spec=Expt_11, no=364, id=823, vol=3.471304e+08
assign (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   40 and name HG21) 1.896 0.449 0.449 weight 1.000 ! spec=Expt_11, no=368, id=826, vol=2.801078e+09
    or (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   40 and name HG23)
assign (segid "   C" and resid   40 and name   HB) (segid "   C" and resid   40 and name HG21) 1.896 0.449 0.449 weight 1.000 ! spec=Expt_11, no=368, id=826, vol=2.801078e+09
    or (segid "   C" and resid   40 and name   HB) (segid "   C" and resid   40 and name HG22)
    or (segid "   C" and resid   40 and name   HB) (segid "   C" and resid   40 and name HG23)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   36 and name  HB1) 2.445 0.747 0.747 weight 1.000 ! spec=Expt_11, no=372, id=829, vol=6.084929e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   36 and name  HB1)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   36 and name  HB1)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   36 and name  HB1) 2.445 0.747 0.747 weight 1.000 ! spec=Expt_11, no=372, id=829, vol=6.084929e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   36 and name  HB1)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   36 and name  HB1)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   37 and name   HA) 2.674 0.894 3.326 weight 1.000 ! spec=Expt_11, no=375, id=831, vol=3.554394e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   37 and name   HA)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   37 and name   HA)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   37 and name   HA) 2.674 0.894 3.326 weight 1.000 ! spec=Expt_11, no=375, id=831, vol=3.554394e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   37 and name   HA)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   37 and name   HA)
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   31 and name HD22) 2.158 0.582 3.842 weight 1.000 ! spec=Expt_11, no=376, id=832, vol=1.286177e+09
    or (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   31 and name HD21)
    or (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   31 and name HD23)
assign (segid "   C" and resid   20 and name  HB2) (segid "   C" and resid   31 and name HD22) 2.158 0.582 3.842 weight 1.000 ! spec=Expt_11, no=376, id=832, vol=1.286177e+09
    or (segid "   C" and resid   20 and name  HB2) (segid "   C" and resid   31 and name HD21)
    or (segid "   C" and resid   20 and name  HB2) (segid "   C" and resid   31 and name HD23)
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   31 and name   HA) 2.353 0.692 3.647 weight 1.000 ! spec=Expt_11, no=378, id=834, vol=7.655773e+08
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   31 and name   HA)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   31 and name   HA)
assign (segid "   C" and resid   31 and name HD12) (segid "   C" and resid   31 and name   HA) 2.353 0.692 3.647 weight 1.000 ! spec=Expt_11, no=378, id=834, vol=7.655773e+08
    or (segid "   C" and resid   31 and name HD11) (segid "   C" and resid   31 and name   HA)
    or (segid "   C" and resid   31 and name HD13) (segid "   C" and resid   31 and name   HA)
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   27 and name  HD2) 2.403 0.722 3.597 weight 1.000 ! spec=Expt_11, no=379, id=835, vol=6.746307e+08
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   27 and name  HD2)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   27 and name  HD2)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   27 and name  HD2) 2.403 0.722 3.597 weight 1.000 ! spec=Expt_11, no=379, id=835, vol=6.746307e+08
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   27 and name  HD2)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   27 and name  HD2)
assign (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HG22) 2.054 0.527 0.527 weight 1.000 ! spec=Expt_11, no=380, id=836, vol=1.730674e+09
    or (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HG23)
assign (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HG22) 2.054 0.527 0.527 weight 1.000 ! spec=Expt_11, no=380, id=836, vol=1.730674e+09
    or (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HG23)
assign (segid "   A" and resid   13 and name HG22) (segid "   A" and resid   13 and name   HA) 2.205 0.608 0.608 weight 1.000 ! spec=Expt_11, no=381, id=837, vol=1.131772e+09
    or (segid "   A" and resid   13 and name HG21) (segid "   A" and resid   13 and name   HA)
    or (segid "   A" and resid   13 and name HG23) (segid "   A" and resid   13 and name   HA)
assign (segid "   C" and resid   13 and name HG22) (segid "   C" and resid   13 and name   HA) 2.205 0.608 0.608 weight 1.000 ! spec=Expt_11, no=381, id=837, vol=1.131772e+09
    or (segid "   C" and resid   13 and name HG21) (segid "   C" and resid   13 and name   HA)
    or (segid "   C" and resid   13 and name HG23) (segid "   C" and resid   13 and name   HA)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HG22) 2.651 0.879 0.879 weight 1.000 ! spec=Expt_11, no=382, id=838, vol=3.744131e+08
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HG23)
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HG22) 2.651 0.879 0.879 weight 1.000 ! spec=Expt_11, no=382, id=838, vol=3.744131e+08
    or (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HG23)
assign (segid "   A" and resid   13 and name HG22) (segid "   A" and resid   13 and name   HN) 2.806 0.984 0.984 weight 1.000 ! spec=Expt_11, no=383, id=839, vol=2.665985e+08
    or (segid "   A" and resid   13 and name HG21) (segid "   A" and resid   13 and name   HN)
    or (segid "   A" and resid   13 and name HG23) (segid "   A" and resid   13 and name   HN)
assign (segid "   C" and resid   13 and name HG22) (segid "   C" and resid   13 and name   HN) 2.806 0.984 0.984 weight 1.000 ! spec=Expt_11, no=383, id=839, vol=2.665985e+08
    or (segid "   C" and resid   13 and name HG21) (segid "   C" and resid   13 and name   HN)
    or (segid "   C" and resid   13 and name HG23) (segid "   C" and resid   13 and name   HN)
assign (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   22 and name   HA) 2.336 0.682 3.664 weight 1.000 ! spec=Expt_11, no=388, id=844, vol=7.998637e+08
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   22 and name   HA)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   22 and name   HA)
assign (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   22 and name   HA) 2.336 0.682 3.664 weight 1.000 ! spec=Expt_11, no=388, id=844, vol=7.998637e+08
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   22 and name   HA)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   22 and name   HA)
assign (segid "   A" and resid   22 and name HG11) (segid "   A" and resid   22 and name   HB) 2.706 0.916 0.916 weight 1.000 ! spec=Expt_11, no=390, id=846, vol=3.308363e+08
assign (segid "   C" and resid   22 and name HG11) (segid "   C" and resid   22 and name   HB) 2.706 0.916 0.916 weight 1.000 ! spec=Expt_11, no=390, id=846, vol=3.308363e+08
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   35 and name   HN) 2.782 0.968 0.968 weight 1.000 ! spec=Expt_11, no=394, id=849, vol=2.803099e+08
assign (segid "   C" and resid   34 and name  HB1) (segid "   C" and resid   35 and name   HN) 2.782 0.968 0.968 weight 1.000 ! spec=Expt_11, no=394, id=849, vol=2.803099e+08
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   17 and name   HA) 2.822 0.996 0.996 weight 1.000 ! spec=Expt_11, no=396, id=851, vol=2.573197e+08
assign (segid "   C" and resid   17 and name  HG1) (segid "   C" and resid   17 and name   HA) 2.822 0.996 0.996 weight 1.000 ! spec=Expt_11, no=396, id=851, vol=2.573197e+08
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   17 and name   HN) 3.028 1.146 1.146 weight 1.000 ! spec=Expt_11, no=397, id=852, vol=1.687906e+08
assign (segid "   C" and resid   17 and name  HG1) (segid "   C" and resid   17 and name   HN) 3.028 1.146 1.146 weight 1.000 ! spec=Expt_11, no=397, id=852, vol=1.687906e+08
assign (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name HD12) 2.005 0.502 0.502 weight 1.000 ! spec=Expt_11, no=399, id=854, vol=2.002993e+09
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name HD11)
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name HD13)
assign (segid "   C" and resid   38 and name HG11) (segid "   C" and resid   38 and name HD12) 2.005 0.502 0.502 weight 1.000 ! spec=Expt_11, no=399, id=854, vol=2.002993e+09
    or (segid "   C" and resid   38 and name HG11) (segid "   C" and resid   38 and name HD11)
    or (segid "   C" and resid   38 and name HG11) (segid "   C" and resid   38 and name HD13)
assign (segid "   A" and resid   38 and name HD12) (segid "   A" and resid   38 and name HG12) 2.013 0.506 0.506 weight 1.000 ! spec=Expt_11, no=400, id=855, vol=1.955865e+09
    or (segid "   A" and resid   38 and name HD11) (segid "   A" and resid   38 and name HG12)
    or (segid "   A" and resid   38 and name HD13) (segid "   A" and resid   38 and name HG12)
assign (segid "   C" and resid   38 and name HD12) (segid "   C" and resid   38 and name HG12) 2.013 0.506 0.506 weight 1.000 ! spec=Expt_11, no=400, id=855, vol=1.955865e+09
    or (segid "   C" and resid   38 and name HD11) (segid "   C" and resid   38 and name HG12)
    or (segid "   C" and resid   38 and name HD13) (segid "   C" and resid   38 and name HG12)
assign (segid "   A" and resid   38 and name HD12) (segid "   C" and resid   38 and name   HA) 2.426 0.736 3.574 weight 1.000 ! spec=Expt_11, no=401, id=856, vol=6.378478e+08
    or (segid "   A" and resid   38 and name HD11) (segid "   C" and resid   38 and name   HA)
    or (segid "   A" and resid   38 and name HD13) (segid "   C" and resid   38 and name   HA)
assign (segid "   C" and resid   38 and name HD12) (segid "   A" and resid   38 and name   HA) 2.426 0.736 3.574 weight 1.000 ! spec=Expt_11, no=401, id=856, vol=6.378478e+08
    or (segid "   C" and resid   38 and name HD11) (segid "   A" and resid   38 and name   HA)
    or (segid "   C" and resid   38 and name HD13) (segid "   A" and resid   38 and name   HA)
assign (segid "   A" and resid   38 and name HD12) (segid "   A" and resid   35 and name   HA) 2.247 0.631 3.753 weight 1.000 ! spec=Expt_11, no=402, id=857, vol=1.009095e+09
    or (segid "   A" and resid   38 and name HD11) (segid "   A" and resid   35 and name   HA)
    or (segid "   A" and resid   38 and name HD13) (segid "   A" and resid   35 and name   HA)
assign (segid "   C" and resid   38 and name HD12) (segid "   C" and resid   35 and name   HA) 2.247 0.631 3.753 weight 1.000 ! spec=Expt_11, no=402, id=857, vol=1.009095e+09
    or (segid "   C" and resid   38 and name HD11) (segid "   C" and resid   35 and name   HA)
    or (segid "   C" and resid   38 and name HD13) (segid "   C" and resid   35 and name   HA)
assign (segid "   A" and resid   38 and name HD12) (segid "   A" and resid   38 and name   HN) 2.577 0.830 3.423 weight 1.000 ! spec=Expt_11, no=403, id=858, vol=4.435707e+08
    or (segid "   A" and resid   38 and name HD11) (segid "   A" and resid   38 and name   HN)
    or (segid "   A" and resid   38 and name HD13) (segid "   A" and resid   38 and name   HN)
assign (segid "   C" and resid   38 and name HD12) (segid "   C" and resid   38 and name   HN) 2.577 0.830 3.423 weight 1.000 ! spec=Expt_11, no=403, id=858, vol=4.435707e+08
    or (segid "   C" and resid   38 and name HD11) (segid "   C" and resid   38 and name   HN)
    or (segid "   C" and resid   38 and name HD13) (segid "   C" and resid   38 and name   HN)
assign (segid "   A" and resid   45 and name  HD2) (segid "   A" and resid   45 and name  HG2) 2.218 0.615 0.615 weight 1.000 ! spec=Expt_11, no=404, id=859, vol=1.091309e+09
assign (segid "   C" and resid   45 and name  HD2) (segid "   C" and resid   45 and name  HG2) 2.218 0.615 0.615 weight 1.000 ! spec=Expt_11, no=404, id=859, vol=1.091309e+09
assign (segid "   A" and resid   22 and name HG22) (segid "   C" and resid   40 and name HG21) 2.211 0.611 3.789 weight 1.000 ! spec=Expt_11, no=406, id=861, vol=1.112913e+09
    or (segid "   A" and resid   22 and name HG22) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   22 and name HG22) (segid "   C" and resid   40 and name HG23)
    or (segid "   A" and resid   22 and name HG21) (segid "   C" and resid   40 and name HG21)
    or (segid "   A" and resid   22 and name HG21) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   22 and name HG21) (segid "   C" and resid   40 and name HG23)
    or (segid "   A" and resid   22 and name HG23) (segid "   C" and resid   40 and name HG21)
    or (segid "   A" and resid   22 and name HG23) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   22 and name HG23) (segid "   C" and resid   40 and name HG23)
assign (segid "   C" and resid   22 and name HG22) (segid "   A" and resid   40 and name HG21) 2.211 0.611 3.789 weight 1.000 ! spec=Expt_11, no=406, id=861, vol=1.112913e+09
    or (segid "   C" and resid   22 and name HG22) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   22 and name HG22) (segid "   A" and resid   40 and name HG23)
    or (segid "   C" and resid   22 and name HG21) (segid "   A" and resid   40 and name HG21)
    or (segid "   C" and resid   22 and name HG21) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   22 and name HG21) (segid "   A" and resid   40 and name HG23)
    or (segid "   C" and resid   22 and name HG23) (segid "   A" and resid   40 and name HG21)
    or (segid "   C" and resid   22 and name HG23) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   22 and name HG23) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name   HB) 2.099 0.551 0.551 weight 1.000 ! spec=Expt_11, no=407, id=862, vol=1.518659e+09
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name   HB)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name   HB)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   22 and name   HB) 2.099 0.551 0.551 weight 1.000 ! spec=Expt_11, no=407, id=862, vol=1.518659e+09
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   22 and name   HB)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   22 and name   HB)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name   HA) 2.208 0.610 2.610 weight 1.000 ! spec=Expt_11, no=408, id=863, vol=1.121444e+09
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name   HA)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name   HA)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   22 and name   HA) 2.208 0.610 2.610 weight 1.000 ! spec=Expt_11, no=408, id=863, vol=1.121444e+09
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   22 and name   HA)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   22 and name   HA)
assign (segid "   A" and resid   22 and name HG22) (segid "   C" and resid   41 and name   HA) 2.848 1.014 3.152 weight 1.000 ! spec=Expt_11, no=409, id=864, vol=2.438152e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   C" and resid   41 and name   HA)
    or (segid "   A" and resid   22 and name HG23) (segid "   C" and resid   41 and name   HA)
assign (segid "   C" and resid   22 and name HG22) (segid "   A" and resid   41 and name   HA) 2.848 1.014 3.152 weight 1.000 ! spec=Expt_11, no=409, id=864, vol=2.438152e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   A" and resid   41 and name   HA)
    or (segid "   C" and resid   22 and name HG23) (segid "   A" and resid   41 and name   HA)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   31 and name   HA) 2.805 0.984 0.984 weight 1.000 ! spec=Expt_11, no=410, id=865, vol=2.669030e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   31 and name   HA)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   31 and name   HA)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   31 and name   HA) 2.805 0.984 0.984 weight 1.000 ! spec=Expt_11, no=410, id=865, vol=2.669030e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   31 and name   HA)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   31 and name   HA)
assign (segid "   A" and resid   22 and name HG22) (segid "   C" and resid   41 and name  HB2) 2.933 1.075 1.075 weight 1.000 ! spec=Expt_11, no=411, id=866, vol=2.042612e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   C" and resid   41 and name  HB2)
    or (segid "   A" and resid   22 and name HG23) (segid "   C" and resid   41 and name  HB2)
assign (segid "   C" and resid   22 and name HG22) (segid "   A" and resid   41 and name  HB2) 2.933 1.075 1.075 weight 1.000 ! spec=Expt_11, no=411, id=866, vol=2.042612e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   A" and resid   41 and name  HB2)
    or (segid "   C" and resid   22 and name HG23) (segid "   A" and resid   41 and name  HB2)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HG22) 2.750 0.946 0.946 weight 1.000 ! spec=Expt_11, no=413, id=868, vol=3.003654e+08
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HG21)
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HG23)
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name HG22) 2.750 0.946 0.946 weight 1.000 ! spec=Expt_11, no=413, id=868, vol=3.003654e+08
    or (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name HG21)
    or (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   22 and name HG23)
assign (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name HD12) 2.300 0.661 0.661 weight 1.000 ! spec=Expt_11, no=414, id=869, vol=8.772290e+08
    or (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name HD11)
    or (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name HD13)
assign (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name HD12) 2.300 0.661 0.661 weight 1.000 ! spec=Expt_11, no=414, id=869, vol=8.772290e+08
    or (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name HD11)
    or (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name HD13)
assign (segid "   A" and resid   35 and name  HD2) (segid "   A" and resid   35 and name   HA) 2.539 0.806 3.461 weight 1.000 ! spec=Expt_11, no=415, id=870, vol=4.853657e+08
assign (segid "   C" and resid   35 and name  HD2) (segid "   C" and resid   35 and name   HA) 2.539 0.806 3.461 weight 1.000 ! spec=Expt_11, no=415, id=870, vol=4.853657e+08
assign (segid "   A" and resid   35 and name  HD2) (segid "   A" and resid   35 and name  HG1) 2.219 0.615 0.615 weight 1.000 ! spec=Expt_11, no=418, id=873, vol=1.090173e+09
assign (segid "   C" and resid   35 and name  HD2) (segid "   C" and resid   35 and name  HG1) 2.219 0.615 0.615 weight 1.000 ! spec=Expt_11, no=418, id=873, vol=1.090173e+09
assign (segid "   A" and resid   18 and name  HD2) (segid "   A" and resid   18 and name  HB2) 2.678 0.896 1.896 weight 1.000 ! spec=Expt_11, no=420, id=875, vol=3.526036e+08
assign (segid "   C" and resid   18 and name  HD2) (segid "   C" and resid   18 and name  HB2) 2.678 0.896 1.896 weight 1.000 ! spec=Expt_11, no=420, id=875, vol=3.526036e+08
assign (segid "   A" and resid   18 and name  HD2) (segid "   A" and resid   11 and name  HB1) 3.025 1.144 2.975 weight 1.000 ! spec=Expt_11, no=422, id=877, vol=1.695548e+08
assign (segid "   C" and resid   18 and name  HD2) (segid "   C" and resid   11 and name  HB1) 3.025 1.144 2.975 weight 1.000 ! spec=Expt_11, no=422, id=877, vol=1.695548e+08
assign (segid "   A" and resid   45 and name  HD1) (segid "   A" and resid   44 and name   HA) 2.000 0.500 4.000 weight 1.000 ! spec=Expt_11, no=427, id=882, vol=2.030037e+09
assign (segid "   C" and resid   45 and name  HD1) (segid "   C" and resid   44 and name   HA) 2.000 0.500 4.000 weight 1.000 ! spec=Expt_11, no=427, id=882, vol=2.030037e+09
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   44 and name   HA) 2.642 0.873 0.873 weight 1.000 ! spec=Expt_11, no=428, id=883, vol=3.822848e+08
assign (segid "   C" and resid   44 and name  HB2) (segid "   C" and resid   44 and name   HA) 2.642 0.873 0.873 weight 1.000 ! spec=Expt_11, no=428, id=883, vol=3.822848e+08
assign (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name  HB1) 2.430 0.738 0.738 weight 1.000 ! spec=Expt_11, no=429, id=884, vol=6.315873e+08
assign (segid "   C" and resid   44 and name   HA) (segid "   C" and resid   44 and name  HB1) 2.430 0.738 0.738 weight 1.000 ! spec=Expt_11, no=429, id=884, vol=6.315873e+08
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   45 and name  HD2) 2.810 0.987 3.190 weight 1.000 ! spec=Expt_11, no=433, id=887, vol=2.639610e+08
assign (segid "   C" and resid   45 and name  HB2) (segid "   C" and resid   45 and name  HD2) 2.810 0.987 3.190 weight 1.000 ! spec=Expt_11, no=433, id=887, vol=2.639610e+08
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   28 and name  HB2) 2.480 0.769 3.520 weight 1.000 ! spec=Expt_11, no=441, id=894, vol=5.587859e+08
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   28 and name  HB2)
assign (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   28 and name  HB2) 2.480 0.769 3.520 weight 1.000 ! spec=Expt_11, no=441, id=894, vol=5.587859e+08
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   28 and name  HB2)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   28 and name  HB2)
assign (segid "   A" and resid    5 and name   HB) (segid "   A" and resid    5 and name HG22) 2.259 0.638 0.638 weight 1.000 ! spec=Expt_11, no=442, id=895, vol=9.785359e+08
    or (segid "   A" and resid    5 and name   HB) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    5 and name   HB) (segid "   A" and resid    5 and name HG23)
assign (segid "   C" and resid    5 and name   HB) (segid "   C" and resid    5 and name HG22) 2.259 0.638 0.638 weight 1.000 ! spec=Expt_11, no=442, id=895, vol=9.785359e+08
    or (segid "   C" and resid    5 and name   HB) (segid "   C" and resid    5 and name HG21)
    or (segid "   C" and resid    5 and name   HB) (segid "   C" and resid    5 and name HG23)
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name   HA) 2.423 0.734 0.734 weight 1.000 ! spec=Expt_11, no=444, id=897, vol=6.428458e+08
assign (segid "   C" and resid    9 and name  HB2) (segid "   C" and resid    9 and name   HA) 2.423 0.734 0.734 weight 1.000 ! spec=Expt_11, no=444, id=897, vol=6.428458e+08
assign (segid "   A" and resid   13 and name HG12) (segid "   A" and resid   13 and name   HA) 2.771 0.960 0.960 weight 1.000 ! spec=Expt_11, no=452, id=903, vol=2.869753e+08
assign (segid "   C" and resid   13 and name HG12) (segid "   C" and resid   13 and name   HA) 2.771 0.960 0.960 weight 1.000 ! spec=Expt_11, no=452, id=903, vol=2.869753e+08
assign (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name   HA) 2.709 0.917 0.917 weight 1.000 ! spec=Expt_11, no=454, id=904, vol=3.287826e+08
assign (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name   HA) 2.709 0.917 0.917 weight 1.000 ! spec=Expt_11, no=454, id=904, vol=3.287826e+08
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name   HB) 2.423 0.734 0.734 weight 1.000 ! spec=Expt_11, no=455, id=905, vol=6.421878e+08
assign (segid "   C" and resid   26 and name   HA) (segid "   C" and resid   26 and name   HB) 2.423 0.734 0.734 weight 1.000 ! spec=Expt_11, no=455, id=905, vol=6.421878e+08
assign (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HG11) 2.769 0.959 0.959 weight 1.000 ! spec=Expt_11, no=461, id=909, vol=2.883504e+08
assign (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HG11) 2.769 0.959 0.959 weight 1.000 ! spec=Expt_11, no=461, id=909, vol=2.883504e+08
assign (segid "   A" and resid   13 and name HG11) (segid "   A" and resid   13 and name   HA) 2.765 0.955 3.235 weight 1.000 ! spec=Expt_11, no=462, id=910, vol=2.912479e+08
assign (segid "   C" and resid   13 and name HG11) (segid "   C" and resid   13 and name   HA) 2.765 0.955 3.235 weight 1.000 ! spec=Expt_11, no=462, id=910, vol=2.912479e+08
assign (segid "   A" and resid   13 and name HG11) (segid "   A" and resid   13 and name   HN) 2.996 1.122 1.122 weight 1.000 ! spec=Expt_11, no=463, id=911, vol=1.799428e+08
assign (segid "   C" and resid   13 and name HG11) (segid "   C" and resid   13 and name   HN) 2.996 1.122 1.122 weight 1.000 ! spec=Expt_11, no=463, id=911, vol=1.799428e+08
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name  HB2) 2.229 0.621 0.621 weight 1.000 ! spec=Expt_11, no=464, id=912, vol=1.061429e+09
assign (segid "   C" and resid   15 and name   HA) (segid "   C" and resid   15 and name  HB2) 2.229 0.621 0.621 weight 1.000 ! spec=Expt_11, no=464, id=912, vol=1.061429e+09
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HB2) 2.697 0.909 1.909 weight 1.000 ! spec=Expt_11, no=465, id=913, vol=3.378279e+08
assign (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   15 and name  HB2) 2.697 0.909 1.909 weight 1.000 ! spec=Expt_11, no=465, id=913, vol=3.378279e+08
assign (segid "   A" and resid   16 and name  HG1) (segid "   A" and resid   18 and name  HD2) 2.411 0.727 3.589 weight 1.000 ! spec=Expt_11, no=469, id=917, vol=6.612213e+08
assign (segid "   C" and resid   16 and name  HG1) (segid "   C" and resid   18 and name  HD2) 2.411 0.727 3.589 weight 1.000 ! spec=Expt_11, no=469, id=917, vol=6.612213e+08
assign (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   20 and name  HD2) 2.059 0.530 3.941 weight 1.000 ! spec=Expt_11, no=475, id=923, vol=1.705444e+09
assign (segid "   C" and resid   20 and name  HG2) (segid "   C" and resid   20 and name  HD2) 2.059 0.530 3.941 weight 1.000 ! spec=Expt_11, no=475, id=923, vol=1.705444e+09
assign (segid "   A" and resid   20 and name  HD2) (segid "   A" and resid   31 and name HD22) 2.419 0.732 3.581 weight 1.000 ! spec=Expt_11, no=476, id=924, vol=6.485306e+08
    or (segid "   A" and resid   20 and name  HD2) (segid "   A" and resid   31 and name HD21)
    or (segid "   A" and resid   20 and name  HD2) (segid "   A" and resid   31 and name HD23)
assign (segid "   C" and resid   20 and name  HD2) (segid "   C" and resid   31 and name HD22) 2.419 0.732 3.581 weight 1.000 ! spec=Expt_11, no=476, id=924, vol=6.485306e+08
    or (segid "   C" and resid   20 and name  HD2) (segid "   C" and resid   31 and name HD21)
    or (segid "   C" and resid   20 and name  HD2) (segid "   C" and resid   31 and name HD23)
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   24 and name  HB2) 3.037 1.153 2.653 weight 1.000 ! spec=Expt_11, no=479, id=927, vol=1.657694e+08
assign (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   24 and name  HB2) 3.037 1.153 2.653 weight 1.000 ! spec=Expt_11, no=479, id=927, vol=1.657694e+08
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   36 and name  HE2) 2.813 0.989 3.187 weight 1.000 ! spec=Expt_11, no=480, id=928, vol=2.625585e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   36 and name  HE2)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   36 and name  HE2)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   36 and name  HE2) 2.813 0.989 3.187 weight 1.000 ! spec=Expt_11, no=480, id=928, vol=2.625585e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   36 and name  HE2)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   36 and name  HE2)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   37 and name   HN) 3.079 1.185 2.185 weight 1.000 ! spec=Expt_11, no=481, id=929, vol=1.524771e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   37 and name   HN)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   37 and name   HN)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   37 and name   HN) 3.079 1.185 2.185 weight 1.000 ! spec=Expt_11, no=481, id=929, vol=1.524771e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   37 and name   HN)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   37 and name   HN)
assign (segid "   A" and resid   24 and name   HG) (segid "   A" and resid   24 and name   HA) 2.910 1.058 1.058 weight 1.000 ! spec=Expt_11, no=482, id=930, vol=2.143157e+08
assign (segid "   C" and resid   24 and name   HG) (segid "   C" and resid   24 and name   HA) 2.910 1.058 1.058 weight 1.000 ! spec=Expt_11, no=482, id=930, vol=2.143157e+08
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   11 and name  HB2) 3.015 1.136 2.985 weight 1.000 ! spec=Expt_11, no=483, id=931, vol=1.731317e+08
assign (segid "   C" and resid   14 and name   HA) (segid "   C" and resid   11 and name  HB2) 3.015 1.136 2.985 weight 1.000 ! spec=Expt_11, no=483, id=931, vol=1.731317e+08
assign (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   27 and name   HA) 2.448 0.749 3.552 weight 1.000 ! spec=Expt_11, no=486, id=934, vol=6.035036e+08
assign (segid "   C" and resid   27 and name  HD2) (segid "   C" and resid   27 and name   HA) 2.448 0.749 3.552 weight 1.000 ! spec=Expt_11, no=486, id=934, vol=6.035036e+08
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HB1) 2.511 0.788 0.788 weight 1.000 ! spec=Expt_11, no=487, id=935, vol=5.191270e+08
assign (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   34 and name  HB1) 2.511 0.788 0.788 weight 1.000 ! spec=Expt_11, no=487, id=935, vol=5.191270e+08
assign (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   27 and name  HB2) 2.707 0.916 0.916 weight 1.000 ! spec=Expt_11, no=488, id=936, vol=3.306294e+08
assign (segid "   C" and resid   27 and name  HG2) (segid "   C" and resid   27 and name  HB2) 2.707 0.916 0.916 weight 1.000 ! spec=Expt_11, no=488, id=936, vol=3.306294e+08
assign (segid "   A" and resid   27 and name  HG2) (segid "   C" and resid   13 and name   HA) 2.795 0.976 0.976 weight 1.000 ! spec=Expt_11, no=490, id=937, vol=2.729592e+08
assign (segid "   C" and resid   27 and name  HG2) (segid "   A" and resid   13 and name   HA) 2.795 0.976 0.976 weight 1.000 ! spec=Expt_11, no=490, id=937, vol=2.729592e+08
assign (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   27 and name   HA) 2.922 1.067 1.567 weight 1.000 ! spec=Expt_11, no=491, id=938, vol=2.089233e+08
assign (segid "   C" and resid   27 and name  HG2) (segid "   C" and resid   27 and name   HA) 2.922 1.067 1.567 weight 1.000 ! spec=Expt_11, no=491, id=938, vol=2.089233e+08
assign (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   28 and name  HB1) 2.135 0.570 0.570 weight 1.000 ! spec=Expt_11, no=495, id=942, vol=1.374492e+09
assign (segid "   C" and resid   28 and name  HB2) (segid "   C" and resid   28 and name  HB1) 2.135 0.570 0.570 weight 1.000 ! spec=Expt_11, no=495, id=942, vol=1.374492e+09
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   30 and name  HB1) 2.781 0.967 3.219 weight 1.000 ! spec=Expt_11, no=499, id=946, vol=2.812470e+08
assign (segid "   C" and resid   29 and name   HA) (segid "   C" and resid   30 and name  HB1) 2.781 0.967 3.219 weight 1.000 ! spec=Expt_11, no=499, id=946, vol=2.812470e+08
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name HD12) 2.970 1.102 3.030 weight 1.000 ! spec=Expt_11, no=500, id=947, vol=1.895123e+08
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name HD11)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   29 and name HD13)
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name HD12) 2.970 1.102 3.030 weight 1.000 ! spec=Expt_11, no=500, id=947, vol=1.895123e+08
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name HD11)
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   29 and name HD13)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name HD12) 2.835 1.004 2.004 weight 1.000 ! spec=Expt_11, no=505, id=952, vol=2.506103e+08
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name HD11)
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name HD13)
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   31 and name HD12) 2.835 1.004 2.004 weight 1.000 ! spec=Expt_11, no=505, id=952, vol=2.506103e+08
    or (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   31 and name HD11)
    or (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   31 and name HD13)
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name  HB2) 2.374 0.705 0.705 weight 1.000 ! spec=Expt_11, no=512, id=959, vol=7.254318e+08
assign (segid "   C" and resid   34 and name  HG2) (segid "   C" and resid   34 and name  HB2) 2.374 0.705 0.705 weight 1.000 ! spec=Expt_11, no=512, id=959, vol=7.254318e+08
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   35 and name   HA) 2.637 0.869 3.363 weight 1.000 ! spec=Expt_11, no=513, id=960, vol=3.870527e+08
assign (segid "   C" and resid   35 and name  HG1) (segid "   C" and resid   35 and name   HA) 2.637 0.869 3.363 weight 1.000 ! spec=Expt_11, no=513, id=960, vol=3.870527e+08
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   35 and name   HN) 2.841 1.009 1.009 weight 1.000 ! spec=Expt_11, no=514, id=961, vol=2.473669e+08
assign (segid "   C" and resid   35 and name  HG1) (segid "   C" and resid   35 and name   HN) 2.841 1.009 1.009 weight 1.000 ! spec=Expt_11, no=514, id=961, vol=2.473669e+08
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   33 and name   HA) 2.517 0.792 3.483 weight 1.000 ! spec=Expt_11, no=515, id=962, vol=5.118218e+08
assign (segid "   C" and resid   36 and name  HB1) (segid "   C" and resid   33 and name   HA) 2.517 0.792 3.483 weight 1.000 ! spec=Expt_11, no=515, id=962, vol=5.118218e+08
assign (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   37 and name   HB) 2.082 0.542 0.542 weight 1.000 ! spec=Expt_11, no=521, id=968, vol=1.596232e+09
    or (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   37 and name   HB)
    or (segid "   A" and resid   37 and name HG13) (segid "   A" and resid   37 and name   HB)
assign (segid "   C" and resid   37 and name HG12) (segid "   C" and resid   37 and name   HB) 2.082 0.542 0.542 weight 1.000 ! spec=Expt_11, no=521, id=968, vol=1.596232e+09
    or (segid "   C" and resid   37 and name HG11) (segid "   C" and resid   37 and name   HB)
    or (segid "   C" and resid   37 and name HG13) (segid "   C" and resid   37 and name   HB)
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   44 and name  HB2) 1.888 0.445 0.445 weight 1.000 ! spec=Expt_11, no=532, id=979, vol=2.873521e+09
assign (segid "   C" and resid   44 and name  HB1) (segid "   C" and resid   44 and name  HB2) 1.888 0.445 0.445 weight 1.000 ! spec=Expt_11, no=532, id=979, vol=2.873521e+09
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   45 and name  HB2) 1.968 0.484 0.484 weight 1.000 ! spec=Expt_11, no=534, id=981, vol=2.235762e+09
assign (segid "   C" and resid   45 and name  HB1) (segid "   C" and resid   45 and name  HB2) 1.968 0.484 0.484 weight 1.000 ! spec=Expt_11, no=534, id=981, vol=2.235762e+09
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name HG12) 2.405 0.723 0.723 weight 1.000 ! spec=Expt_11, no=535, id=982, vol=6.713045e+08
    or (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name HG11)
    or (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name HG13)
assign (segid "   C" and resid    5 and name   HA) (segid "   C" and resid    5 and name HG12) 2.405 0.723 0.723 weight 1.000 ! spec=Expt_11, no=535, id=982, vol=6.713045e+08
    or (segid "   C" and resid    5 and name   HA) (segid "   C" and resid    5 and name HG11)
    or (segid "   C" and resid    5 and name   HA) (segid "   C" and resid    5 and name HG13)
assign (segid "   A" and resid    5 and name   HB) (segid "   A" and resid    5 and name HG12) 2.282 0.651 0.651 weight 1.000 ! spec=Expt_11, no=536, id=983, vol=9.198347e+08
    or (segid "   A" and resid    5 and name   HB) (segid "   A" and resid    5 and name HG11)
    or (segid "   A" and resid    5 and name   HB) (segid "   A" and resid    5 and name HG13)
assign (segid "   C" and resid    5 and name   HB) (segid "   C" and resid    5 and name HG12) 2.282 0.651 0.651 weight 1.000 ! spec=Expt_11, no=536, id=983, vol=9.198347e+08
    or (segid "   C" and resid    5 and name   HB) (segid "   C" and resid    5 and name HG11)
    or (segid "   C" and resid    5 and name   HB) (segid "   C" and resid    5 and name HG13)
assign (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name   HA) 2.872 1.031 1.031 weight 1.000 ! spec=Expt_11, no=552, id=999, vol=2.317381e+08
assign (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name   HA) 2.872 1.031 1.031 weight 1.000 ! spec=Expt_11, no=552, id=999, vol=2.317381e+08
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name HG12) 2.067 0.534 1.534 weight 1.000 ! spec=Expt_11, no=553, id=1000, vol=1.667989e+09
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name HG13)
assign (segid "   C" and resid   12 and name   HA) (segid "   C" and resid   12 and name HG12) 2.067 0.534 1.534 weight 1.000 ! spec=Expt_11, no=553, id=1000, vol=1.667989e+09
    or (segid "   C" and resid   12 and name   HA) (segid "   C" and resid   12 and name HG11)
    or (segid "   C" and resid   12 and name   HA) (segid "   C" and resid   12 and name HG13)
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   10 and name HG21) 3.261 1.329 2.739 weight 1.000 ! spec=Expt_11, no=556, id=1003, vol=1.081242e+08
    or (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   10 and name HG21) 3.261 1.329 2.739 weight 1.000 ! spec=Expt_11, no=556, id=1003, vol=1.081242e+08
    or (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid    1 and name  HG2) (segid "   A" and resid    1 and name  HB2) 4.994 3.117 3.117 weight 1.000 ! spec=Expt_11, no=560, id=1005, vol=8.383387e+06
assign (segid "   C" and resid    1 and name  HG2) (segid "   C" and resid    1 and name  HB2) 4.994 3.117 3.117 weight 1.000 ! spec=Expt_11, no=560, id=1005, vol=8.383387e+06
assign (segid "   A" and resid    1 and name  HG1) (segid "   A" and resid    1 and name  HB2) 4.790 2.868 2.868 weight 1.000 ! spec=Expt_11, no=561, id=1006, vol=1.076336e+07
assign (segid "   C" and resid    1 and name  HG1) (segid "   C" and resid    1 and name  HB2) 4.790 2.868 2.868 weight 1.000 ! spec=Expt_11, no=561, id=1006, vol=1.076336e+07
assign (segid "   A" and resid    1 and name  HG1) (segid "   A" and resid    1 and name  HB1) 3.325 1.382 1.382 weight 1.000 ! spec=Expt_11, no=562, id=1007, vol=9.628798e+07
assign (segid "   C" and resid    1 and name  HG1) (segid "   C" and resid    1 and name  HB1) 3.325 1.382 1.382 weight 1.000 ! spec=Expt_11, no=562, id=1007, vol=9.628798e+07
assign (segid "   A" and resid    2 and name   HA) (segid "   A" and resid    2 and name  HB2) 2.601 0.846 0.846 weight 1.000 ! spec=Expt_11, no=565, id=1008, vol=4.198958e+08
assign (segid "   C" and resid    2 and name   HA) (segid "   C" and resid    2 and name  HB2) 2.601 0.846 0.846 weight 1.000 ! spec=Expt_11, no=565, id=1008, vol=4.198958e+08
assign (segid "   A" and resid    3 and name   HA) (segid "   A" and resid    3 and name  HG1) 2.675 0.894 0.894 weight 1.000 ! spec=Expt_11, no=567, id=1010, vol=3.549878e+08
assign (segid "   C" and resid    3 and name   HA) (segid "   C" and resid    3 and name  HG1) 2.675 0.894 0.894 weight 1.000 ! spec=Expt_11, no=567, id=1010, vol=3.549878e+08
assign (segid "   A" and resid    3 and name   HA) (segid "   A" and resid    3 and name  HG2) 2.794 0.976 0.976 weight 1.000 ! spec=Expt_11, no=568, id=1011, vol=2.731369e+08
assign (segid "   C" and resid    3 and name   HA) (segid "   C" and resid    3 and name  HG2) 2.794 0.976 0.976 weight 1.000 ! spec=Expt_11, no=568, id=1011, vol=2.731369e+08
assign (segid "   A" and resid    3 and name   HA) (segid "   A" and resid    3 and name  HB1) 2.690 0.905 0.905 weight 1.000 ! spec=Expt_11, no=569, id=1012, vol=3.430792e+08
assign (segid "   C" and resid    3 and name   HA) (segid "   C" and resid    3 and name  HB1) 2.690 0.905 0.905 weight 1.000 ! spec=Expt_11, no=569, id=1012, vol=3.430792e+08
assign (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    5 and name HG12) 3.044 1.158 2.956 weight 1.000 ! spec=Expt_11, no=574, id=1017, vol=1.635386e+08
    or (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    5 and name HG11)
    or (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    5 and name HG13)
assign (segid "   C" and resid    4 and name   HA) (segid "   C" and resid    5 and name HG12) 3.044 1.158 2.956 weight 1.000 ! spec=Expt_11, no=574, id=1017, vol=1.635386e+08
    or (segid "   C" and resid    4 and name   HA) (segid "   C" and resid    5 and name HG11)
    or (segid "   C" and resid    4 and name   HA) (segid "   C" and resid    5 and name HG13)
assign (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    5 and name HG22) 3.024 1.143 2.976 weight 1.000 ! spec=Expt_11, no=575, id=1018, vol=1.699624e+08
    or (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    5 and name HG23)
assign (segid "   C" and resid    4 and name   HA) (segid "   C" and resid    5 and name HG22) 3.024 1.143 2.976 weight 1.000 ! spec=Expt_11, no=575, id=1018, vol=1.699624e+08
    or (segid "   C" and resid    4 and name   HA) (segid "   C" and resid    5 and name HG21)
    or (segid "   C" and resid    4 and name   HA) (segid "   C" and resid    5 and name HG23)
assign (segid "   A" and resid    4 and name   HB) (segid "   A" and resid    4 and name HG21) 1.857 0.431 0.431 weight 1.000 ! spec=Expt_11, no=576, id=1019, vol=3.169700e+09
    or (segid "   A" and resid    4 and name   HB) (segid "   A" and resid    4 and name HG22)
    or (segid "   A" and resid    4 and name   HB) (segid "   A" and resid    4 and name HG23)
assign (segid "   C" and resid    4 and name   HB) (segid "   C" and resid    4 and name HG21) 1.857 0.431 0.431 weight 1.000 ! spec=Expt_11, no=576, id=1019, vol=3.169700e+09
    or (segid "   C" and resid    4 and name   HB) (segid "   C" and resid    4 and name HG22)
    or (segid "   C" and resid    4 and name   HB) (segid "   C" and resid    4 and name HG23)
assign (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    4 and name HG21) 1.857 0.431 0.431 weight 1.000 ! spec=Expt_11, no=577, id=1020, vol=3.169700e+09
    or (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    4 and name HG22)
    or (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    4 and name HG23)
assign (segid "   C" and resid    4 and name   HA) (segid "   C" and resid    4 and name HG21) 1.857 0.431 0.431 weight 1.000 ! spec=Expt_11, no=577, id=1020, vol=3.169700e+09
    or (segid "   C" and resid    4 and name   HA) (segid "   C" and resid    4 and name HG22)
    or (segid "   C" and resid    4 and name   HA) (segid "   C" and resid    4 and name HG23)
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name   HN) 3.637 1.654 1.654 weight 1.000 ! spec=Expt_11, no=578, id=1021, vol=5.612577e+07
assign (segid "   C" and resid    5 and name   HA) (segid "   C" and resid    5 and name   HN) 3.637 1.654 1.654 weight 1.000 ! spec=Expt_11, no=578, id=1021, vol=5.612577e+07
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name   HB) 2.477 0.767 0.767 weight 1.000 ! spec=Expt_11, no=581, id=1024, vol=5.629688e+08
assign (segid "   C" and resid    5 and name   HA) (segid "   C" and resid    5 and name   HB) 2.477 0.767 0.767 weight 1.000 ! spec=Expt_11, no=581, id=1024, vol=5.629688e+08
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG12) 3.417 1.459 1.459 weight 1.000 ! spec=Expt_11, no=583, id=1026, vol=8.172753e+07
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG11)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG13)
assign (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    5 and name HG12) 3.417 1.459 1.459 weight 1.000 ! spec=Expt_11, no=583, id=1026, vol=8.172753e+07
    or (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    5 and name HG11)
    or (segid "   C" and resid    5 and name   HN) (segid "   C" and resid    5 and name HG13)
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name  HG1) 2.576 0.830 3.424 weight 1.000 ! spec=Expt_11, no=584, id=1027, vol=4.447163e+08
assign (segid "   C" and resid    6 and name   HA) (segid "   C" and resid    6 and name  HG1) 2.576 0.830 3.424 weight 1.000 ! spec=Expt_11, no=584, id=1027, vol=4.447163e+08
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name  HD2) 2.365 0.699 3.635 weight 1.000 ! spec=Expt_11, no=585, id=1028, vol=7.438492e+08
assign (segid "   C" and resid    6 and name   HA) (segid "   C" and resid    6 and name  HD2) 2.365 0.699 3.635 weight 1.000 ! spec=Expt_11, no=585, id=1028, vol=7.438492e+08
assign (segid "   A" and resid    6 and name  HB2) (segid "   A" and resid    6 and name   HA) 2.310 0.667 0.667 weight 1.000 ! spec=Expt_11, no=586, id=1029, vol=8.559403e+08
assign (segid "   C" and resid    6 and name  HB2) (segid "   C" and resid    6 and name   HA) 2.310 0.667 0.667 weight 1.000 ! spec=Expt_11, no=586, id=1029, vol=8.559403e+08
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name  HE2) 3.828 1.832 1.832 weight 1.000 ! spec=Expt_11, no=587, id=1030, vol=4.129572e+07
assign (segid "   C" and resid    6 and name   HA) (segid "   C" and resid    6 and name  HE2) 3.828 1.832 1.832 weight 1.000 ! spec=Expt_11, no=587, id=1030, vol=4.129572e+07
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name   HN) 2.956 1.092 1.092 weight 1.000 ! spec=Expt_11, no=588, id=1031, vol=1.949103e+08
assign (segid "   C" and resid    6 and name   HA) (segid "   C" and resid    6 and name   HN) 2.956 1.092 1.092 weight 1.000 ! spec=Expt_11, no=588, id=1031, vol=1.949103e+08
assign (segid "   A" and resid    6 and name  HG1) (segid "   A" and resid    6 and name  HE2) 3.191 1.273 1.273 weight 1.000 ! spec=Expt_11, no=594, id=1037, vol=1.231093e+08
assign (segid "   C" and resid    6 and name  HG1) (segid "   C" and resid    6 and name  HE2) 3.191 1.273 1.273 weight 1.000 ! spec=Expt_11, no=594, id=1037, vol=1.231093e+08
assign (segid "   A" and resid    6 and name  HG2) (segid "   A" and resid    6 and name  HE2) 2.808 0.986 0.986 weight 1.000 ! spec=Expt_11, no=595, id=1038, vol=2.649609e+08
assign (segid "   C" and resid    6 and name  HG2) (segid "   C" and resid    6 and name  HE2) 2.808 0.986 0.986 weight 1.000 ! spec=Expt_11, no=595, id=1038, vol=2.649609e+08
assign (segid "   A" and resid    6 and name  HG2) (segid "   A" and resid    6 and name  HD2) 1.840 0.423 4.160 weight 1.000 ! spec=Expt_11, no=596, id=1039, vol=3.352953e+09
assign (segid "   C" and resid    6 and name  HG2) (segid "   C" and resid    6 and name  HD2) 1.840 0.423 4.160 weight 1.000 ! spec=Expt_11, no=596, id=1039, vol=3.352953e+09
assign (segid "   A" and resid    6 and name  HB2) (segid "   A" and resid    6 and name  HG1) 2.395 0.717 0.717 weight 1.000 ! spec=Expt_11, no=598, id=1041, vol=6.887023e+08
assign (segid "   C" and resid    6 and name  HB2) (segid "   C" and resid    6 and name  HG1) 2.395 0.717 0.717 weight 1.000 ! spec=Expt_11, no=598, id=1041, vol=6.887023e+08
assign (segid "   A" and resid    6 and name  HB2) (segid "   A" and resid    6 and name  HG2) 2.075 0.538 2.538 weight 1.000 ! spec=Expt_11, no=599, id=1042, vol=1.628265e+09
assign (segid "   C" and resid    6 and name  HB2) (segid "   C" and resid    6 and name  HG2) 2.075 0.538 2.538 weight 1.000 ! spec=Expt_11, no=599, id=1042, vol=1.628265e+09
assign (segid "   A" and resid    6 and name  HB1) (segid "   A" and resid    6 and name  HG2) 1.927 0.464 4.073 weight 1.000 ! spec=Expt_11, no=600, id=1043, vol=2.537417e+09
assign (segid "   C" and resid    6 and name  HB1) (segid "   C" and resid    6 and name  HG2) 1.927 0.464 4.073 weight 1.000 ! spec=Expt_11, no=600, id=1043, vol=2.537417e+09
assign (segid "   A" and resid    6 and name  HB1) (segid "   A" and resid    6 and name  HG1) 2.259 0.638 0.638 weight 1.000 ! spec=Expt_11, no=601, id=1044, vol=9.772667e+08
assign (segid "   C" and resid    6 and name  HB1) (segid "   C" and resid    6 and name  HG1) 2.259 0.638 0.638 weight 1.000 ! spec=Expt_11, no=601, id=1044, vol=9.772667e+08
assign (segid "   A" and resid    6 and name  HG1) (segid "   A" and resid    6 and name  HD2) 1.992 0.496 4.008 weight 1.000 ! spec=Expt_11, no=602, id=1045, vol=2.079202e+09
assign (segid "   C" and resid    6 and name  HG1) (segid "   C" and resid    6 and name  HD2) 1.992 0.496 4.008 weight 1.000 ! spec=Expt_11, no=602, id=1045, vol=2.079202e+09
assign (segid "   A" and resid   36 and name  HD2) (segid "   A" and resid   36 and name  HG1) 1.876 0.440 0.440 weight 1.000 ! spec=Expt_11, no=603, id=1046, vol=2.979531e+09
assign (segid "   C" and resid   36 and name  HD2) (segid "   C" and resid   36 and name  HG1) 1.876 0.440 0.440 weight 1.000 ! spec=Expt_11, no=603, id=1046, vol=2.979531e+09
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name  HE2) 2.281 0.650 0.650 weight 1.000 ! spec=Expt_11, no=604, id=1047, vol=9.233175e+08
assign (segid "   C" and resid    6 and name  HD2) (segid "   C" and resid    6 and name  HE2) 2.281 0.650 0.650 weight 1.000 ! spec=Expt_11, no=604, id=1047, vol=9.233175e+08
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name   HA) 2.323 0.675 0.675 weight 1.000 ! spec=Expt_11, no=606, id=1048, vol=8.262952e+08
assign (segid "   C" and resid    7 and name  HB2) (segid "   C" and resid    7 and name   HA) 2.323 0.675 0.675 weight 1.000 ! spec=Expt_11, no=606, id=1048, vol=8.262952e+08
assign (segid "   A" and resid    7 and name HD22) (segid "   A" and resid    7 and name   HA) 2.269 0.644 3.731 weight 1.000 ! spec=Expt_11, no=607, id=1049, vol=9.517338e+08
    or (segid "   A" and resid    7 and name HD21) (segid "   A" and resid    7 and name   HA)
    or (segid "   A" and resid    7 and name HD23) (segid "   A" and resid    7 and name   HA)
assign (segid "   C" and resid    7 and name HD22) (segid "   C" and resid    7 and name   HA) 2.269 0.644 3.731 weight 1.000 ! spec=Expt_11, no=607, id=1049, vol=9.517338e+08
    or (segid "   C" and resid    7 and name HD21) (segid "   C" and resid    7 and name   HA)
    or (segid "   C" and resid    7 and name HD23) (segid "   C" and resid    7 and name   HA)
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name HD12) 2.276 0.648 3.724 weight 1.000 ! spec=Expt_11, no=608, id=1050, vol=9.342283e+08
    or (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name HD11)
    or (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name HD13)
assign (segid "   C" and resid    7 and name   HA) (segid "   C" and resid    7 and name HD12) 2.276 0.648 3.724 weight 1.000 ! spec=Expt_11, no=608, id=1050, vol=9.342283e+08
    or (segid "   C" and resid    7 and name   HA) (segid "   C" and resid    7 and name HD11)
    or (segid "   C" and resid    7 and name   HA) (segid "   C" and resid    7 and name HD13)
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name HD12) 2.327 0.677 0.677 weight 1.000 ! spec=Expt_11, no=609, id=1051, vol=8.192184e+08
    or (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name HD11)
    or (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name HD13)
assign (segid "   C" and resid    7 and name  HB1) (segid "   C" and resid    7 and name HD12) 2.327 0.677 0.677 weight 1.000 ! spec=Expt_11, no=609, id=1051, vol=8.192184e+08
    or (segid "   C" and resid    7 and name  HB1) (segid "   C" and resid    7 and name HD11)
    or (segid "   C" and resid    7 and name  HB1) (segid "   C" and resid    7 and name HD13)
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name HD22) 2.371 0.703 0.703 weight 1.000 ! spec=Expt_11, no=610, id=1052, vol=7.321855e+08
    or (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name HD21)
    or (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name HD23)
assign (segid "   C" and resid    7 and name  HB1) (segid "   C" and resid    7 and name HD22) 2.371 0.703 0.703 weight 1.000 ! spec=Expt_11, no=610, id=1052, vol=7.321855e+08
    or (segid "   C" and resid    7 and name  HB1) (segid "   C" and resid    7 and name HD21)
    or (segid "   C" and resid    7 and name  HB1) (segid "   C" and resid    7 and name HD23)
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name HD22) 2.355 0.693 0.693 weight 1.000 ! spec=Expt_11, no=611, id=1053, vol=7.625540e+08
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name HD21)
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name HD23)
assign (segid "   C" and resid    7 and name  HB2) (segid "   C" and resid    7 and name HD22) 2.355 0.693 0.693 weight 1.000 ! spec=Expt_11, no=611, id=1053, vol=7.625540e+08
    or (segid "   C" and resid    7 and name  HB2) (segid "   C" and resid    7 and name HD21)
    or (segid "   C" and resid    7 and name  HB2) (segid "   C" and resid    7 and name HD23)
assign (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name   HN) 3.409 1.453 1.453 weight 1.000 ! spec=Expt_11, no=615, id=1057, vol=8.281477e+07
assign (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name   HN) 3.409 1.453 1.453 weight 1.000 ! spec=Expt_11, no=615, id=1057, vol=8.281477e+07
assign (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name HD22) 2.151 0.578 0.578 weight 1.000 ! spec=Expt_11, no=617, id=1059, vol=1.312591e+09
    or (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name HD21)
    or (segid "   A" and resid    7 and name   HG) (segid "   A" and resid    7 and name HD23)
assign (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name HD22) 2.151 0.578 0.578 weight 1.000 ! spec=Expt_11, no=617, id=1059, vol=1.312591e+09
    or (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name HD21)
    or (segid "   C" and resid    7 and name   HG) (segid "   C" and resid    7 and name HD23)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name   HA) 2.821 0.995 0.995 weight 1.000 ! spec=Expt_11, no=618, id=1060, vol=2.578381e+08
assign (segid "   C" and resid   13 and name   HN) (segid "   C" and resid   12 and name   HA) 2.821 0.995 0.995 weight 1.000 ! spec=Expt_11, no=618, id=1060, vol=2.578381e+08
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name   HA) 2.561 0.820 0.820 weight 1.000 ! spec=Expt_11, no=619, id=1061, vol=4.612355e+08
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   12 and name   HA) 2.561 0.820 0.820 weight 1.000 ! spec=Expt_11, no=619, id=1061, vol=4.612355e+08
assign (segid "   A" and resid   12 and name   HB) (segid "   A" and resid   28 and name   HN) 3.400 1.445 2.600 weight 1.000 ! spec=Expt_11, no=622, id=1064, vol=8.422729e+07
assign (segid "   C" and resid   12 and name   HB) (segid "   C" and resid   28 and name   HN) 3.400 1.445 2.600 weight 1.000 ! spec=Expt_11, no=622, id=1064, vol=8.422729e+07
assign (segid "   A" and resid   40 and name HG21) (segid "   C" and resid   22 and name   HB) 2.245 0.630 0.630 weight 1.000 ! spec=Expt_11, no=628, id=1070, vol=1.016760e+09
    or (segid "   A" and resid   40 and name HG22) (segid "   C" and resid   22 and name   HB)
    or (segid "   A" and resid   40 and name HG23) (segid "   C" and resid   22 and name   HB)
assign (segid "   C" and resid   40 and name HG21) (segid "   A" and resid   22 and name   HB) 2.245 0.630 0.630 weight 1.000 ! spec=Expt_11, no=628, id=1070, vol=1.016760e+09
    or (segid "   C" and resid   40 and name HG22) (segid "   A" and resid   22 and name   HB)
    or (segid "   C" and resid   40 and name HG23) (segid "   A" and resid   22 and name   HB)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   27 and name  HG2) 2.185 0.597 2.815 weight 1.000 ! spec=Expt_11, no=629, id=1071, vol=1.194137e+09
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   27 and name  HG2)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   27 and name  HG2)
assign (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   27 and name  HG2) 2.185 0.597 2.815 weight 1.000 ! spec=Expt_11, no=629, id=1071, vol=1.194137e+09
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   27 and name  HG2)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   27 and name  HG2)
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   11 and name   HA) 2.834 1.004 1.004 weight 1.000 ! spec=Expt_11, no=631, id=1073, vol=2.512012e+08
assign (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   11 and name   HA) 2.834 1.004 1.004 weight 1.000 ! spec=Expt_11, no=631, id=1073, vol=2.512012e+08
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   15 and name   HA) 2.745 0.942 3.255 weight 1.000 ! spec=Expt_11, no=632, id=1074, vol=3.041977e+08
assign (segid "   C" and resid   11 and name  HB1) (segid "   C" and resid   15 and name   HA) 2.745 0.942 3.255 weight 1.000 ! spec=Expt_11, no=632, id=1074, vol=3.041977e+08
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   28 and name  HD1) 3.149 1.239 1.239 weight 1.000 ! spec=Expt_11, no=633, id=1075, vol=1.333828e+08
    or (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   11 and name  HB1) (segid "   C" and resid   28 and name  HD1) 3.149 1.239 1.239 weight 1.000 ! spec=Expt_11, no=633, id=1075, vol=1.333828e+08
    or (segid "   C" and resid   11 and name  HB1) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   14 and name   HN) 3.182 1.266 1.266 weight 1.000 ! spec=Expt_11, no=639, id=1081, vol=1.252619e+08
assign (segid "   C" and resid   11 and name  HB1) (segid "   C" and resid   14 and name   HN) 3.182 1.266 1.266 weight 1.000 ! spec=Expt_11, no=639, id=1081, vol=1.252619e+08
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name  HB2) 3.275 1.341 1.341 weight 1.000 ! spec=Expt_11, no=640, id=1082, vol=1.052956e+08
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   11 and name  HB2) 3.275 1.341 1.341 weight 1.000 ! spec=Expt_11, no=640, id=1082, vol=1.052956e+08
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   11 and name  HB1) 3.055 1.167 2.945 weight 1.000 ! spec=Expt_11, no=645, id=1087, vol=1.598808e+08
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   11 and name  HB1) 3.055 1.167 2.945 weight 1.000 ! spec=Expt_11, no=645, id=1087, vol=1.598808e+08
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   17 and name  HG2) 3.000 1.125 1.125 weight 1.000 ! spec=Expt_11, no=646, id=1088, vol=1.781814e+08
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   17 and name  HG2) 3.000 1.125 1.125 weight 1.000 ! spec=Expt_11, no=646, id=1088, vol=1.781814e+08
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   10 and name HG21) 2.338 0.683 0.683 weight 1.000 ! spec=Expt_11, no=648, id=1090, vol=7.959097e+08
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   15 and name   HA) (segid "   C" and resid   10 and name HG21) 2.338 0.683 0.683 weight 1.000 ! spec=Expt_11, no=648, id=1090, vol=7.959097e+08
    or (segid "   C" and resid   15 and name   HA) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   15 and name   HA) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid    9 and name   HA) 2.387 0.712 0.712 weight 1.000 ! spec=Expt_11, no=651, id=1093, vol=7.025240e+08
assign (segid "   C" and resid    9 and name  HB1) (segid "   C" and resid    9 and name   HA) 2.387 0.712 0.712 weight 1.000 ! spec=Expt_11, no=651, id=1093, vol=7.025240e+08
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    9 and name  HD2) 3.320 1.378 1.378 weight 1.000 ! spec=Expt_11, no=652, id=1094, vol=9.712398e+07
assign (segid "   C" and resid    9 and name   HA) (segid "   C" and resid    9 and name  HD2) 3.320 1.378 1.378 weight 1.000 ! spec=Expt_11, no=652, id=1094, vol=9.712398e+07
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   28 and name  HD1) 3.382 1.430 1.430 weight 1.000 ! spec=Expt_11, no=653, id=1095, vol=8.690880e+07
    or (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid    9 and name  HB2) (segid "   C" and resid   28 and name  HD1) 3.382 1.430 1.430 weight 1.000 ! spec=Expt_11, no=653, id=1095, vol=8.690880e+07
    or (segid "   C" and resid    9 and name  HB2) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name   HA) 3.130 1.225 1.225 weight 1.000 ! spec=Expt_11, no=663, id=1104, vol=1.382413e+08
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name   HA) 3.130 1.225 1.225 weight 1.000 ! spec=Expt_11, no=663, id=1104, vol=1.382413e+08
assign (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name   HA) 2.252 0.634 0.634 weight 1.000 ! spec=Expt_11, no=665, id=1106, vol=9.969069e+08
assign (segid "   C" and resid   27 and name  HB1) (segid "   C" and resid   27 and name   HA) 2.252 0.634 0.634 weight 1.000 ! spec=Expt_11, no=665, id=1106, vol=9.969069e+08
assign (segid "   A" and resid   13 and name   HA) (segid "   C" and resid   27 and name  HB2) 3.211 1.289 1.289 weight 1.000 ! spec=Expt_11, no=668, id=1108, vol=1.186013e+08
assign (segid "   C" and resid   13 and name   HA) (segid "   A" and resid   27 and name  HB2) 3.211 1.289 1.289 weight 1.000 ! spec=Expt_11, no=668, id=1108, vol=1.186013e+08
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   46 and name  HB1) 2.410 0.726 0.726 weight 1.000 ! spec=Expt_11, no=673, id=1112, vol=6.642985e+08
assign (segid "   C" and resid   46 and name   HA) (segid "   C" and resid   46 and name  HB1) 2.410 0.726 0.726 weight 1.000 ! spec=Expt_11, no=673, id=1112, vol=6.642985e+08
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name   HA) 2.531 0.801 0.801 weight 1.000 ! spec=Expt_11, no=675, id=1114, vol=4.946064e+08
assign (segid "   C" and resid   46 and name  HB2) (segid "   C" and resid   46 and name   HA) 2.531 0.801 0.801 weight 1.000 ! spec=Expt_11, no=675, id=1114, vol=4.946064e+08
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HD1) 2.646 0.875 3.354 weight 1.000 ! spec=Expt_11, no=678, id=1117, vol=3.791074e+08
assign (segid "   C" and resid   45 and name   HA) (segid "   C" and resid   45 and name  HD1) 2.646 0.875 3.354 weight 1.000 ! spec=Expt_11, no=678, id=1117, vol=3.791074e+08
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   45 and name   HA) 2.442 0.746 0.746 weight 1.000 ! spec=Expt_11, no=679, id=1118, vol=6.124182e+08
assign (segid "   C" and resid   45 and name  HB1) (segid "   C" and resid   45 and name   HA) 2.442 0.746 0.746 weight 1.000 ! spec=Expt_11, no=679, id=1118, vol=6.124182e+08
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   45 and name  HD2) 2.593 0.840 3.407 weight 1.000 ! spec=Expt_11, no=682, id=1121, vol=4.278281e+08
assign (segid "   C" and resid   45 and name  HB1) (segid "   C" and resid   45 and name  HD2) 2.593 0.840 3.407 weight 1.000 ! spec=Expt_11, no=682, id=1121, vol=4.278281e+08
assign (segid "   A" and resid   45 and name  HD1) (segid "   A" and resid   45 and name  HB2) 2.827 0.999 3.173 weight 1.000 ! spec=Expt_11, no=688, id=1127, vol=2.547300e+08
assign (segid "   C" and resid   45 and name  HD1) (segid "   C" and resid   45 and name  HB2) 2.827 0.999 3.173 weight 1.000 ! spec=Expt_11, no=688, id=1127, vol=2.547300e+08
assign (segid "   A" and resid   45 and name  HD1) (segid "   A" and resid   45 and name  HB1) 2.879 1.036 1.036 weight 1.000 ! spec=Expt_11, no=689, id=1128, vol=2.284438e+08
assign (segid "   C" and resid   45 and name  HD1) (segid "   C" and resid   45 and name  HB1) 2.879 1.036 1.036 weight 1.000 ! spec=Expt_11, no=689, id=1128, vol=2.284438e+08
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   45 and name  HG2) 1.969 0.484 0.484 weight 1.000 ! spec=Expt_11, no=690, id=1129, vol=2.234232e+09
assign (segid "   C" and resid   45 and name  HB2) (segid "   C" and resid   45 and name  HG2) 1.969 0.484 0.484 weight 1.000 ! spec=Expt_11, no=690, id=1129, vol=2.234232e+09
assign (segid "   A" and resid   45 and name  HD1) (segid "   A" and resid   45 and name  HG2) 2.218 0.615 0.615 weight 1.000 ! spec=Expt_11, no=692, id=1131, vol=1.091309e+09
assign (segid "   C" and resid   45 and name  HD1) (segid "   C" and resid   45 and name  HG2) 2.218 0.615 0.615 weight 1.000 ! spec=Expt_11, no=692, id=1131, vol=1.091309e+09
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   45 and name  HD2) 3.069 1.178 2.931 weight 1.000 ! spec=Expt_11, no=694, id=1133, vol=1.555219e+08
assign (segid "   C" and resid   44 and name  HB1) (segid "   C" and resid   45 and name  HD2) 3.069 1.178 2.931 weight 1.000 ! spec=Expt_11, no=694, id=1133, vol=1.555219e+08
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   43 and name  HB1) 2.171 0.589 3.829 weight 1.000 ! spec=Expt_11, no=695, id=1134, vol=1.241186e+09
assign (segid "   C" and resid   43 and name   HA) (segid "   C" and resid   43 and name  HB1) 2.171 0.589 3.829 weight 1.000 ! spec=Expt_11, no=695, id=1134, vol=1.241186e+09
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name   HN) 3.322 1.380 1.380 weight 1.000 ! spec=Expt_11, no=698, id=1136, vol=9.665689e+07
assign (segid "   C" and resid   41 and name   HA) (segid "   C" and resid   41 and name   HN) 3.322 1.380 1.380 weight 1.000 ! spec=Expt_11, no=698, id=1136, vol=9.665689e+07
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   40 and name HG21) 3.161 1.249 1.249 weight 1.000 ! spec=Expt_11, no=699, id=1137, vol=1.303576e+08
    or (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   40 and name HG23)
assign (segid "   C" and resid   41 and name   HA) (segid "   C" and resid   40 and name HG21) 3.161 1.249 1.249 weight 1.000 ! spec=Expt_11, no=699, id=1137, vol=1.303576e+08
    or (segid "   C" and resid   41 and name   HA) (segid "   C" and resid   40 and name HG22)
    or (segid "   C" and resid   41 and name   HA) (segid "   C" and resid   40 and name HG23)
assign (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   42 and name HG21) 3.047 1.160 2.160 weight 1.000 ! spec=Expt_11, no=701, id=1139, vol=1.624828e+08
    or (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   42 and name HG22)
    or (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   42 and name HG23)
assign (segid "   C" and resid   41 and name  HB2) (segid "   C" and resid   42 and name HG21) 3.047 1.160 2.160 weight 1.000 ! spec=Expt_11, no=701, id=1139, vol=1.624828e+08
    or (segid "   C" and resid   41 and name  HB2) (segid "   C" and resid   42 and name HG22)
    or (segid "   C" and resid   41 and name  HB2) (segid "   C" and resid   42 and name HG23)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   40 and name   HN) 3.269 1.336 1.336 weight 1.000 ! spec=Expt_11, no=702, id=1140, vol=1.064877e+08
assign (segid "   C" and resid   39 and name   HA) (segid "   C" and resid   40 and name   HN) 3.269 1.336 1.336 weight 1.000 ! spec=Expt_11, no=702, id=1140, vol=1.064877e+08
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name  HG1) 1.850 0.428 0.428 weight 1.000 ! spec=Expt_11, no=706, id=1144, vol=3.241814e+09
assign (segid "   C" and resid   34 and name  HG2) (segid "   C" and resid   34 and name  HG1) 1.850 0.428 0.428 weight 1.000 ! spec=Expt_11, no=706, id=1144, vol=3.241814e+09
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   27 and name  HB2) 2.574 0.828 3.426 weight 1.000 ! spec=Expt_11, no=707, id=1145, vol=4.475223e+08
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   27 and name  HB2)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   27 and name  HB2)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   27 and name  HB2) 2.574 0.828 3.426 weight 1.000 ! spec=Expt_11, no=707, id=1145, vol=4.475223e+08
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   27 and name  HB2)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   25 and name  HE1) 2.236 0.625 0.625 weight 1.000 ! spec=Expt_11, no=708, id=1146, vol=1.040126e+09
    or (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   25 and name  HE2)
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   25 and name  HE1)
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   25 and name  HE2)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   25 and name  HE1)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   25 and name  HE2)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   25 and name  HE1) 2.236 0.625 0.625 weight 1.000 ! spec=Expt_11, no=708, id=1146, vol=1.040126e+09
    or (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   25 and name  HE2)
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   25 and name  HE1)
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   25 and name  HE2)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   25 and name  HE1)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   25 and name  HE2)
assign (segid "   A" and resid   24 and name HD22) (segid "   A" and resid   25 and name  HD1) 3.015 1.136 1.136 weight 1.000 ! spec=Expt_11, no=710, id=1147, vol=1.731976e+08
    or (segid "   A" and resid   24 and name HD22) (segid "   A" and resid   25 and name  HD2)
    or (segid "   A" and resid   24 and name HD21) (segid "   A" and resid   25 and name  HD1)
    or (segid "   A" and resid   24 and name HD21) (segid "   A" and resid   25 and name  HD2)
    or (segid "   A" and resid   24 and name HD23) (segid "   A" and resid   25 and name  HD1)
    or (segid "   A" and resid   24 and name HD23) (segid "   A" and resid   25 and name  HD2)
assign (segid "   C" and resid   24 and name HD22) (segid "   C" and resid   25 and name  HD1) 3.015 1.136 1.136 weight 1.000 ! spec=Expt_11, no=710, id=1147, vol=1.731976e+08
    or (segid "   C" and resid   24 and name HD22) (segid "   C" and resid   25 and name  HD2)
    or (segid "   C" and resid   24 and name HD21) (segid "   C" and resid   25 and name  HD1)
    or (segid "   C" and resid   24 and name HD21) (segid "   C" and resid   25 and name  HD2)
    or (segid "   C" and resid   24 and name HD23) (segid "   C" and resid   25 and name  HD1)
    or (segid "   C" and resid   24 and name HD23) (segid "   C" and resid   25 and name  HD2)
assign (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   13 and name   HA) 3.063 1.173 2.937 weight 1.000 ! spec=Expt_11, no=715, id=1152, vol=1.572936e+08
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   13 and name   HA)
assign (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   13 and name   HA) 3.063 1.173 2.937 weight 1.000 ! spec=Expt_11, no=715, id=1152, vol=1.572936e+08
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   13 and name   HA)
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name   HA) 2.369 0.702 0.702 weight 1.000 ! spec=Expt_11, no=716, id=1153, vol=7.350182e+08
assign (segid "   C" and resid    8 and name  HB2) (segid "   C" and resid    8 and name   HA) 2.369 0.702 0.702 weight 1.000 ! spec=Expt_11, no=716, id=1153, vol=7.350182e+08
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid   17 and name   HA) 2.998 1.123 1.123 weight 1.000 ! spec=Expt_11, no=718, id=1155, vol=1.791323e+08
assign (segid "   C" and resid    8 and name  HB1) (segid "   C" and resid   17 and name   HA) 2.998 1.123 1.123 weight 1.000 ! spec=Expt_11, no=718, id=1155, vol=1.791323e+08
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid   17 and name  HB1) 2.872 1.031 1.031 weight 1.000 ! spec=Expt_11, no=719, id=1156, vol=2.316076e+08
assign (segid "   C" and resid    8 and name  HB2) (segid "   C" and resid   17 and name  HB1) 2.872 1.031 1.031 weight 1.000 ! spec=Expt_11, no=719, id=1156, vol=2.316076e+08
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid    8 and name  HB1) 2.864 1.025 1.025 weight 1.000 ! spec=Expt_11, no=721, id=1158, vol=2.357006e+08
assign (segid "   C" and resid   17 and name  HB1) (segid "   C" and resid    8 and name  HB1) 2.864 1.025 1.025 weight 1.000 ! spec=Expt_11, no=721, id=1158, vol=2.357006e+08
assign (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid    8 and name  HB2) 3.104 1.205 2.205 weight 1.000 ! spec=Expt_11, no=724, id=1161, vol=1.452537e+08
assign (segid "   C" and resid   17 and name  HG2) (segid "   C" and resid    8 and name  HB2) 3.104 1.205 2.205 weight 1.000 ! spec=Expt_11, no=724, id=1161, vol=1.452537e+08
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid   28 and name  HE1) 3.332 1.388 1.388 weight 1.000 ! spec=Expt_11, no=728, id=1164, vol=9.505927e+07
    or (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid    9 and name  HB1) (segid "   C" and resid   28 and name  HE1) 3.332 1.388 1.388 weight 1.000 ! spec=Expt_11, no=728, id=1164, vol=9.505927e+07
    or (segid "   C" and resid    9 and name  HB1) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   28 and name   HA) 3.096 1.198 2.904 weight 1.000 ! spec=Expt_11, no=729, id=1165, vol=1.477685e+08
assign (segid "   C" and resid    9 and name  HB2) (segid "   C" and resid   28 and name   HA) 3.096 1.198 2.904 weight 1.000 ! spec=Expt_11, no=729, id=1165, vol=1.477685e+08
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    8 and name   HA) 3.186 1.269 2.814 weight 1.000 ! spec=Expt_11, no=730, id=1166, vol=1.241966e+08
assign (segid "   C" and resid    9 and name  HB2) (segid "   C" and resid    8 and name   HA) 3.186 1.269 2.814 weight 1.000 ! spec=Expt_11, no=730, id=1166, vol=1.241966e+08
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   11 and name  HB2) 2.944 1.083 3.056 weight 1.000 ! spec=Expt_11, no=732, id=1168, vol=1.997097e+08
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   11 and name  HB2) 2.944 1.083 3.056 weight 1.000 ! spec=Expt_11, no=732, id=1168, vol=1.997097e+08
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   18 and name  HD2) 2.971 1.104 3.029 weight 1.000 ! spec=Expt_11, no=735, id=1171, vol=1.888898e+08
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   18 and name  HD2) 2.971 1.104 3.029 weight 1.000 ! spec=Expt_11, no=735, id=1171, vol=1.888898e+08
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   17 and name  HB1) 3.051 1.164 2.949 weight 1.000 ! spec=Expt_11, no=736, id=1172, vol=1.610765e+08
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   17 and name  HB1) 3.051 1.164 2.949 weight 1.000 ! spec=Expt_11, no=736, id=1172, vol=1.610765e+08
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   18 and name  HB2) 3.215 1.292 2.785 weight 1.000 ! spec=Expt_11, no=737, id=1173, vol=1.176474e+08
assign (segid "   C" and resid   10 and name   HA) (segid "   C" and resid   18 and name  HB2) 3.215 1.292 2.785 weight 1.000 ! spec=Expt_11, no=737, id=1173, vol=1.176474e+08
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   15 and name  HB1) 2.672 0.893 1.893 weight 1.000 ! spec=Expt_11, no=741, id=1176, vol=3.571007e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   15 and name  HB1)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   15 and name  HB1)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   15 and name  HB1) 2.672 0.893 1.893 weight 1.000 ! spec=Expt_11, no=741, id=1176, vol=3.571007e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   15 and name  HB1)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   15 and name  HB1)
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   16 and name  HB2) 2.894 1.047 3.106 weight 1.000 ! spec=Expt_11, no=743, id=1178, vol=2.214906e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   16 and name  HB2)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   16 and name  HB2)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   16 and name  HB2) 2.894 1.047 3.106 weight 1.000 ! spec=Expt_11, no=743, id=1178, vol=2.214906e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   16 and name  HB2)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   16 and name  HB2)
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   16 and name  HB1) 2.749 0.945 3.251 weight 1.000 ! spec=Expt_11, no=744, id=1179, vol=3.013034e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   16 and name  HB1)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   16 and name  HB1)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   16 and name  HB1) 2.749 0.945 3.251 weight 1.000 ! spec=Expt_11, no=744, id=1179, vol=3.013034e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   16 and name  HB1)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   16 and name  HB1)
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   17 and name  HG1) 2.793 0.975 0.975 weight 1.000 ! spec=Expt_11, no=745, id=1180, vol=2.740660e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   17 and name  HG1)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   17 and name  HG1)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   17 and name  HG1) 2.793 0.975 0.975 weight 1.000 ! spec=Expt_11, no=745, id=1180, vol=2.740660e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   17 and name  HG1)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   17 and name  HG1)
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   17 and name  HB1) 2.781 0.967 3.219 weight 1.000 ! spec=Expt_11, no=747, id=1182, vol=2.809117e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   17 and name  HB1)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   17 and name  HB1)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   17 and name  HB1) 2.781 0.967 3.219 weight 1.000 ! spec=Expt_11, no=747, id=1182, vol=2.809117e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   17 and name  HB1)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   17 and name  HB1)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   11 and name   HA) 2.797 0.978 0.978 weight 1.000 ! spec=Expt_11, no=750, id=1185, vol=2.716279e+08
assign (segid "   C" and resid   30 and name   HN) (segid "   C" and resid   11 and name   HA) 2.797 0.978 0.978 weight 1.000 ! spec=Expt_11, no=750, id=1185, vol=2.716279e+08
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name   HA) 2.977 1.108 1.108 weight 1.000 ! spec=Expt_11, no=751, id=1186, vol=1.867015e+08
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   11 and name   HA) 2.977 1.108 1.108 weight 1.000 ! spec=Expt_11, no=751, id=1186, vol=1.867015e+08
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   30 and name   HA) 2.861 1.023 3.139 weight 1.000 ! spec=Expt_11, no=755, id=1189, vol=2.369242e+08
assign (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   30 and name   HA) 2.861 1.023 3.139 weight 1.000 ! spec=Expt_11, no=755, id=1189, vol=2.369242e+08
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   14 and name   HA) 3.165 1.252 2.835 weight 1.000 ! spec=Expt_11, no=758, id=1190, vol=1.292727e+08
assign (segid "   C" and resid   11 and name  HB1) (segid "   C" and resid   14 and name   HA) 3.165 1.252 2.835 weight 1.000 ! spec=Expt_11, no=758, id=1190, vol=1.292727e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name HG21) 2.582 0.833 3.418 weight 1.000 ! spec=Expt_11, no=766, id=1195, vol=4.388347e+08
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name HG22)
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name HG23)
assign (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   26 and name HG21) 2.582 0.833 3.418 weight 1.000 ! spec=Expt_11, no=766, id=1195, vol=4.388347e+08
    or (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   26 and name HG22)
    or (segid "   C" and resid   27 and name   HN) (segid "   C" and resid   26 and name HG23)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   13 and name   HN) 2.656 0.882 3.344 weight 1.000 ! spec=Expt_11, no=767, id=1196, vol=3.700451e+08
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   13 and name   HN)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   13 and name   HN)
assign (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   13 and name   HN) 2.656 0.882 3.344 weight 1.000 ! spec=Expt_11, no=767, id=1196, vol=3.700451e+08
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   13 and name   HN)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   13 and name   HN)
assign (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   26 and name HG21) 2.092 0.587 1.587 weight 1.000 ! spec=Expt_11, no=768, id=1198, vol=1.0865e+09
    or (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   26 and name HG22)
    or (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   26 and name HG23)
assign (segid "   C" and resid   27 and name  HD2) (segid "   C" and resid   26 and name HG21) 2.092 0.587 1.587 weight 1.000 ! spec=Expt_11, no=768, id=1198, vol=1.0865e+09
    or (segid "   C" and resid   27 and name  HD2) (segid "   C" and resid   26 and name HG22)
    or (segid "   C" and resid   27 and name  HD2) (segid "   C" and resid   26 and name HG23)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   12 and name HG22) 3.027 1.145 2.973 weight 1.000 ! spec=Expt_11, no=773, id=1199, vol=1.689681e+08
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   12 and name HG23)
assign (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   12 and name HG22) 3.027 1.145 2.973 weight 1.000 ! spec=Expt_11, no=773, id=1199, vol=1.689681e+08
    or (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   12 and name HG21)
    or (segid "   C" and resid   28 and name   HN) (segid "   C" and resid   12 and name HG23)
assign (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   11 and name   HA) 2.601 0.845 3.399 weight 1.000 ! spec=Expt_11, no=775, id=1201, vol=4.202515e+08
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   11 and name   HA)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   11 and name   HA)
assign (segid "   C" and resid   12 and name HG22) (segid "   C" and resid   11 and name   HA) 2.601 0.845 3.399 weight 1.000 ! spec=Expt_11, no=775, id=1201, vol=4.202515e+08
    or (segid "   C" and resid   12 and name HG21) (segid "   C" and resid   11 and name   HA)
    or (segid "   C" and resid   12 and name HG23) (segid "   C" and resid   11 and name   HA)
assign (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   13 and name   HA) 2.476 0.766 0.766 weight 1.000 ! spec=Expt_11, no=777, id=1202, vol=5.641268e+08
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   13 and name   HA)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   13 and name   HA)
assign (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   13 and name   HA) 2.476 0.766 0.766 weight 1.000 ! spec=Expt_11, no=777, id=1202, vol=5.641268e+08
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   13 and name   HA)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   13 and name   HA)
assign (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   13 and name   HA) 2.247 0.631 3.753 weight 1.000 ! spec=Expt_11, no=778, id=1203, vol=1.011342e+09
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   13 and name   HA)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   13 and name   HA)
assign (segid "   C" and resid   12 and name HG22) (segid "   C" and resid   13 and name   HA) 2.247 0.631 3.753 weight 1.000 ! spec=Expt_11, no=778, id=1203, vol=1.011342e+09
    or (segid "   C" and resid   12 and name HG21) (segid "   C" and resid   13 and name   HA)
    or (segid "   C" and resid   12 and name HG23) (segid "   C" and resid   13 and name   HA)
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name HG21) 2.242 0.628 3.758 weight 1.000 ! spec=Expt_11, no=779, id=1204, vol=1.022979e+09
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name HG22)
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name HG23)
assign (segid "   C" and resid   26 and name   HA) (segid "   C" and resid   26 and name HG21) 2.242 0.628 3.758 weight 1.000 ! spec=Expt_11, no=779, id=1204, vol=1.022979e+09
    or (segid "   C" and resid   26 and name   HA) (segid "   C" and resid   26 and name HG22)
    or (segid "   C" and resid   26 and name   HA) (segid "   C" and resid   26 and name HG23)
assign (segid "   A" and resid   13 and name   HA) (segid "   C" and resid   27 and name  HG1) 2.667 0.889 0.889 weight 1.000 ! spec=Expt_11, no=780, id=1205, vol=3.616749e+08
assign (segid "   C" and resid   13 and name   HA) (segid "   A" and resid   27 and name  HG1) 2.667 0.889 0.889 weight 1.000 ! spec=Expt_11, no=780, id=1205, vol=3.616749e+08
assign (segid "   A" and resid   13 and name   HA) (segid "   C" and resid   27 and name  HB1) 2.346 0.688 3.654 weight 1.000 ! spec=Expt_11, no=781, id=1206, vol=7.802771e+08
assign (segid "   C" and resid   13 and name   HA) (segid "   A" and resid   27 and name  HB1) 2.346 0.688 3.654 weight 1.000 ! spec=Expt_11, no=781, id=1206, vol=7.802771e+08
assign (segid "   A" and resid   13 and name   HA) (segid "   C" and resid   27 and name  HG2) 2.367 0.700 3.633 weight 1.000 ! spec=Expt_11, no=782, id=1207, vol=7.395044e+08
assign (segid "   C" and resid   13 and name   HA) (segid "   A" and resid   27 and name  HG2) 2.367 0.700 3.633 weight 1.000 ! spec=Expt_11, no=782, id=1207, vol=7.395044e+08
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   13 and name HD12) 2.074 0.538 3.926 weight 1.000 ! spec=Expt_11, no=788, id=1211, vol=1.633724e+09
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   13 and name HD13)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   13 and name HD12)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   13 and name HD13)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   13 and name HD12)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   13 and name HD13)
assign (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   13 and name HD12) 2.074 0.538 3.926 weight 1.000 ! spec=Expt_11, no=788, id=1211, vol=1.633724e+09
    or (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   12 and name HG12) (segid "   C" and resid   13 and name HD13)
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   13 and name HD12)
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   12 and name HG11) (segid "   C" and resid   13 and name HD13)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   13 and name HD12)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   12 and name HG13) (segid "   C" and resid   13 and name HD13)
assign (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   29 and name HG12) 2.182 0.595 3.818 weight 1.000 ! spec=Expt_11, no=790, id=1212, vol=1.204343e+09
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   29 and name HG12)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   29 and name HG12)
assign (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   29 and name HG12) 2.182 0.595 3.818 weight 1.000 ! spec=Expt_11, no=790, id=1212, vol=1.204343e+09
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   29 and name HG12)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   29 and name HG12)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   27 and name  HG2) 2.669 0.891 0.891 weight 1.000 ! spec=Expt_11, no=791, id=1213, vol=3.592909e+08
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   27 and name  HG2)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   27 and name  HG2)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   27 and name  HG2) 2.669 0.891 0.891 weight 1.000 ! spec=Expt_11, no=791, id=1213, vol=3.592909e+08
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   27 and name  HG2)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   27 and name  HG2)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   27 and name  HB2) 2.829 1.001 2.001 weight 1.000 ! spec=Expt_11, no=792, id=1214, vol=2.534886e+08
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   27 and name  HB2)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   27 and name  HB2)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   27 and name  HB2) 2.829 1.001 2.001 weight 1.000 ! spec=Expt_11, no=792, id=1214, vol=2.534886e+08
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   27 and name  HB2)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HD12) 2.358 0.695 0.695 weight 1.000 ! spec=Expt_11, no=794, id=1215, vol=7.571329e+08
    or (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   13 and name   HB) (segid "   A" and resid   13 and name HD13)
assign (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HD12) 2.358 0.695 0.695 weight 1.000 ! spec=Expt_11, no=794, id=1215, vol=7.571329e+08
    or (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   13 and name   HB) (segid "   C" and resid   13 and name HD13)
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   13 and name HD12) 2.352 0.691 1.691 weight 1.000 ! spec=Expt_11, no=795, id=1216, vol=7.681329e+08
    or (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   13 and name HD13)
assign (segid "   C" and resid   33 and name  HB1) (segid "   C" and resid   13 and name HD12) 2.352 0.691 1.691 weight 1.000 ! spec=Expt_11, no=795, id=1216, vol=7.681329e+08
    or (segid "   C" and resid   33 and name  HB1) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   33 and name  HB1) (segid "   C" and resid   13 and name HD13)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   27 and name   HA) 3.025 1.144 2.975 weight 1.000 ! spec=Expt_11, no=797, id=1218, vol=1.697172e+08
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   27 and name   HA)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   27 and name   HA)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   27 and name   HA) 3.025 1.144 2.975 weight 1.000 ! spec=Expt_11, no=797, id=1218, vol=1.697172e+08
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   27 and name   HA)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   27 and name   HA)
assign (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   11 and name   HA) 3.350 1.403 2.650 weight 1.000 ! spec=Expt_11, no=798, id=1219, vol=9.196272e+07
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   11 and name   HA)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   11 and name   HA)
assign (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   11 and name   HA) 3.350 1.403 2.650 weight 1.000 ! spec=Expt_11, no=798, id=1219, vol=9.196272e+07
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   11 and name   HA)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   11 and name   HA)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   25 and name  HD1) 3.462 1.499 1.499 weight 1.000 ! spec=Expt_11, no=800, id=1221, vol=7.545777e+07
    or (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   25 and name  HD2)
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   25 and name  HD1)
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   25 and name  HD2)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   25 and name  HD1)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   25 and name  HD2)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   25 and name  HD1) 3.462 1.499 1.499 weight 1.000 ! spec=Expt_11, no=800, id=1221, vol=7.545777e+07
    or (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   25 and name  HD2)
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   25 and name  HD1)
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   25 and name  HD2)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   25 and name  HD1)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   25 and name  HD2)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   25 and name  HE1) 3.571 1.594 1.594 weight 1.000 ! spec=Expt_11, no=801, id=1222, vol=6.265684e+07
    or (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   25 and name  HE2)
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   25 and name  HE1)
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   25 and name  HE2)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   25 and name  HE1)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   25 and name  HE2)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   25 and name  HE1) 3.571 1.594 1.594 weight 1.000 ! spec=Expt_11, no=801, id=1222, vol=6.265684e+07
    or (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   25 and name  HE2)
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   25 and name  HE1)
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   25 and name  HE2)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   25 and name  HE1)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   25 and name  HE2)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   13 and name HD12) 3.075 1.182 2.925 weight 1.000 ! spec=Expt_11, no=803, id=1224, vol=1.536970e+08
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   13 and name HD11)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   13 and name HD13)
assign (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   13 and name HD12) 3.075 1.182 2.925 weight 1.000 ! spec=Expt_11, no=803, id=1224, vol=1.536970e+08
    or (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   13 and name HD11)
    or (segid "   C" and resid   12 and name   HN) (segid "   C" and resid   13 and name HD13)
assign (segid "   A" and resid   13 and name HG11) (segid "   A" and resid   13 and name HG12) 2.066 0.534 0.534 weight 1.000 ! spec=Expt_11, no=806, id=1226, vol=1.669493e+09
assign (segid "   C" and resid   13 and name HG11) (segid "   C" and resid   13 and name HG12) 2.066 0.534 0.534 weight 1.000 ! spec=Expt_11, no=806, id=1226, vol=1.669493e+09
assign (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   13 and name HG11) 2.228 0.620 0.620 weight 1.000 ! spec=Expt_11, no=807, id=1227, vol=1.063193e+09
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   13 and name HG11)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   13 and name HG11)
assign (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   13 and name HG11) 2.228 0.620 0.620 weight 1.000 ! spec=Expt_11, no=807, id=1227, vol=1.063193e+09
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   13 and name HG11)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   13 and name HG11)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name HG11) 3.491 1.524 1.524 weight 1.000 ! spec=Expt_11, no=811, id=1230, vol=7.177417e+07
assign (segid "   C" and resid   14 and name   HN) (segid "   C" and resid   13 and name HG11) 3.491 1.524 1.524 weight 1.000 ! spec=Expt_11, no=811, id=1230, vol=7.177417e+07
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   27 and name   HN) 3.196 1.277 1.277 weight 1.000 ! spec=Expt_11, no=813, id=1232, vol=1.219953e+08
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   27 and name   HN)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   27 and name   HN)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   27 and name   HN) 3.196 1.277 1.277 weight 1.000 ! spec=Expt_11, no=813, id=1232, vol=1.219953e+08
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   27 and name   HN)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   27 and name   HN)
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   27 and name   HA) 3.100 1.201 2.900 weight 1.000 ! spec=Expt_11, no=814, id=1233, vol=1.465830e+08
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   27 and name   HA)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   27 and name   HA)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   27 and name   HA) 3.100 1.201 2.900 weight 1.000 ! spec=Expt_11, no=814, id=1233, vol=1.465830e+08
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   27 and name   HA)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   27 and name   HA)
assign (segid "   A" and resid   13 and name HG22) (segid "   A" and resid   33 and name  HB2) 2.658 0.883 1.883 weight 1.000 ! spec=Expt_11, no=818, id=1235, vol=3.688848e+08
    or (segid "   A" and resid   13 and name HG21) (segid "   A" and resid   33 and name  HB2)
    or (segid "   A" and resid   13 and name HG23) (segid "   A" and resid   33 and name  HB2)
assign (segid "   C" and resid   13 and name HG22) (segid "   C" and resid   33 and name  HB2) 2.658 0.883 1.883 weight 1.000 ! spec=Expt_11, no=818, id=1235, vol=3.688848e+08
    or (segid "   C" and resid   13 and name HG21) (segid "   C" and resid   33 and name  HB2)
    or (segid "   C" and resid   13 and name HG23) (segid "   C" and resid   33 and name  HB2)
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   27 and name  HG2) 2.462 0.758 0.758 weight 1.000 ! spec=Expt_11, no=819, id=1236, vol=5.837243e+08
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   27 and name  HG2)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   27 and name  HG2)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   27 and name  HG2) 2.462 0.758 0.758 weight 1.000 ! spec=Expt_11, no=819, id=1236, vol=5.837243e+08
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   27 and name  HG2)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   27 and name  HG2)
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   27 and name  HG1) 2.556 0.817 0.817 weight 1.000 ! spec=Expt_11, no=821, id=1237, vol=4.659216e+08
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   27 and name  HG1)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   27 and name  HG1)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   27 and name  HG1) 2.556 0.817 0.817 weight 1.000 ! spec=Expt_11, no=821, id=1237, vol=4.659216e+08
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   27 and name  HG1)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   27 and name  HG1)
assign (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   13 and name HG22) 2.065 0.533 0.533 weight 1.000 ! spec=Expt_11, no=822, id=1238, vol=1.676274e+09
    or (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   13 and name HG23)
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   13 and name HG22)
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   13 and name HG23)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   13 and name HG22)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   13 and name HG23)
assign (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   13 and name HG22) 2.065 0.533 0.533 weight 1.000 ! spec=Expt_11, no=822, id=1238, vol=1.676274e+09
    or (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   13 and name HG23)
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   13 and name HG22)
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   13 and name HG23)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   13 and name HG22)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   13 and name HG23)
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   27 and name  HD2) 3.376 1.424 2.624 weight 1.000 ! spec=Expt_11, no=823, id=1239, vol=8.787369e+07
assign (segid "   C" and resid   25 and name   HA) (segid "   C" and resid   27 and name  HD2) 3.376 1.424 2.624 weight 1.000 ! spec=Expt_11, no=823, id=1239, vol=8.787369e+07
assign (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name   HA) 2.599 0.844 3.401 weight 1.000 ! spec=Expt_11, no=825, id=1241, vol=4.219675e+08
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name   HA)
assign (segid "   C" and resid   25 and name  HE1) (segid "   C" and resid   25 and name   HA) 2.599 0.844 3.401 weight 1.000 ! spec=Expt_11, no=825, id=1241, vol=4.219675e+08
    or (segid "   C" and resid   25 and name  HE2) (segid "   C" and resid   25 and name   HA)
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   13 and name HG22) 3.420 1.462 2.580 weight 1.000 ! spec=Expt_11, no=826, id=1242, vol=8.117788e+07
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   13 and name HG23)
assign (segid "   C" and resid   14 and name  HB2) (segid "   C" and resid   13 and name HG22) 3.420 1.462 2.580 weight 1.000 ! spec=Expt_11, no=826, id=1242, vol=8.117788e+07
    or (segid "   C" and resid   14 and name  HB2) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   14 and name  HB2) (segid "   C" and resid   13 and name HG23)
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   13 and name HG22) 3.078 1.184 2.922 weight 1.000 ! spec=Expt_11, no=827, id=1243, vol=1.529389e+08
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   13 and name HG23)
assign (segid "   C" and resid   14 and name  HB1) (segid "   C" and resid   13 and name HG22) 3.078 1.184 2.922 weight 1.000 ! spec=Expt_11, no=827, id=1243, vol=1.529389e+08
    or (segid "   C" and resid   14 and name  HB1) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   14 and name  HB1) (segid "   C" and resid   13 and name HG23)
assign (segid "   A" and resid   14 and name  HB2) (segid "   C" and resid   25 and name  HD1) 3.245 1.317 2.755 weight 1.000 ! spec=Expt_11, no=828, id=1244, vol=1.112815e+08
    or (segid "   A" and resid   14 and name  HB2) (segid "   C" and resid   25 and name  HD2)
assign (segid "   C" and resid   14 and name  HB2) (segid "   A" and resid   25 and name  HD1) 3.245 1.317 2.755 weight 1.000 ! spec=Expt_11, no=828, id=1244, vol=1.112815e+08
    or (segid "   C" and resid   14 and name  HB2) (segid "   A" and resid   25 and name  HD2)
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   16 and name   HN) 3.432 1.473 1.473 weight 1.000 ! spec=Expt_11, no=830, id=1246, vol=7.952301e+07
assign (segid "   C" and resid   14 and name  HB2) (segid "   C" and resid   16 and name   HN) 3.432 1.473 1.473 weight 1.000 ! spec=Expt_11, no=830, id=1246, vol=7.952301e+07
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   16 and name   HN) 3.451 1.489 2.549 weight 1.000 ! spec=Expt_11, no=831, id=1247, vol=7.695986e+07
assign (segid "   C" and resid   14 and name  HB1) (segid "   C" and resid   16 and name   HN) 3.451 1.489 2.549 weight 1.000 ! spec=Expt_11, no=831, id=1247, vol=7.695986e+07
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name  HB1) 2.311 0.668 0.668 weight 1.000 ! spec=Expt_11, no=837, id=1251, vol=8.533516e+08
assign (segid "   C" and resid   15 and name   HA) (segid "   C" and resid   15 and name  HB1) 2.311 0.668 0.668 weight 1.000 ! spec=Expt_11, no=837, id=1251, vol=8.533516e+08
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   16 and name   HA) 2.375 0.705 3.625 weight 1.000 ! spec=Expt_11, no=838, id=1252, vol=7.251800e+08
assign (segid "   C" and resid   15 and name  HB2) (segid "   C" and resid   16 and name   HA) 2.375 0.705 3.625 weight 1.000 ! spec=Expt_11, no=838, id=1252, vol=7.251800e+08
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   16 and name   HA) 2.429 0.738 3.571 weight 1.000 ! spec=Expt_11, no=839, id=1253, vol=6.322654e+08
assign (segid "   C" and resid   15 and name  HB1) (segid "   C" and resid   16 and name   HA) 2.429 0.738 3.571 weight 1.000 ! spec=Expt_11, no=839, id=1253, vol=6.322654e+08
assign (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   15 and name  HB2) 3.110 1.209 1.209 weight 1.000 ! spec=Expt_11, no=840, id=1254, vol=1.437099e+08
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   15 and name  HB2)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   15 and name  HB2)
assign (segid "   C" and resid   10 and name HG21) (segid "   C" and resid   15 and name  HB2) 3.110 1.209 1.209 weight 1.000 ! spec=Expt_11, no=840, id=1254, vol=1.437099e+08
    or (segid "   C" and resid   10 and name HG22) (segid "   C" and resid   15 and name  HB2)
    or (segid "   C" and resid   10 and name HG23) (segid "   C" and resid   15 and name  HB2)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HB1) 2.818 0.993 3.182 weight 1.000 ! spec=Expt_11, no=842, id=1256, vol=2.596766e+08
assign (segid "   C" and resid   15 and name   HN) (segid "   C" and resid   15 and name  HB1) 2.818 0.993 3.182 weight 1.000 ! spec=Expt_11, no=842, id=1256, vol=2.596766e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HB2) 3.062 1.172 1.172 weight 1.000 ! spec=Expt_11, no=843, id=1257, vol=1.578521e+08
assign (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   15 and name  HB2) 3.062 1.172 1.172 weight 1.000 ! spec=Expt_11, no=843, id=1257, vol=1.578521e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HB1) 3.167 1.254 1.254 weight 1.000 ! spec=Expt_11, no=844, id=1258, vol=1.287337e+08
assign (segid "   C" and resid   16 and name   HN) (segid "   C" and resid   15 and name  HB1) 3.167 1.254 1.254 weight 1.000 ! spec=Expt_11, no=844, id=1258, vol=1.287337e+08
assign (segid "   A" and resid   16 and name  HG1) (segid "   A" and resid   16 and name   HA) 2.406 0.724 3.594 weight 1.000 ! spec=Expt_11, no=845, id=1259, vol=6.699850e+08
assign (segid "   C" and resid   16 and name  HG1) (segid "   C" and resid   16 and name   HA) 2.406 0.724 3.594 weight 1.000 ! spec=Expt_11, no=845, id=1259, vol=6.699850e+08
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   16 and name   HA) 2.467 0.761 0.761 weight 1.000 ! spec=Expt_11, no=846, id=1260, vol=5.764649e+08
assign (segid "   C" and resid   16 and name  HB2) (segid "   C" and resid   16 and name   HA) 2.467 0.761 0.761 weight 1.000 ! spec=Expt_11, no=846, id=1260, vol=5.764649e+08
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   16 and name   HA) 2.480 0.769 2.769 weight 1.000 ! spec=Expt_11, no=847, id=1261, vol=5.582270e+08
assign (segid "   C" and resid   16 and name  HG2) (segid "   C" and resid   16 and name   HA) 2.480 0.769 2.769 weight 1.000 ! spec=Expt_11, no=847, id=1261, vol=5.582270e+08
assign (segid "   A" and resid   16 and name  HB1) (segid "   A" and resid   16 and name   HA) 2.397 0.718 0.718 weight 1.000 ! spec=Expt_11, no=848, id=1262, vol=6.858515e+08
assign (segid "   C" and resid   16 and name  HB1) (segid "   C" and resid   16 and name   HA) 2.397 0.718 0.718 weight 1.000 ! spec=Expt_11, no=848, id=1262, vol=6.858515e+08
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   17 and name  HG1) 2.408 0.725 3.592 weight 1.000 ! spec=Expt_11, no=849, id=1263, vol=6.676001e+08
assign (segid "   C" and resid   16 and name   HA) (segid "   C" and resid   17 and name  HG1) 2.408 0.725 3.592 weight 1.000 ! spec=Expt_11, no=849, id=1263, vol=6.676001e+08
assign (segid "   A" and resid   16 and name  HB1) (segid "   A" and resid   18 and name  HE1) 3.059 1.170 1.170 weight 1.000 ! spec=Expt_11, no=854, id=1268, vol=1.585178e+08
assign (segid "   C" and resid   16 and name  HB1) (segid "   C" and resid   18 and name  HE1) 3.059 1.170 1.170 weight 1.000 ! spec=Expt_11, no=854, id=1268, vol=1.585178e+08
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   18 and name  HE2) 2.839 1.008 2.008 weight 1.000 ! spec=Expt_11, no=855, id=1269, vol=2.480672e+08
assign (segid "   C" and resid   16 and name  HB2) (segid "   C" and resid   18 and name  HE2) 2.839 1.008 2.008 weight 1.000 ! spec=Expt_11, no=855, id=1269, vol=2.480672e+08
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   18 and name  HG1) 3.024 1.143 2.976 weight 1.000 ! spec=Expt_11, no=856, id=1270, vol=1.698899e+08
assign (segid "   C" and resid   16 and name  HB2) (segid "   C" and resid   18 and name  HG1) 3.024 1.143 2.976 weight 1.000 ! spec=Expt_11, no=856, id=1270, vol=1.698899e+08
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   18 and name  HD2) 2.416 0.729 3.584 weight 1.000 ! spec=Expt_11, no=858, id=1272, vol=6.544281e+08
assign (segid "   C" and resid   16 and name  HG2) (segid "   C" and resid   18 and name  HD2) 2.416 0.729 3.584 weight 1.000 ! spec=Expt_11, no=858, id=1272, vol=6.544281e+08
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   16 and name  HB1) 2.256 0.636 0.636 weight 1.000 ! spec=Expt_11, no=859, id=1273, vol=9.865778e+08
assign (segid "   C" and resid   16 and name  HG2) (segid "   C" and resid   16 and name  HB1) 2.256 0.636 0.636 weight 1.000 ! spec=Expt_11, no=859, id=1273, vol=9.865778e+08
assign (segid "   A" and resid   16 and name  HG1) (segid "   A" and resid   16 and name  HB1) 2.272 0.645 0.645 weight 1.000 ! spec=Expt_11, no=860, id=1274, vol=9.449189e+08
assign (segid "   C" and resid   16 and name  HG1) (segid "   C" and resid   16 and name  HB1) 2.272 0.645 0.645 weight 1.000 ! spec=Expt_11, no=860, id=1274, vol=9.449189e+08
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   16 and name  HB2) 2.088 0.545 2.545 weight 1.000 ! spec=Expt_11, no=861, id=1275, vol=1.567714e+09
assign (segid "   C" and resid   16 and name  HG2) (segid "   C" and resid   16 and name  HB2) 2.088 0.545 2.545 weight 1.000 ! spec=Expt_11, no=861, id=1275, vol=1.567714e+09
assign (segid "   A" and resid   16 and name  HG1) (segid "   A" and resid   16 and name  HB2) 2.063 0.532 1.532 weight 1.000 ! spec=Expt_11, no=862, id=1276, vol=1.686878e+09
assign (segid "   C" and resid   16 and name  HG1) (segid "   C" and resid   16 and name  HB2) 2.063 0.532 1.532 weight 1.000 ! spec=Expt_11, no=862, id=1276, vol=1.686878e+09
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   18 and name  HE2) 3.287 1.351 2.713 weight 1.000 ! spec=Expt_11, no=863, id=1277, vol=1.030754e+08
assign (segid "   C" and resid   16 and name  HG2) (segid "   C" and resid   18 and name  HE2) 3.287 1.351 2.713 weight 1.000 ! spec=Expt_11, no=863, id=1277, vol=1.030754e+08
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   10 and name HG21) 3.083 1.188 1.188 weight 1.000 ! spec=Expt_11, no=869, id=1283, vol=1.512723e+08
    or (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   10 and name HG23)
assign (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   10 and name HG21) 3.083 1.188 1.188 weight 1.000 ! spec=Expt_11, no=869, id=1283, vol=1.512723e+08
    or (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   10 and name HG22)
    or (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   10 and name HG23)
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name   HA) 2.457 0.755 0.755 weight 1.000 ! spec=Expt_11, no=870, id=1284, vol=5.903977e+08
assign (segid "   C" and resid   17 and name  HB1) (segid "   C" and resid   17 and name   HA) 2.457 0.755 0.755 weight 1.000 ! spec=Expt_11, no=870, id=1284, vol=5.903977e+08
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name   HA) 2.386 0.711 0.711 weight 1.000 ! spec=Expt_11, no=871, id=1285, vol=7.054874e+08
assign (segid "   C" and resid   17 and name  HB2) (segid "   C" and resid   17 and name   HA) 2.386 0.711 0.711 weight 1.000 ! spec=Expt_11, no=871, id=1285, vol=7.054874e+08
assign (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   17 and name   HA) 2.752 0.947 0.947 weight 1.000 ! spec=Expt_11, no=873, id=1286, vol=2.994383e+08
assign (segid "   C" and resid   17 and name  HG2) (segid "   C" and resid   17 and name   HA) 2.752 0.947 0.947 weight 1.000 ! spec=Expt_11, no=873, id=1286, vol=2.994383e+08
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   16 and name  HB1) 2.599 0.844 3.401 weight 1.000 ! spec=Expt_11, no=874, id=1287, vol=4.218408e+08
assign (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   16 and name  HB1) 2.599 0.844 3.401 weight 1.000 ! spec=Expt_11, no=874, id=1287, vol=4.218408e+08
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid   17 and name   HA) 2.820 0.994 0.994 weight 1.000 ! spec=Expt_11, no=877, id=1290, vol=2.585555e+08
assign (segid "   C" and resid    8 and name  HB2) (segid "   C" and resid   17 and name   HA) 2.820 0.994 0.994 weight 1.000 ! spec=Expt_11, no=877, id=1290, vol=2.585555e+08
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   10 and name   HB) 3.173 1.258 2.827 weight 1.000 ! spec=Expt_11, no=879, id=1292, vol=1.274483e+08
assign (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   10 and name   HB) 3.173 1.258 2.827 weight 1.000 ! spec=Expt_11, no=879, id=1292, vol=1.274483e+08
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   18 and name   HA) 2.678 0.896 3.322 weight 1.000 ! spec=Expt_11, no=883, id=1296, vol=3.528142e+08
assign (segid "   C" and resid   17 and name  HB2) (segid "   C" and resid   18 and name   HA) 2.678 0.896 3.322 weight 1.000 ! spec=Expt_11, no=883, id=1296, vol=3.528142e+08
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   18 and name   HA) 2.630 0.865 3.370 weight 1.000 ! spec=Expt_11, no=884, id=1297, vol=3.924892e+08
assign (segid "   C" and resid   17 and name  HB1) (segid "   C" and resid   18 and name   HA) 2.630 0.865 3.370 weight 1.000 ! spec=Expt_11, no=884, id=1297, vol=3.924892e+08
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid    8 and name   HA) 2.618 0.857 3.382 weight 1.000 ! spec=Expt_11, no=887, id=1300, vol=4.039036e+08
assign (segid "   C" and resid   17 and name  HB2) (segid "   C" and resid    8 and name   HA) 2.618 0.857 3.382 weight 1.000 ! spec=Expt_11, no=887, id=1300, vol=4.039036e+08
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   16 and name   HA) 2.603 0.847 3.397 weight 1.000 ! spec=Expt_11, no=888, id=1301, vol=4.177530e+08
assign (segid "   C" and resid   17 and name  HB2) (segid "   C" and resid   16 and name   HA) 2.603 0.847 3.397 weight 1.000 ! spec=Expt_11, no=888, id=1301, vol=4.177530e+08
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid   17 and name  HB2) 2.888 1.043 1.043 weight 1.000 ! spec=Expt_11, no=889, id=1302, vol=2.240147e+08
assign (segid "   C" and resid    8 and name  HB2) (segid "   C" and resid   17 and name  HB2) 2.888 1.043 1.043 weight 1.000 ! spec=Expt_11, no=889, id=1302, vol=2.240147e+08
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid   17 and name  HB2) 2.859 1.021 3.141 weight 1.000 ! spec=Expt_11, no=890, id=1303, vol=2.382973e+08
assign (segid "   C" and resid    8 and name  HB1) (segid "   C" and resid   17 and name  HB2) 2.859 1.021 3.141 weight 1.000 ! spec=Expt_11, no=890, id=1303, vol=2.382973e+08
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid    8 and name  HB2) 3.018 1.138 2.982 weight 1.000 ! spec=Expt_11, no=893, id=1306, vol=1.721877e+08
assign (segid "   C" and resid   17 and name  HG1) (segid "   C" and resid    8 and name  HB2) 3.018 1.138 2.982 weight 1.000 ! spec=Expt_11, no=893, id=1306, vol=1.721877e+08
assign (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   17 and name  HB1) 2.353 0.692 0.692 weight 1.000 ! spec=Expt_11, no=894, id=1307, vol=7.654186e+08
assign (segid "   C" and resid   17 and name  HG2) (segid "   C" and resid   17 and name  HB1) 2.353 0.692 0.692 weight 1.000 ! spec=Expt_11, no=894, id=1307, vol=7.654186e+08
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   17 and name  HB1) 2.281 0.650 0.650 weight 1.000 ! spec=Expt_11, no=895, id=1308, vol=9.228930e+08
assign (segid "   C" and resid   17 and name  HG1) (segid "   C" and resid   17 and name  HB1) 2.281 0.650 0.650 weight 1.000 ! spec=Expt_11, no=895, id=1308, vol=9.228930e+08
assign (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   16 and name   HA) 3.147 1.238 2.853 weight 1.000 ! spec=Expt_11, no=899, id=1312, vol=1.337358e+08
assign (segid "   C" and resid   17 and name  HG2) (segid "   C" and resid   16 and name   HA) 3.147 1.238 2.853 weight 1.000 ! spec=Expt_11, no=899, id=1312, vol=1.337358e+08
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   10 and name   HA) 3.329 1.386 1.386 weight 1.000 ! spec=Expt_11, no=901, id=1314, vol=9.546841e+07
assign (segid "   C" and resid   17 and name  HG1) (segid "   C" and resid   10 and name   HA) 3.329 1.386 1.386 weight 1.000 ! spec=Expt_11, no=901, id=1314, vol=9.546841e+07
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   18 and name   HN) 3.354 1.406 1.406 weight 1.000 ! spec=Expt_11, no=905, id=1317, vol=9.126289e+07
assign (segid "   C" and resid   17 and name  HG1) (segid "   C" and resid   18 and name   HN) 3.354 1.406 1.406 weight 1.000 ! spec=Expt_11, no=905, id=1317, vol=9.126289e+07
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   28 and name   HZ) 3.003 1.127 2.997 weight 1.000 ! spec=Expt_11, no=908, id=1319, vol=1.773124e+08
assign (segid "   C" and resid   19 and name   HA) (segid "   C" and resid   28 and name   HZ) 3.003 1.127 2.997 weight 1.000 ! spec=Expt_11, no=908, id=1319, vol=1.773124e+08
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid    8 and name   HA) 1.992 0.496 0.496 weight 1.000 ! spec=Expt_11, no=911, id=1321, vol=2.082808e+09
assign (segid "   C" and resid   19 and name   HA) (segid "   C" and resid    8 and name   HA) 1.992 0.496 0.496 weight 1.000 ! spec=Expt_11, no=911, id=1321, vol=2.082808e+09
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name   HA) 2.254 0.635 0.635 weight 1.000 ! spec=Expt_11, no=913, id=1322, vol=9.914562e+08
assign (segid "   C" and resid   19 and name  HB2) (segid "   C" and resid   19 and name   HA) 2.254 0.635 0.635 weight 1.000 ! spec=Expt_11, no=913, id=1322, vol=9.914562e+08
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid    8 and name  HB1) 2.454 0.753 3.546 weight 1.000 ! spec=Expt_11, no=914, id=1323, vol=5.952127e+08
assign (segid "   C" and resid   19 and name   HA) (segid "   C" and resid    8 and name  HB1) 2.454 0.753 3.546 weight 1.000 ! spec=Expt_11, no=914, id=1323, vol=5.952127e+08
assign (segid "   A" and resid   18 and name  HD2) (segid "   A" and resid   18 and name   HA) 2.285 0.652 3.715 weight 1.000 ! spec=Expt_11, no=915, id=1324, vol=9.143443e+08
assign (segid "   C" and resid   18 and name  HD2) (segid "   C" and resid   18 and name   HA) 2.285 0.652 3.715 weight 1.000 ! spec=Expt_11, no=915, id=1324, vol=9.143443e+08
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name  HB1) 2.182 0.595 0.595 weight 1.000 ! spec=Expt_11, no=916, id=1325, vol=1.205363e+09
assign (segid "   C" and resid   18 and name   HA) (segid "   C" and resid   18 and name  HB1) 2.182 0.595 0.595 weight 1.000 ! spec=Expt_11, no=916, id=1325, vol=1.205363e+09
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name  HD1) 2.150 0.578 3.850 weight 1.000 ! spec=Expt_11, no=917, id=1326, vol=1.317487e+09
assign (segid "   C" and resid   18 and name   HA) (segid "   C" and resid   18 and name  HD1) 2.150 0.578 3.850 weight 1.000 ! spec=Expt_11, no=917, id=1326, vol=1.317487e+09
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   18 and name  HG1) 2.698 0.910 0.910 weight 1.000 ! spec=Expt_11, no=921, id=1327, vol=3.372550e+08
assign (segid "   C" and resid   18 and name  HB1) (segid "   C" and resid   18 and name  HG1) 2.698 0.910 0.910 weight 1.000 ! spec=Expt_11, no=921, id=1327, vol=3.372550e+08
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   30 and name  HB1) 2.871 1.031 3.129 weight 1.000 ! spec=Expt_11, no=926, id=1332, vol=2.320217e+08
assign (segid "   C" and resid   18 and name  HB1) (segid "   C" and resid   30 and name  HB1) 2.871 1.031 3.129 weight 1.000 ! spec=Expt_11, no=926, id=1332, vol=2.320217e+08
assign (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid   18 and name  HE2) 3.111 1.210 2.889 weight 1.000 ! spec=Expt_11, no=929, id=1335, vol=1.433747e+08
assign (segid "   C" and resid   18 and name  HB2) (segid "   C" and resid   18 and name  HE2) 3.111 1.210 2.889 weight 1.000 ! spec=Expt_11, no=929, id=1335, vol=1.433747e+08
assign (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid   30 and name   HA) 3.373 1.422 1.422 weight 1.000 ! spec=Expt_11, no=931, id=1337, vol=8.823541e+07
assign (segid "   C" and resid   18 and name  HB2) (segid "   C" and resid   30 and name   HA) 3.373 1.422 1.422 weight 1.000 ! spec=Expt_11, no=931, id=1337, vol=8.823541e+07
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   30 and name   HA) 3.383 1.430 1.430 weight 1.000 ! spec=Expt_11, no=932, id=1338, vol=8.674393e+07
assign (segid "   C" and resid   18 and name  HB1) (segid "   C" and resid   30 and name   HA) 3.383 1.430 1.430 weight 1.000 ! spec=Expt_11, no=932, id=1338, vol=8.674393e+07
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   28 and name  HE1) 2.808 0.986 0.986 weight 1.000 ! spec=Expt_11, no=935, id=1341, vol=2.652561e+08
    or (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   18 and name  HB1) (segid "   C" and resid   28 and name  HE1) 2.808 0.986 0.986 weight 1.000 ! spec=Expt_11, no=935, id=1341, vol=2.652561e+08
    or (segid "   C" and resid   18 and name  HB1) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB1) 3.040 1.155 1.155 weight 1.000 ! spec=Expt_11, no=937, id=1343, vol=1.647987e+08
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   18 and name  HB1) 3.040 1.155 1.155 weight 1.000 ! spec=Expt_11, no=937, id=1343, vol=1.647987e+08
assign (segid "   A" and resid   18 and name  HD1) (segid "   A" and resid   18 and name  HB2) 2.399 0.719 3.601 weight 1.000 ! spec=Expt_11, no=943, id=1347, vol=6.824795e+08
assign (segid "   C" and resid   18 and name  HD1) (segid "   C" and resid   18 and name  HB2) 2.399 0.719 3.601 weight 1.000 ! spec=Expt_11, no=943, id=1347, vol=6.824795e+08
assign (segid "   A" and resid   18 and name  HD1) (segid "   A" and resid   18 and name  HG1) 2.439 0.744 0.744 weight 1.000 ! spec=Expt_11, no=944, id=1348, vol=6.177303e+08
assign (segid "   C" and resid   18 and name  HD1) (segid "   C" and resid   18 and name  HG1) 2.439 0.744 0.744 weight 1.000 ! spec=Expt_11, no=944, id=1348, vol=6.177303e+08
assign (segid "   A" and resid   18 and name  HD1) (segid "   A" and resid   16 and name  HG2) 2.647 0.876 3.353 weight 1.000 ! spec=Expt_11, no=946, id=1350, vol=3.775866e+08
assign (segid "   C" and resid   18 and name  HD1) (segid "   C" and resid   16 and name  HG2) 2.647 0.876 3.353 weight 1.000 ! spec=Expt_11, no=946, id=1350, vol=3.775866e+08
assign (segid "   A" and resid   18 and name  HD1) (segid "   A" and resid   18 and name  HE1) 2.302 0.662 0.662 weight 1.000 ! spec=Expt_11, no=949, id=1353, vol=8.746474e+08
assign (segid "   C" and resid   18 and name  HD1) (segid "   C" and resid   18 and name  HE1) 2.302 0.662 0.662 weight 1.000 ! spec=Expt_11, no=949, id=1353, vol=8.746474e+08
assign (segid "   A" and resid   18 and name  HD2) (segid "   A" and resid   30 and name  HB2) 3.289 1.353 2.353 weight 1.000 ! spec=Expt_11, no=951, id=1355, vol=1.026191e+08
assign (segid "   C" and resid   18 and name  HD2) (segid "   C" and resid   30 and name  HB2) 3.289 1.353 2.353 weight 1.000 ! spec=Expt_11, no=951, id=1355, vol=1.026191e+08
assign (segid "   A" and resid   18 and name  HD1) (segid "   A" and resid   30 and name  HB2) 2.925 1.069 3.075 weight 1.000 ! spec=Expt_11, no=952, id=1356, vol=2.076928e+08
assign (segid "   C" and resid   18 and name  HD1) (segid "   C" and resid   30 and name  HB2) 2.925 1.069 3.075 weight 1.000 ! spec=Expt_11, no=952, id=1356, vol=2.076928e+08
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name  HD2) 2.640 0.872 3.360 weight 1.000 ! spec=Expt_11, no=954, id=1358, vol=3.836106e+08
assign (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   18 and name  HD2) 2.640 0.872 3.360 weight 1.000 ! spec=Expt_11, no=954, id=1358, vol=3.836106e+08
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name  HD1) 2.563 0.821 3.437 weight 1.000 ! spec=Expt_11, no=955, id=1359, vol=4.586349e+08
assign (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   18 and name  HD1) 2.563 0.821 3.437 weight 1.000 ! spec=Expt_11, no=955, id=1359, vol=4.586349e+08
assign (segid "   A" and resid   18 and name  HD2) (segid "   A" and resid   16 and name   HA) 3.037 1.153 2.153 weight 1.000 ! spec=Expt_11, no=956, id=1360, vol=1.657938e+08
assign (segid "   C" and resid   18 and name  HD2) (segid "   C" and resid   16 and name   HA) 3.037 1.153 2.153 weight 1.000 ! spec=Expt_11, no=956, id=1360, vol=1.657938e+08
assign (segid "   A" and resid   18 and name  HD1) (segid "   A" and resid   16 and name   HA) 2.505 0.785 3.495 weight 1.000 ! spec=Expt_11, no=957, id=1361, vol=5.258503e+08
assign (segid "   C" and resid   18 and name  HD1) (segid "   C" and resid   16 and name   HA) 2.505 0.785 3.495 weight 1.000 ! spec=Expt_11, no=957, id=1361, vol=5.258503e+08
assign (segid "   A" and resid   18 and name  HD1) (segid "   A" and resid   18 and name  HE2) 2.011 0.506 3.989 weight 1.000 ! spec=Expt_11, no=965, id=1366, vol=1.963978e+09
assign (segid "   C" and resid   18 and name  HD1) (segid "   C" and resid   18 and name  HE2) 2.011 0.506 3.989 weight 1.000 ! spec=Expt_11, no=965, id=1366, vol=1.963978e+09
assign (segid "   A" and resid   18 and name  HD2) (segid "   A" and resid   18 and name  HE1) 2.341 0.685 0.685 weight 1.000 ! spec=Expt_11, no=966, id=1367, vol=7.892523e+08
assign (segid "   C" and resid   18 and name  HD2) (segid "   C" and resid   18 and name  HE1) 2.341 0.685 0.685 weight 1.000 ! spec=Expt_11, no=966, id=1367, vol=7.892523e+08
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   18 and name  HE1) 2.499 0.781 1.781 weight 1.000 ! spec=Expt_11, no=968, id=1368, vol=5.337708e+08
assign (segid "   C" and resid   16 and name  HB2) (segid "   C" and resid   18 and name  HE1) 2.499 0.781 1.781 weight 1.000 ! spec=Expt_11, no=968, id=1368, vol=5.337708e+08
assign (segid "   A" and resid   18 and name  HD2) (segid "   A" and resid   18 and name  HE2) 2.185 0.597 0.597 weight 1.000 ! spec=Expt_11, no=969, id=1369, vol=1.195182e+09
assign (segid "   C" and resid   18 and name  HD2) (segid "   C" and resid   18 and name  HE2) 2.185 0.597 0.597 weight 1.000 ! spec=Expt_11, no=969, id=1369, vol=1.195182e+09
assign (segid "   A" and resid   18 and name  HE2) (segid "   A" and resid   16 and name  HB1) 2.347 0.689 3.653 weight 1.000 ! spec=Expt_11, no=970, id=1370, vol=7.775179e+08
assign (segid "   C" and resid   18 and name  HE2) (segid "   C" and resid   16 and name  HB1) 2.347 0.689 3.653 weight 1.000 ! spec=Expt_11, no=970, id=1370, vol=7.775179e+08
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   18 and name  HE1) 2.828 1.000 3.172 weight 1.000 ! spec=Expt_11, no=975, id=1374, vol=2.540151e+08
assign (segid "   C" and resid   16 and name  HG2) (segid "   C" and resid   18 and name  HE1) 2.828 1.000 3.172 weight 1.000 ! spec=Expt_11, no=975, id=1374, vol=2.540151e+08
assign (segid "   A" and resid   18 and name  HE2) (segid "   A" and resid   16 and name   HA) 2.547 0.811 3.453 weight 1.000 ! spec=Expt_11, no=977, id=1376, vol=4.764135e+08
assign (segid "   C" and resid   18 and name  HE2) (segid "   C" and resid   16 and name   HA) 2.547 0.811 3.453 weight 1.000 ! spec=Expt_11, no=977, id=1376, vol=4.764135e+08
assign (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   16 and name  HB1) 2.490 0.775 3.510 weight 1.000 ! spec=Expt_11, no=979, id=1378, vol=5.451544e+08
assign (segid "   C" and resid   18 and name  HG2) (segid "   C" and resid   16 and name  HB1) 2.490 0.775 3.510 weight 1.000 ! spec=Expt_11, no=979, id=1378, vol=5.451544e+08
assign (segid "   A" and resid   18 and name  HD2) (segid "   A" and resid   18 and name  HG1) 2.324 0.675 0.675 weight 1.000 ! spec=Expt_11, no=980, id=1379, vol=8.249661e+08
assign (segid "   C" and resid   18 and name  HD2) (segid "   C" and resid   18 and name  HG1) 2.324 0.675 0.675 weight 1.000 ! spec=Expt_11, no=980, id=1379, vol=8.249661e+08
assign (segid "   A" and resid   16 and name  HB1) (segid "   A" and resid   18 and name  HG1) 2.467 0.761 3.533 weight 1.000 ! spec=Expt_11, no=981, id=1380, vol=5.770154e+08
assign (segid "   C" and resid   16 and name  HB1) (segid "   C" and resid   18 and name  HG1) 2.467 0.761 3.533 weight 1.000 ! spec=Expt_11, no=981, id=1380, vol=5.770154e+08
assign (segid "   A" and resid   18 and name  HG1) (segid "   A" and resid   11 and name  HB1) 3.039 1.155 2.961 weight 1.000 ! spec=Expt_11, no=983, id=1381, vol=1.650037e+08
assign (segid "   C" and resid   18 and name  HG1) (segid "   C" and resid   11 and name  HB1) 3.039 1.155 2.961 weight 1.000 ! spec=Expt_11, no=983, id=1381, vol=1.650037e+08
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   18 and name  HG2) 3.031 1.148 2.969 weight 1.000 ! spec=Expt_11, no=984, id=1382, vol=1.677748e+08
assign (segid "   C" and resid   11 and name  HB1) (segid "   C" and resid   18 and name  HG2) 3.031 1.148 2.969 weight 1.000 ! spec=Expt_11, no=984, id=1382, vol=1.677748e+08
assign (segid "   A" and resid   18 and name  HG1) (segid "   A" and resid   30 and name  HB1) 3.031 1.148 1.148 weight 1.000 ! spec=Expt_11, no=985, id=1383, vol=1.677748e+08
assign (segid "   C" and resid   18 and name  HG1) (segid "   C" and resid   30 and name  HB1) 3.031 1.148 1.148 weight 1.000 ! spec=Expt_11, no=985, id=1383, vol=1.677748e+08
assign (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   18 and name  HE1) 3.069 1.177 1.177 weight 1.000 ! spec=Expt_11, no=986, id=1384, vol=1.556919e+08
assign (segid "   C" and resid   18 and name  HG2) (segid "   C" and resid   18 and name  HE1) 3.069 1.177 1.177 weight 1.000 ! spec=Expt_11, no=986, id=1384, vol=1.556919e+08
assign (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   18 and name  HE2) 3.139 1.232 1.232 weight 1.000 ! spec=Expt_11, no=987, id=1385, vol=1.358753e+08
assign (segid "   C" and resid   18 and name  HG2) (segid "   C" and resid   18 and name  HE2) 3.139 1.232 1.232 weight 1.000 ! spec=Expt_11, no=987, id=1385, vol=1.358753e+08
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   18 and name  HG2) 3.078 1.184 1.184 weight 1.000 ! spec=Expt_11, no=989, id=1387, vol=1.529519e+08
assign (segid "   C" and resid   30 and name  HB2) (segid "   C" and resid   18 and name  HG2) 3.078 1.184 1.184 weight 1.000 ! spec=Expt_11, no=989, id=1387, vol=1.529519e+08
assign (segid "   A" and resid   18 and name  HG1) (segid "   A" and resid   30 and name  HB2) 3.333 1.388 1.388 weight 1.000 ! spec=Expt_11, no=990, id=1388, vol=9.489008e+07
assign (segid "   C" and resid   18 and name  HG1) (segid "   C" and resid   30 and name  HB2) 3.333 1.388 1.388 weight 1.000 ! spec=Expt_11, no=990, id=1388, vol=9.489008e+07
assign (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   18 and name   HA) 3.022 1.141 1.141 weight 1.000 ! spec=Expt_11, no=991, id=1389, vol=1.708453e+08
assign (segid "   C" and resid   18 and name  HG2) (segid "   C" and resid   18 and name   HA) 3.022 1.141 1.141 weight 1.000 ! spec=Expt_11, no=991, id=1389, vol=1.708453e+08
assign (segid "   A" and resid   18 and name  HG1) (segid "   A" and resid   17 and name   HA) 2.867 1.028 3.133 weight 1.000 ! spec=Expt_11, no=992, id=1390, vol=2.339524e+08
assign (segid "   C" and resid   18 and name  HG1) (segid "   C" and resid   17 and name   HA) 2.867 1.028 3.133 weight 1.000 ! spec=Expt_11, no=992, id=1390, vol=2.339524e+08
assign (segid "   A" and resid   18 and name  HG1) (segid "   A" and resid   11 and name   HA) 3.102 1.203 2.898 weight 1.000 ! spec=Expt_11, no=993, id=1391, vol=1.459284e+08
assign (segid "   C" and resid   18 and name  HG1) (segid "   C" and resid   11 and name   HA) 3.102 1.203 2.898 weight 1.000 ! spec=Expt_11, no=993, id=1391, vol=1.459284e+08
assign (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   11 and name   HA) 3.287 1.350 2.713 weight 1.000 ! spec=Expt_11, no=994, id=1392, vol=1.031011e+08
assign (segid "   C" and resid   18 and name  HG2) (segid "   C" and resid   11 and name   HA) 3.287 1.350 2.713 weight 1.000 ! spec=Expt_11, no=994, id=1392, vol=1.031011e+08
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name  HG2) 3.029 1.147 2.971 weight 1.000 ! spec=Expt_11, no=995, id=1393, vol=1.682461e+08
assign (segid "   C" and resid   17 and name   HA) (segid "   C" and resid   18 and name  HG2) 3.029 1.147 2.971 weight 1.000 ! spec=Expt_11, no=995, id=1393, vol=1.682461e+08
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   18 and name  HG1) 3.172 1.258 2.258 weight 1.000 ! spec=Expt_11, no=996, id=1394, vol=1.276596e+08
assign (segid "   C" and resid   11 and name   HN) (segid "   C" and resid   18 and name  HG1) 3.172 1.258 2.258 weight 1.000 ! spec=Expt_11, no=996, id=1394, vol=1.276596e+08
assign (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   11 and name   HN) 3.488 1.521 1.521 weight 1.000 ! spec=Expt_11, no=998, id=1396, vol=7.214185e+07
assign (segid "   C" and resid   18 and name  HG2) (segid "   C" and resid   11 and name   HN) 3.488 1.521 1.521 weight 1.000 ! spec=Expt_11, no=998, id=1396, vol=7.214185e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HG2) 3.551 1.576 1.576 weight 1.000 ! spec=Expt_11, no=999, id=1397, vol=6.488975e+07
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   18 and name  HG2) 3.551 1.576 1.576 weight 1.000 ! spec=Expt_11, no=999, id=1397, vol=6.488975e+07
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid    8 and name   HA) 2.945 1.084 3.055 weight 1.000 ! spec=Expt_11, no=1000, id=1398, vol=1.993911e+08
assign (segid "   C" and resid    9 and name  HB1) (segid "   C" and resid    8 and name   HA) 2.945 1.084 3.055 weight 1.000 ! spec=Expt_11, no=1000, id=1398, vol=1.993911e+08
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid    8 and name   HA) 2.624 0.861 0.861 weight 1.000 ! spec=Expt_11, no=1003, id=1400, vol=3.979222e+08
assign (segid "   C" and resid   19 and name  HB2) (segid "   C" and resid    8 and name   HA) 2.624 0.861 0.861 weight 1.000 ! spec=Expt_11, no=1003, id=1400, vol=3.979222e+08
assign (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   20 and name   HA) 2.261 0.639 0.639 weight 1.000 ! spec=Expt_11, no=1004, id=1401, vol=9.731194e+08
assign (segid "   C" and resid   20 and name  HG2) (segid "   C" and resid   20 and name   HA) 2.261 0.639 0.639 weight 1.000 ! spec=Expt_11, no=1004, id=1401, vol=9.731194e+08
assign (segid "   A" and resid   20 and name  HG1) (segid "   A" and resid   20 and name   HA) 2.399 0.719 3.601 weight 1.000 ! spec=Expt_11, no=1005, id=1402, vol=6.826538e+08
assign (segid "   C" and resid   20 and name  HG1) (segid "   C" and resid   20 and name   HA) 2.399 0.719 3.601 weight 1.000 ! spec=Expt_11, no=1005, id=1402, vol=6.826538e+08
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   28 and name   HZ) 3.046 1.160 2.954 weight 1.000 ! spec=Expt_11, no=1007, id=1404, vol=1.626836e+08
assign (segid "   C" and resid   20 and name   HA) (segid "   C" and resid   28 and name   HZ) 3.046 1.160 2.954 weight 1.000 ! spec=Expt_11, no=1007, id=1404, vol=1.626836e+08
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   28 and name  HE1) 3.314 1.373 1.373 weight 1.000 ! spec=Expt_11, no=1009, id=1405, vol=9.807015e+07
    or (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   20 and name   HA) (segid "   C" and resid   28 and name  HE1) 3.314 1.373 1.373 weight 1.000 ! spec=Expt_11, no=1009, id=1405, vol=9.807015e+07
    or (segid "   C" and resid   20 and name   HA) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name  HB2) 2.772 0.960 0.960 weight 1.000 ! spec=Expt_11, no=1012, id=1407, vol=2.867850e+08
assign (segid "   C" and resid   20 and name   HN) (segid "   C" and resid   20 and name  HB2) 2.772 0.960 0.960 weight 1.000 ! spec=Expt_11, no=1012, id=1407, vol=2.867850e+08
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name  HD2) 2.049 0.525 0.525 weight 1.000 ! spec=Expt_11, no=1013, id=1408, vol=1.755563e+09
assign (segid "   C" and resid   20 and name  HB2) (segid "   C" and resid   20 and name  HD2) 2.049 0.525 0.525 weight 1.000 ! spec=Expt_11, no=1013, id=1408, vol=1.755563e+09
assign (segid "   A" and resid   20 and name  HD2) (segid "   A" and resid   20 and name  HG1) 2.156 0.581 0.581 weight 1.000 ! spec=Expt_11, no=1014, id=1409, vol=1.295768e+09
assign (segid "   C" and resid   20 and name  HD2) (segid "   C" and resid   20 and name  HG1) 2.156 0.581 0.581 weight 1.000 ! spec=Expt_11, no=1014, id=1409, vol=1.295768e+09
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   22 and name   HA) 2.987 1.115 3.013 weight 1.000 ! spec=Expt_11, no=1019, id=1413, vol=1.829879e+08
assign (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   22 and name   HA) 2.987 1.115 3.013 weight 1.000 ! spec=Expt_11, no=1019, id=1413, vol=1.829879e+08
assign (segid "   A" and resid   21 and name  HA2) (segid "   A" and resid   22 and name   HA) 3.035 1.151 2.965 weight 1.000 ! spec=Expt_11, no=1020, id=1414, vol=1.664165e+08
assign (segid "   C" and resid   21 and name  HA2) (segid "   C" and resid   22 and name   HA) 3.035 1.151 2.965 weight 1.000 ! spec=Expt_11, no=1020, id=1414, vol=1.664165e+08
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   28 and name  HE1) 3.229 1.303 1.303 weight 1.000 ! spec=Expt_11, no=1022, id=1416, vol=1.147471e+08
    or (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   28 and name  HE1) 3.229 1.303 1.303 weight 1.000 ! spec=Expt_11, no=1022, id=1416, vol=1.147471e+08
    or (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   21 and name  HA2) (segid "   A" and resid   28 and name  HE1) 2.922 1.067 3.078 weight 1.000 ! spec=Expt_11, no=1023, id=1417, vol=2.089633e+08
    or (segid "   A" and resid   21 and name  HA2) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   21 and name  HA2) (segid "   C" and resid   28 and name  HE1) 2.922 1.067 3.078 weight 1.000 ! spec=Expt_11, no=1023, id=1417, vol=2.089633e+08
    or (segid "   C" and resid   21 and name  HA2) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   28 and name   HZ) 3.204 1.284 1.284 weight 1.000 ! spec=Expt_11, no=1024, id=1418, vol=1.200750e+08
assign (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   28 and name   HZ) 3.204 1.284 1.284 weight 1.000 ! spec=Expt_11, no=1024, id=1418, vol=1.200750e+08
assign (segid "   A" and resid   21 and name  HA2) (segid "   A" and resid   28 and name   HZ) 3.050 1.163 1.163 weight 1.000 ! spec=Expt_11, no=1025, id=1419, vol=1.614487e+08
assign (segid "   C" and resid   21 and name  HA2) (segid "   C" and resid   28 and name   HZ) 3.050 1.163 1.163 weight 1.000 ! spec=Expt_11, no=1025, id=1419, vol=1.614487e+08
assign (segid "   A" and resid   21 and name  HA2) (segid "   A" and resid   31 and name  HB1) 3.145 1.237 1.237 weight 1.000 ! spec=Expt_11, no=1028, id=1422, vol=1.342840e+08
assign (segid "   C" and resid   21 and name  HA2) (segid "   C" and resid   31 and name  HB1) 3.145 1.237 1.237 weight 1.000 ! spec=Expt_11, no=1028, id=1422, vol=1.342840e+08
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   29 and name HG22) 2.399 0.719 3.601 weight 1.000 ! spec=Expt_11, no=1034, id=1425, vol=6.818082e+08
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   11 and name   HA) (segid "   C" and resid   29 and name HG22) 2.399 0.719 3.601 weight 1.000 ! spec=Expt_11, no=1034, id=1425, vol=6.818082e+08
    or (segid "   C" and resid   11 and name   HA) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   11 and name   HA) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   22 and name   HB) 2.123 0.563 0.563 weight 1.000 ! spec=Expt_11, no=1040, id=1431, vol=1.421850e+09
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   22 and name   HB)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   22 and name   HB)
assign (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   22 and name   HB) 2.123 0.563 0.563 weight 1.000 ! spec=Expt_11, no=1040, id=1431, vol=1.421850e+09
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   22 and name   HB)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   22 and name   HB)
assign (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   22 and name HG11) 1.955 0.478 0.478 weight 1.000 ! spec=Expt_11, no=1041, id=1432, vol=2.326148e+09
assign (segid "   C" and resid   22 and name HG12) (segid "   C" and resid   22 and name HG11) 1.955 0.478 0.478 weight 1.000 ! spec=Expt_11, no=1041, id=1432, vol=2.326148e+09
assign (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   22 and name   HA) 3.118 1.215 1.215 weight 1.000 ! spec=Expt_11, no=1044, id=1435, vol=1.414671e+08
assign (segid "   C" and resid   22 and name HG12) (segid "   C" and resid   22 and name   HA) 3.118 1.215 1.215 weight 1.000 ! spec=Expt_11, no=1044, id=1435, vol=1.414671e+08
assign (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   23 and name   HA) 3.400 1.445 1.445 weight 1.000 ! spec=Expt_11, no=1046, id=1436, vol=8.410885e+07
assign (segid "   C" and resid   22 and name HG12) (segid "   C" and resid   23 and name   HA) 3.400 1.445 1.445 weight 1.000 ! spec=Expt_11, no=1046, id=1436, vol=8.410885e+07
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG11) 2.736 0.936 0.936 weight 1.000 ! spec=Expt_11, no=1050, id=1439, vol=3.097797e+08
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   22 and name HG11) 2.736 0.936 0.936 weight 1.000 ! spec=Expt_11, no=1050, id=1439, vol=3.097797e+08
assign (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   29 and name   HN) 3.192 1.273 1.273 weight 1.000 ! spec=Expt_11, no=1052, id=1440, vol=1.229944e+08
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   29 and name   HN)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   29 and name   HN)
assign (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   29 and name   HN) 3.192 1.273 1.273 weight 1.000 ! spec=Expt_11, no=1052, id=1440, vol=1.229944e+08
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   29 and name   HN)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   29 and name   HN)
assign (segid "   A" and resid   22 and name HD12) (segid "   C" and resid   41 and name  HB2) 3.064 1.173 2.936 weight 1.000 ! spec=Expt_11, no=1055, id=1442, vol=1.571544e+08
    or (segid "   A" and resid   22 and name HD11) (segid "   C" and resid   41 and name  HB2)
    or (segid "   A" and resid   22 and name HD13) (segid "   C" and resid   41 and name  HB2)
assign (segid "   C" and resid   22 and name HD12) (segid "   A" and resid   41 and name  HB2) 3.064 1.173 2.936 weight 1.000 ! spec=Expt_11, no=1055, id=1442, vol=1.571544e+08
    or (segid "   C" and resid   22 and name HD11) (segid "   A" and resid   41 and name  HB2)
    or (segid "   C" and resid   22 and name HD13) (segid "   A" and resid   41 and name  HB2)
assign (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   34 and name   HA) 2.534 0.803 3.466 weight 1.000 ! spec=Expt_11, no=1056, id=1443, vol=4.909519e+08
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   34 and name   HA)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   34 and name   HA)
assign (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   34 and name   HA) 2.534 0.803 3.466 weight 1.000 ! spec=Expt_11, no=1056, id=1443, vol=4.909519e+08
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   34 and name   HA)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   34 and name   HA)
assign (segid "   A" and resid   22 and name HD12) (segid "   C" and resid   40 and name HG21) 2.005 0.502 0.502 weight 1.000 ! spec=Expt_11, no=1057, id=1444, vol=2.004025e+09
    or (segid "   A" and resid   22 and name HD12) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   22 and name HD12) (segid "   C" and resid   40 and name HG23)
    or (segid "   A" and resid   22 and name HD11) (segid "   C" and resid   40 and name HG21)
    or (segid "   A" and resid   22 and name HD11) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   22 and name HD11) (segid "   C" and resid   40 and name HG23)
    or (segid "   A" and resid   22 and name HD13) (segid "   C" and resid   40 and name HG21)
    or (segid "   A" and resid   22 and name HD13) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   22 and name HD13) (segid "   C" and resid   40 and name HG23)
assign (segid "   C" and resid   22 and name HD12) (segid "   A" and resid   40 and name HG21) 2.005 0.502 0.502 weight 1.000 ! spec=Expt_11, no=1057, id=1444, vol=2.004025e+09
    or (segid "   C" and resid   22 and name HD12) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   22 and name HD12) (segid "   A" and resid   40 and name HG23)
    or (segid "   C" and resid   22 and name HD11) (segid "   A" and resid   40 and name HG21)
    or (segid "   C" and resid   22 and name HD11) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   22 and name HD11) (segid "   A" and resid   40 and name HG23)
    or (segid "   C" and resid   22 and name HD13) (segid "   A" and resid   40 and name HG21)
    or (segid "   C" and resid   22 and name HD13) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   22 and name HD13) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   29 and name   HB) 2.270 0.644 3.730 weight 1.000 ! spec=Expt_11, no=1058, id=1445, vol=9.513782e+08
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   29 and name   HB)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   29 and name   HB)
assign (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   29 and name   HB) 2.270 0.644 3.730 weight 1.000 ! spec=Expt_11, no=1058, id=1445, vol=9.513782e+08
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   29 and name   HB)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   29 and name   HB)
assign (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   34 and name  HG1) 2.307 0.665 0.665 weight 1.000 ! spec=Expt_11, no=1059, id=1446, vol=8.620209e+08
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   34 and name  HG1)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   34 and name  HG1)
assign (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   34 and name  HG1) 2.307 0.665 0.665 weight 1.000 ! spec=Expt_11, no=1059, id=1446, vol=8.620209e+08
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   34 and name  HG1)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   34 and name  HG1)
assign (segid "   A" and resid   22 and name HD12) (segid "   C" and resid   37 and name   HB) 2.769 0.959 0.959 weight 1.000 ! spec=Expt_11, no=1061, id=1448, vol=2.882409e+08
    or (segid "   A" and resid   22 and name HD11) (segid "   C" and resid   37 and name   HB)
    or (segid "   A" and resid   22 and name HD13) (segid "   C" and resid   37 and name   HB)
assign (segid "   C" and resid   22 and name HD12) (segid "   A" and resid   37 and name   HB) 2.769 0.959 0.959 weight 1.000 ! spec=Expt_11, no=1061, id=1448, vol=2.882409e+08
    or (segid "   C" and resid   22 and name HD11) (segid "   A" and resid   37 and name   HB)
    or (segid "   C" and resid   22 and name HD13) (segid "   A" and resid   37 and name   HB)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   29 and name   HN) 2.923 1.068 3.077 weight 1.000 ! spec=Expt_11, no=1062, id=1449, vol=2.086087e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   29 and name   HN)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   29 and name   HN)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   29 and name   HN) 2.923 1.068 3.077 weight 1.000 ! spec=Expt_11, no=1062, id=1449, vol=2.086087e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   29 and name   HN)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   29 and name   HN)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   28 and name  HE1) 3.537 1.563 2.463 weight 1.000 ! spec=Expt_11, no=1063, id=1450, vol=6.643941e+07
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   28 and name  HE2)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   28 and name  HE1)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   28 and name  HE2)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   28 and name  HE1)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   28 and name  HE1) 3.537 1.563 2.463 weight 1.000 ! spec=Expt_11, no=1063, id=1450, vol=6.643941e+07
    or (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   28 and name  HE2)
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   28 and name  HE1)
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   28 and name  HE2)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   28 and name  HE1)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   23 and name  HD2) 3.534 1.561 1.561 weight 1.000 ! spec=Expt_11, no=1064, id=1451, vol=6.674759e+07
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   23 and name  HD2)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   23 and name  HD2)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   23 and name  HD2) 3.534 1.561 1.561 weight 1.000 ! spec=Expt_11, no=1064, id=1451, vol=6.674759e+07
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   23 and name  HD2)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   23 and name  HD2)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   21 and name  HA2) 3.016 1.137 1.137 weight 1.000 ! spec=Expt_11, no=1066, id=1453, vol=1.726006e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   21 and name  HA2)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   21 and name  HA2)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   21 and name  HA2) 3.016 1.137 1.137 weight 1.000 ! spec=Expt_11, no=1066, id=1453, vol=1.726006e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   21 and name  HA2)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   21 and name  HA2)
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   22 and name HG22) 2.936 1.077 1.077 weight 1.000 ! spec=Expt_11, no=1067, id=1454, vol=2.031373e+08
    or (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   22 and name HG21)
    or (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   22 and name HG23)
assign (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   22 and name HG22) 2.936 1.077 1.077 weight 1.000 ! spec=Expt_11, no=1067, id=1454, vol=2.031373e+08
    or (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   22 and name HG21)
    or (segid "   C" and resid   21 and name  HA1) (segid "   C" and resid   22 and name HG23)
assign (segid "   A" and resid   22 and name HG22) (segid "   C" and resid   37 and name   HA) 3.149 1.240 1.240 weight 1.000 ! spec=Expt_11, no=1068, id=1455, vol=1.332073e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   C" and resid   37 and name   HA)
    or (segid "   A" and resid   22 and name HG23) (segid "   C" and resid   37 and name   HA)
assign (segid "   C" and resid   22 and name HG22) (segid "   A" and resid   37 and name   HA) 3.149 1.240 1.240 weight 1.000 ! spec=Expt_11, no=1068, id=1455, vol=1.332073e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   A" and resid   37 and name   HA)
    or (segid "   C" and resid   22 and name HG23) (segid "   A" and resid   37 and name   HA)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   34 and name  HG1) 2.236 0.625 0.625 weight 1.000 ! spec=Expt_11, no=1071, id=1458, vol=1.040177e+09
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   34 and name  HG1)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   34 and name  HG1)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   34 and name  HG1) 2.236 0.625 0.625 weight 1.000 ! spec=Expt_11, no=1071, id=1458, vol=1.040177e+09
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   34 and name  HG1)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   34 and name  HG1)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   31 and name  HB2) 2.452 0.751 3.548 weight 1.000 ! spec=Expt_11, no=1072, id=1459, vol=5.988850e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   31 and name  HB2)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   31 and name  HB2)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   31 and name  HB2) 2.452 0.751 3.548 weight 1.000 ! spec=Expt_11, no=1072, id=1459, vol=5.988850e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   31 and name  HB2)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   31 and name  HB2)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   29 and name   HB) 2.436 0.742 3.564 weight 1.000 ! spec=Expt_11, no=1073, id=1460, vol=6.218815e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   29 and name   HB)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   29 and name   HB)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   29 and name   HB) 2.436 0.742 3.564 weight 1.000 ! spec=Expt_11, no=1073, id=1460, vol=6.218815e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   29 and name   HB)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   29 and name   HB)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name HG12) 2.208 0.610 1.610 weight 1.000 ! spec=Expt_11, no=1074, id=1461, vol=1.121159e+09
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name HG12)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name HG12)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   22 and name HG12) 2.208 0.610 1.610 weight 1.000 ! spec=Expt_11, no=1074, id=1461, vol=1.121159e+09
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   22 and name HG12)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   22 and name HG12)
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   28 and name  HD1) 3.428 1.468 1.468 weight 1.000 ! spec=Expt_11, no=1076, id=1463, vol=8.018720e+07
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   28 and name  HD1) 3.428 1.468 1.468 weight 1.000 ! spec=Expt_11, no=1076, id=1463, vol=8.018720e+07
    or (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   22 and name HG22) 3.067 1.176 2.933 weight 1.000 ! spec=Expt_11, no=1079, id=1465, vol=1.560528e+08
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   22 and name HG21)
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   22 and name HG23)
assign (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   22 and name HG22) 3.067 1.176 2.933 weight 1.000 ! spec=Expt_11, no=1079, id=1465, vol=1.560528e+08
    or (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   22 and name HG21)
    or (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   22 and name HG23)
assign (segid "   A" and resid   24 and name HD22) (segid "   A" and resid   24 and name   HA) 2.457 0.754 3.543 weight 1.000 ! spec=Expt_11, no=1083, id=1469, vol=5.915774e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   A" and resid   24 and name   HA)
    or (segid "   A" and resid   24 and name HD23) (segid "   A" and resid   24 and name   HA)
assign (segid "   C" and resid   24 and name HD22) (segid "   C" and resid   24 and name   HA) 2.457 0.754 3.543 weight 1.000 ! spec=Expt_11, no=1083, id=1469, vol=5.915774e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   C" and resid   24 and name   HA)
    or (segid "   C" and resid   24 and name HD23) (segid "   C" and resid   24 and name   HA)
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   23 and name   HA) 3.305 1.365 1.365 weight 1.000 ! spec=Expt_11, no=1087, id=1471, vol=9.974237e+07
assign (segid "   C" and resid   24 and name   HA) (segid "   C" and resid   23 and name   HA) 3.305 1.365 1.365 weight 1.000 ! spec=Expt_11, no=1087, id=1471, vol=9.974237e+07
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   25 and name  HE1) 3.481 1.514 1.514 weight 1.000 ! spec=Expt_11, no=1088, id=1472, vol=7.312100e+07
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   25 and name  HE2)
assign (segid "   C" and resid   24 and name   HA) (segid "   C" and resid   25 and name  HE1) 3.481 1.514 1.514 weight 1.000 ! spec=Expt_11, no=1088, id=1472, vol=7.312100e+07
    or (segid "   C" and resid   24 and name   HA) (segid "   C" and resid   25 and name  HE2)
assign (segid "   A" and resid   24 and name HD22) (segid "   A" and resid   24 and name  HB1) 2.462 0.758 0.758 weight 1.000 ! spec=Expt_11, no=1090, id=1474, vol=5.833928e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   A" and resid   24 and name  HB1)
    or (segid "   A" and resid   24 and name HD23) (segid "   A" and resid   24 and name  HB1)
assign (segid "   C" and resid   24 and name HD22) (segid "   C" and resid   24 and name  HB1) 2.462 0.758 0.758 weight 1.000 ! spec=Expt_11, no=1090, id=1474, vol=5.833928e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   C" and resid   24 and name  HB1)
    or (segid "   C" and resid   24 and name HD23) (segid "   C" and resid   24 and name  HB1)
assign (segid "   A" and resid   24 and name HD12) (segid "   A" and resid   24 and name   HG) 2.353 0.692 0.692 weight 1.000 ! spec=Expt_11, no=1099, id=1483, vol=7.655055e+08
    or (segid "   A" and resid   24 and name HD11) (segid "   A" and resid   24 and name   HG)
    or (segid "   A" and resid   24 and name HD13) (segid "   A" and resid   24 and name   HG)
assign (segid "   C" and resid   24 and name HD12) (segid "   C" and resid   24 and name   HG) 2.353 0.692 0.692 weight 1.000 ! spec=Expt_11, no=1099, id=1483, vol=7.655055e+08
    or (segid "   C" and resid   24 and name HD11) (segid "   C" and resid   24 and name   HG)
    or (segid "   C" and resid   24 and name HD13) (segid "   C" and resid   24 and name   HG)
assign (segid "   A" and resid   24 and name HD22) (segid "   A" and resid   24 and name   HG) 2.540 0.807 0.807 weight 1.000 ! spec=Expt_11, no=1100, id=1484, vol=4.838061e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   A" and resid   24 and name   HG)
    or (segid "   A" and resid   24 and name HD23) (segid "   A" and resid   24 and name   HG)
assign (segid "   C" and resid   24 and name HD22) (segid "   C" and resid   24 and name   HG) 2.540 0.807 0.807 weight 1.000 ! spec=Expt_11, no=1100, id=1484, vol=4.838061e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   C" and resid   24 and name   HG)
    or (segid "   C" and resid   24 and name HD23) (segid "   C" and resid   24 and name   HG)
assign (segid "   A" and resid   24 and name   HG) (segid "   A" and resid   22 and name HD12) 2.353 0.692 1.692 weight 1.000 ! spec=Expt_11, no=1101, id=1485, vol=7.655055e+08
    or (segid "   A" and resid   24 and name   HG) (segid "   A" and resid   22 and name HD11)
    or (segid "   A" and resid   24 and name   HG) (segid "   A" and resid   22 and name HD13)
assign (segid "   C" and resid   24 and name   HG) (segid "   C" and resid   22 and name HD12) 2.353 0.692 1.692 weight 1.000 ! spec=Expt_11, no=1101, id=1485, vol=7.655055e+08
    or (segid "   C" and resid   24 and name   HG) (segid "   C" and resid   22 and name HD11)
    or (segid "   C" and resid   24 and name   HG) (segid "   C" and resid   22 and name HD13)
assign (segid "   A" and resid   24 and name   HG) (segid "   C" and resid   37 and name HG12) 2.436 0.742 3.564 weight 1.000 ! spec=Expt_11, no=1102, id=1486, vol=6.226231e+08
    or (segid "   A" and resid   24 and name   HG) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   24 and name   HG) (segid "   C" and resid   37 and name HG13)
assign (segid "   C" and resid   24 and name   HG) (segid "   A" and resid   37 and name HG12) 2.436 0.742 3.564 weight 1.000 ! spec=Expt_11, no=1102, id=1486, vol=6.226231e+08
    or (segid "   C" and resid   24 and name   HG) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   24 and name   HG) (segid "   A" and resid   37 and name HG13)
assign (segid "   A" and resid   24 and name   HG) (segid "   A" and resid   25 and name  HE1) 3.234 1.307 2.766 weight 1.000 ! spec=Expt_11, no=1103, id=1487, vol=1.137241e+08
    or (segid "   A" and resid   24 and name   HG) (segid "   A" and resid   25 and name  HE2)
assign (segid "   C" and resid   24 and name   HG) (segid "   C" and resid   25 and name  HE1) 3.234 1.307 2.766 weight 1.000 ! spec=Expt_11, no=1103, id=1487, vol=1.137241e+08
    or (segid "   C" and resid   24 and name   HG) (segid "   C" and resid   25 and name  HE2)
assign (segid "   A" and resid   24 and name   HG) (segid "   A" and resid   25 and name  HD1) 3.126 1.221 2.874 weight 1.000 ! spec=Expt_11, no=1104, id=1488, vol=1.394164e+08
    or (segid "   A" and resid   24 and name   HG) (segid "   A" and resid   25 and name  HD2)
assign (segid "   C" and resid   24 and name   HG) (segid "   C" and resid   25 and name  HD1) 3.126 1.221 2.874 weight 1.000 ! spec=Expt_11, no=1104, id=1488, vol=1.394164e+08
    or (segid "   C" and resid   24 and name   HG) (segid "   C" and resid   25 and name  HD2)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   37 and name   HN) 3.065 1.174 1.174 weight 1.000 ! spec=Expt_11, no=1105, id=1489, vol=1.567804e+08
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   37 and name   HN)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   37 and name   HN)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   37 and name   HN) 3.065 1.174 1.174 weight 1.000 ! spec=Expt_11, no=1105, id=1489, vol=1.567804e+08
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   37 and name   HN)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   37 and name   HN)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   40 and name   HB) 2.723 0.927 3.277 weight 1.000 ! spec=Expt_11, no=1108, id=1492, vol=3.187614e+08
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   40 and name   HB)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   40 and name   HB)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   40 and name   HB) 2.723 0.927 3.277 weight 1.000 ! spec=Expt_11, no=1108, id=1492, vol=3.187614e+08
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   40 and name   HB)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   40 and name   HB)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   33 and name  HB1) 3.029 1.147 2.647 weight 1.000 ! spec=Expt_11, no=1110, id=1494, vol=1.682664e+08
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   33 and name  HB1)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   33 and name  HB1)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   33 and name  HB1) 3.029 1.147 2.647 weight 1.000 ! spec=Expt_11, no=1110, id=1494, vol=1.682664e+08
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   33 and name  HB1)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   33 and name  HB1)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   36 and name  HB2) 2.533 0.802 0.802 weight 1.000 ! spec=Expt_11, no=1111, id=1495, vol=4.924841e+08
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   36 and name  HB2)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   36 and name  HB2)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   36 and name  HB2) 2.533 0.802 0.802 weight 1.000 ! spec=Expt_11, no=1111, id=1495, vol=4.924841e+08
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   36 and name  HB2)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   36 and name  HB2)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   36 and name  HB1) 2.418 0.731 0.731 weight 1.000 ! spec=Expt_11, no=1112, id=1496, vol=6.503540e+08
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   36 and name  HB1)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   36 and name  HB1)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   36 and name  HB1) 2.418 0.731 0.731 weight 1.000 ! spec=Expt_11, no=1112, id=1496, vol=6.503540e+08
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   36 and name  HB1)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   36 and name  HB1)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   13 and name HG22) 2.295 0.658 3.705 weight 1.000 ! spec=Expt_11, no=1120, id=1503, vol=8.908871e+08
    or (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   13 and name HG23)
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   13 and name HG22)
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   13 and name HG23)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   13 and name HG22)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   13 and name HG22) 2.295 0.658 3.705 weight 1.000 ! spec=Expt_11, no=1120, id=1503, vol=8.908871e+08
    or (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   13 and name HG23)
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   13 and name HG22)
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   13 and name HG23)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   13 and name HG22)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   36 and name   HN) 3.339 1.394 1.394 weight 1.000 ! spec=Expt_11, no=1121, id=1504, vol=9.375483e+07
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   36 and name   HN)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   36 and name   HN)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   36 and name   HN) 3.339 1.394 1.394 weight 1.000 ! spec=Expt_11, no=1121, id=1504, vol=9.375483e+07
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   36 and name   HN)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   36 and name   HN)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   40 and name   HB) 2.481 0.770 3.519 weight 1.000 ! spec=Expt_11, no=1124, id=1507, vol=5.570337e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   40 and name   HB)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   40 and name   HB)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   40 and name   HB) 2.481 0.770 3.519 weight 1.000 ! spec=Expt_11, no=1124, id=1507, vol=5.570337e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   40 and name   HB)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   40 and name   HB)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   33 and name   HA) 2.989 1.117 1.117 weight 1.000 ! spec=Expt_11, no=1125, id=1508, vol=1.823103e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   33 and name   HA)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   33 and name   HA)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   33 and name   HA) 2.989 1.117 1.117 weight 1.000 ! spec=Expt_11, no=1125, id=1508, vol=1.823103e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   33 and name   HA)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   33 and name   HA)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   36 and name   HA) 2.991 1.118 2.118 weight 1.000 ! spec=Expt_11, no=1126, id=1509, vol=1.816654e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   36 and name   HA)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   36 and name   HA)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   36 and name   HA) 2.991 1.118 2.118 weight 1.000 ! spec=Expt_11, no=1126, id=1509, vol=1.816654e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   36 and name   HA)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   36 and name   HA)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   36 and name  HB2) 2.516 0.792 0.792 weight 1.000 ! spec=Expt_11, no=1128, id=1510, vol=5.120791e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   36 and name  HB2)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   36 and name  HB2)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   36 and name  HB2) 2.516 0.792 0.792 weight 1.000 ! spec=Expt_11, no=1128, id=1510, vol=5.120791e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   36 and name  HB2)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   36 and name  HB2)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   36 and name  HG2) 2.413 0.728 3.587 weight 1.000 ! spec=Expt_11, no=1129, id=1511, vol=6.582193e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   36 and name  HG2)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   36 and name  HG2)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   36 and name  HG2) 2.413 0.728 3.587 weight 1.000 ! spec=Expt_11, no=1129, id=1511, vol=6.582193e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   36 and name  HG2)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   36 and name  HG2)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   36 and name  HG1) 2.286 0.653 3.714 weight 1.000 ! spec=Expt_11, no=1130, id=1512, vol=9.098528e+08
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   36 and name  HG1)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   36 and name  HG1)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   36 and name  HG1) 2.286 0.653 3.714 weight 1.000 ! spec=Expt_11, no=1130, id=1512, vol=9.098528e+08
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   36 and name  HG1)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   36 and name  HG1)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   13 and name HG22) 2.111 0.557 3.889 weight 1.000 ! spec=Expt_11, no=1133, id=1515, vol=1.469313e+09
    or (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   13 and name HG23)
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   13 and name HG22)
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   13 and name HG23)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   13 and name HG22)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   13 and name HG22) 2.111 0.557 3.889 weight 1.000 ! spec=Expt_11, no=1133, id=1515, vol=1.469313e+09
    or (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   13 and name HG23)
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   13 and name HG22)
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   13 and name HG23)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   13 and name HG22)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name   HA) 2.232 0.623 0.623 weight 1.000 ! spec=Expt_11, no=1141, id=1521, vol=1.050292e+09
assign (segid "   C" and resid   25 and name  HB1) (segid "   C" and resid   25 and name   HA) 2.232 0.623 0.623 weight 1.000 ! spec=Expt_11, no=1141, id=1521, vol=1.050292e+09
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name   HA) 2.256 0.636 0.636 weight 1.000 ! spec=Expt_11, no=1142, id=1522, vol=9.861105e+08
assign (segid "   C" and resid   25 and name  HB2) (segid "   C" and resid   25 and name   HA) 2.256 0.636 0.636 weight 1.000 ! spec=Expt_11, no=1142, id=1522, vol=9.861105e+08
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name  HD1) 2.458 0.755 0.755 weight 1.000 ! spec=Expt_11, no=1143, id=1523, vol=5.900923e+08
    or (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name  HD2)
assign (segid "   C" and resid   25 and name   HA) (segid "   C" and resid   25 and name  HD1) 2.458 0.755 0.755 weight 1.000 ! spec=Expt_11, no=1143, id=1523, vol=5.900923e+08
    or (segid "   C" and resid   25 and name   HA) (segid "   C" and resid   25 and name  HD2)
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   27 and name   HN) 3.301 1.362 1.301 weight 1.000 ! spec=Expt_11, no=1147, id=1526, vol=1.004252e+08
assign (segid "   C" and resid   25 and name  HB2) (segid "   C" and resid   27 and name   HN) 3.301 1.362 1.301 weight 1.000 ! spec=Expt_11, no=1147, id=1526, vol=1.004252e+08
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   26 and name HG21) 3.381 1.429 1.429 weight 1.000 ! spec=Expt_11, no=1149, id=1528, vol=8.697696e+07
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   26 and name HG22)
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   26 and name HG23)
assign (segid "   C" and resid   25 and name  HB1) (segid "   C" and resid   26 and name HG21) 3.381 1.429 1.429 weight 1.000 ! spec=Expt_11, no=1149, id=1528, vol=8.697696e+07
    or (segid "   C" and resid   25 and name  HB1) (segid "   C" and resid   26 and name HG22)
    or (segid "   C" and resid   25 and name  HB1) (segid "   C" and resid   26 and name HG23)
assign (segid "   A" and resid   25 and name  HB2) (segid "   C" and resid   13 and name HG22) 3.107 1.206 1.206 weight 1.000 ! spec=Expt_11, no=1150, id=1529, vol=1.446231e+08
    or (segid "   A" and resid   25 and name  HB2) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   25 and name  HB2) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   25 and name  HB2) (segid "   A" and resid   13 and name HG22) 3.107 1.206 1.206 weight 1.000 ! spec=Expt_11, no=1150, id=1529, vol=1.446231e+08
    or (segid "   C" and resid   25 and name  HB2) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   25 and name  HB2) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   25 and name  HB1) (segid "   C" and resid   13 and name HG22) 3.300 1.361 1.361 weight 1.000 ! spec=Expt_11, no=1151, id=1530, vol=1.006284e+08
    or (segid "   A" and resid   25 and name  HB1) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   25 and name  HB1) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   25 and name  HB1) (segid "   A" and resid   13 and name HG22) 3.300 1.361 1.361 weight 1.000 ! spec=Expt_11, no=1151, id=1530, vol=1.006284e+08
    or (segid "   C" and resid   25 and name  HB1) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   25 and name  HB1) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   26 and name   HB) (segid "   A" and resid   27 and name   HN) 2.990 1.118 3.010 weight 1.000 ! spec=Expt_11, no=1166, id=1541, vol=1.818288e+08
assign (segid "   C" and resid   26 and name   HB) (segid "   C" and resid   27 and name   HN) 2.990 1.118 3.010 weight 1.000 ! spec=Expt_11, no=1166, id=1541, vol=1.818288e+08
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   26 and name HG21) 2.734 0.935 3.266 weight 1.000 ! spec=Expt_11, no=1168, id=1542, vol=3.110914e+08
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   26 and name HG22)
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   26 and name HG23)
assign (segid "   C" and resid   25 and name  HB2) (segid "   C" and resid   26 and name HG21) 2.734 0.935 3.266 weight 1.000 ! spec=Expt_11, no=1168, id=1542, vol=3.110914e+08
    or (segid "   C" and resid   25 and name  HB2) (segid "   C" and resid   26 and name HG22)
    or (segid "   C" and resid   25 and name  HB2) (segid "   C" and resid   26 and name HG23)
assign (segid "   A" and resid   26 and name   HB) (segid "   A" and resid   26 and name HG21) 1.975 0.487 0.487 weight 1.000 ! spec=Expt_11, no=1170, id=1543, vol=2.192581e+09
    or (segid "   A" and resid   26 and name   HB) (segid "   A" and resid   26 and name HG22)
    or (segid "   A" and resid   26 and name   HB) (segid "   A" and resid   26 and name HG23)
assign (segid "   C" and resid   26 and name   HB) (segid "   C" and resid   26 and name HG21) 1.975 0.487 0.487 weight 1.000 ! spec=Expt_11, no=1170, id=1543, vol=2.192581e+09
    or (segid "   C" and resid   26 and name   HB) (segid "   C" and resid   26 and name HG22)
    or (segid "   C" and resid   26 and name   HB) (segid "   C" and resid   26 and name HG23)
assign (segid "   A" and resid   27 and name  HB2) (segid "   C" and resid   13 and name HD12) 3.160 1.248 1.248 weight 1.000 ! spec=Expt_11, no=1176, id=1548, vol=1.306650e+08
    or (segid "   A" and resid   27 and name  HB2) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   27 and name  HB2) (segid "   C" and resid   13 and name HD13)
assign (segid "   C" and resid   27 and name  HB2) (segid "   A" and resid   13 and name HD12) 3.160 1.248 1.248 weight 1.000 ! spec=Expt_11, no=1176, id=1548, vol=1.306650e+08
    or (segid "   C" and resid   27 and name  HB2) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   27 and name  HB2) (segid "   A" and resid   13 and name HD13)
assign (segid "   A" and resid   27 and name  HG2) (segid "   C" and resid   13 and name HD12) 3.309 1.369 1.369 weight 1.000 ! spec=Expt_11, no=1180, id=1552, vol=9.899736e+07
    or (segid "   A" and resid   27 and name  HG2) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   27 and name  HG2) (segid "   C" and resid   13 and name HD13)
assign (segid "   C" and resid   27 and name  HG2) (segid "   A" and resid   13 and name HD12) 3.309 1.369 1.369 weight 1.000 ! spec=Expt_11, no=1180, id=1552, vol=9.899736e+07
    or (segid "   C" and resid   27 and name  HG2) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   27 and name  HG2) (segid "   A" and resid   13 and name HD13)
assign (segid "   A" and resid   27 and name  HG2) (segid "   C" and resid   13 and name HG22) 2.868 1.028 1.028 weight 1.000 ! spec=Expt_11, no=1184, id=1554, vol=2.334020e+08
    or (segid "   A" and resid   27 and name  HG2) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   27 and name  HG2) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   27 and name  HG2) (segid "   A" and resid   13 and name HG22) 2.868 1.028 1.028 weight 1.000 ! spec=Expt_11, no=1184, id=1554, vol=2.334020e+08
    or (segid "   C" and resid   27 and name  HG2) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   27 and name  HG2) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   27 and name  HG1) (segid "   C" and resid   13 and name HG22) 2.897 1.049 1.049 weight 1.000 ! spec=Expt_11, no=1188, id=1557, vol=2.197238e+08
    or (segid "   A" and resid   27 and name  HG1) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   27 and name  HG1) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   27 and name  HG1) (segid "   A" and resid   13 and name HG22) 2.897 1.049 1.049 weight 1.000 ! spec=Expt_11, no=1188, id=1557, vol=2.197238e+08
    or (segid "   C" and resid   27 and name  HG1) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   27 and name  HG1) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   28 and name   HN) 3.112 1.211 1.211 weight 1.000 ! spec=Expt_11, no=1195, id=1562, vol=1.431348e+08
assign (segid "   C" and resid   27 and name  HG2) (segid "   C" and resid   28 and name   HN) 3.112 1.211 1.211 weight 1.000 ! spec=Expt_11, no=1195, id=1562, vol=1.431348e+08
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   22 and name HG22) 2.402 0.721 3.598 weight 1.000 ! spec=Expt_11, no=1197, id=1564, vol=6.770507e+08
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   22 and name HG21)
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   22 and name HG23)
assign (segid "   C" and resid   34 and name  HB1) (segid "   C" and resid   22 and name HG22) 2.402 0.721 3.598 weight 1.000 ! spec=Expt_11, no=1197, id=1564, vol=6.770507e+08
    or (segid "   C" and resid   34 and name  HB1) (segid "   C" and resid   22 and name HG21)
    or (segid "   C" and resid   34 and name  HB1) (segid "   C" and resid   22 and name HG23)
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   22 and name HD12) 2.429 0.737 3.571 weight 1.000 ! spec=Expt_11, no=1199, id=1566, vol=6.332262e+08
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   22 and name HD11)
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   22 and name HD13)
assign (segid "   C" and resid   34 and name  HB1) (segid "   C" and resid   22 and name HD12) 2.429 0.737 3.571 weight 1.000 ! spec=Expt_11, no=1199, id=1566, vol=6.332262e+08
    or (segid "   C" and resid   34 and name  HB1) (segid "   C" and resid   22 and name HD11)
    or (segid "   C" and resid   34 and name  HB1) (segid "   C" and resid   22 and name HD13)
assign (segid "   A" and resid   27 and name  HE1) (segid "   A" and resid   28 and name  HB1) 4.647 2.699 2.699 weight 1.000 ! spec=Expt_11, no=1212, id=1577, vol=1.306989e+08
assign (segid "   C" and resid   27 and name  HE1) (segid "   C" and resid   28 and name  HB1) 4.647 2.699 2.699 weight 1.000 ! spec=Expt_11, no=1212, id=1577, vol=1.306989e+08
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   28 and name   HA) 2.611 0.852 0.852 weight 1.000 ! spec=Expt_11, no=1219, id=1580, vol=4.104925e+08
assign (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   28 and name   HA) 2.611 0.852 0.852 weight 1.000 ! spec=Expt_11, no=1219, id=1580, vol=4.104925e+08
assign (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   28 and name   HA) 2.628 0.863 0.863 weight 1.000 ! spec=Expt_11, no=1220, id=1581, vol=3.949534e+08
assign (segid "   C" and resid   28 and name  HB2) (segid "   C" and resid   28 and name   HA) 2.628 0.863 0.863 weight 1.000 ! spec=Expt_11, no=1220, id=1581, vol=3.949534e+08
assign (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   28 and name   HA) 2.636 0.869 0.869 weight 1.000 ! spec=Expt_11, no=1221, id=1582, vol=3.874912e+08
assign (segid "   C" and resid   28 and name  HB1) (segid "   C" and resid   28 and name   HA) 2.636 0.869 0.869 weight 1.000 ! spec=Expt_11, no=1221, id=1582, vol=3.874912e+08
assign (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   29 and name   HB) 2.842 1.009 3.158 weight 1.000 ! spec=Expt_11, no=1222, id=1583, vol=2.469113e+08
assign (segid "   C" and resid   28 and name   HA) (segid "   C" and resid   29 and name   HB) 2.842 1.009 3.158 weight 1.000 ! spec=Expt_11, no=1222, id=1583, vol=2.469113e+08
assign (segid "   A" and resid   29 and name HD12) (segid "   A" and resid   28 and name   HA) 3.031 1.149 1.149 weight 1.000 ! spec=Expt_11, no=1224, id=1584, vol=1.675837e+08
    or (segid "   A" and resid   29 and name HD11) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   29 and name HD13) (segid "   A" and resid   28 and name   HA)
assign (segid "   C" and resid   29 and name HD12) (segid "   C" and resid   28 and name   HA) 3.031 1.149 1.149 weight 1.000 ! spec=Expt_11, no=1224, id=1584, vol=1.675837e+08
    or (segid "   C" and resid   29 and name HD11) (segid "   C" and resid   28 and name   HA)
    or (segid "   C" and resid   29 and name HD13) (segid "   C" and resid   28 and name   HA)
assign (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   28 and name  HE1) 3.242 1.314 1.314 weight 1.000 ! spec=Expt_11, no=1226, id=1585, vol=1.118665e+08
    or (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   28 and name  HB1) (segid "   C" and resid   28 and name  HE1) 3.242 1.314 1.314 weight 1.000 ! spec=Expt_11, no=1226, id=1585, vol=1.118665e+08
    or (segid "   C" and resid   28 and name  HB1) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   18 and name  HG2) 3.009 1.132 1.132 weight 1.000 ! spec=Expt_11, no=1229, id=1586, vol=1.750319e+08
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   18 and name  HG2)
assign (segid "   C" and resid   28 and name  HE1) (segid "   C" and resid   18 and name  HG2) 3.009 1.132 1.132 weight 1.000 ! spec=Expt_11, no=1229, id=1586, vol=1.750319e+08
    or (segid "   C" and resid   28 and name  HE2) (segid "   C" and resid   18 and name  HG2)
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   28 and name  HD1) 3.032 1.149 1.149 weight 1.000 ! spec=Expt_11, no=1240, id=1594, vol=1.672341e+08
    or (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   29 and name   HA) (segid "   C" and resid   28 and name  HD1) 3.032 1.149 1.149 weight 1.000 ! spec=Expt_11, no=1240, id=1594, vol=1.672341e+08
    or (segid "   C" and resid   29 and name   HA) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   33 and name  HB1) 2.861 1.023 3.139 weight 1.000 ! spec=Expt_11, no=1241, id=1595, vol=2.369834e+08
assign (segid "   C" and resid   29 and name   HA) (segid "   C" and resid   33 and name  HB1) 2.861 1.023 3.139 weight 1.000 ! spec=Expt_11, no=1241, id=1595, vol=2.369834e+08
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   11 and name  HB1) 2.769 0.959 3.231 weight 1.000 ! spec=Expt_11, no=1242, id=1596, vol=2.881349e+08
assign (segid "   C" and resid   29 and name   HA) (segid "   C" and resid   11 and name  HB1) 2.769 0.959 3.231 weight 1.000 ! spec=Expt_11, no=1242, id=1596, vol=2.881349e+08
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   12 and name HG22) 2.915 1.062 1.562 weight 1.000 ! spec=Expt_11, no=1243, id=1597, vol=2.120018e+08
    or (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   12 and name HG23)
assign (segid "   C" and resid   29 and name   HA) (segid "   C" and resid   12 and name HG22) 2.915 1.062 1.562 weight 1.000 ! spec=Expt_11, no=1243, id=1597, vol=2.120018e+08
    or (segid "   C" and resid   29 and name   HA) (segid "   C" and resid   12 and name HG21)
    or (segid "   C" and resid   29 and name   HA) (segid "   C" and resid   12 and name HG23)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name   HA) 2.238 0.626 0.626 weight 1.000 ! spec=Expt_11, no=1244, id=1598, vol=1.035813e+09
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name   HA)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   29 and name   HA) 2.238 0.626 0.626 weight 1.000 ! spec=Expt_11, no=1244, id=1598, vol=1.035813e+09
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   29 and name   HA)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   29 and name   HA)
assign (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   29 and name HG11) 2.081 0.541 3.919 weight 1.000 ! spec=Expt_11, no=1247, id=1600, vol=1.599232e+09
assign (segid "   C" and resid   29 and name   HB) (segid "   C" and resid   29 and name HG11) 2.081 0.541 3.919 weight 1.000 ! spec=Expt_11, no=1247, id=1600, vol=1.599232e+09
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   12 and name HG22) 2.550 0.813 2.813 weight 1.000 ! spec=Expt_11, no=1252, id=1604, vol=4.728105e+08
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   12 and name HG23)
assign (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   12 and name HG22) 2.550 0.813 2.813 weight 1.000 ! spec=Expt_11, no=1252, id=1604, vol=4.728105e+08
    or (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   12 and name HG21)
    or (segid "   C" and resid   29 and name HG12) (segid "   C" and resid   12 and name HG23)
assign (segid "   A" and resid   29 and name HD12) (segid "   A" and resid   22 and name HG12) 2.040 0.520 3.960 weight 1.000 ! spec=Expt_11, no=1254, id=1606, vol=1.805087e+09
    or (segid "   A" and resid   29 and name HD11) (segid "   A" and resid   22 and name HG12)
    or (segid "   A" and resid   29 and name HD13) (segid "   A" and resid   22 and name HG12)
assign (segid "   C" and resid   29 and name HD12) (segid "   C" and resid   22 and name HG12) 2.040 0.520 3.960 weight 1.000 ! spec=Expt_11, no=1254, id=1606, vol=1.805087e+09
    or (segid "   C" and resid   29 and name HD11) (segid "   C" and resid   22 and name HG12)
    or (segid "   C" and resid   29 and name HD13) (segid "   C" and resid   22 and name HG12)
assign (segid "   A" and resid   29 and name HD12) (segid "   A" and resid   27 and name  HG1) 2.751 0.946 2.946 weight 1.000 ! spec=Expt_11, no=1256, id=1608, vol=2.999349e+08
    or (segid "   A" and resid   29 and name HD11) (segid "   A" and resid   27 and name  HG1)
    or (segid "   A" and resid   29 and name HD13) (segid "   A" and resid   27 and name  HG1)
assign (segid "   C" and resid   29 and name HD12) (segid "   C" and resid   27 and name  HG1) 2.751 0.946 2.946 weight 1.000 ! spec=Expt_11, no=1256, id=1608, vol=2.999349e+08
    or (segid "   C" and resid   29 and name HD11) (segid "   C" and resid   27 and name  HG1)
    or (segid "   C" and resid   29 and name HD13) (segid "   C" and resid   27 and name  HG1)
assign (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   33 and name  HB1) 3.051 1.164 2.164 weight 1.000 ! spec=Expt_11, no=1257, id=1609, vol=1.610263e+08
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   33 and name  HB1)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   33 and name  HB1)
assign (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   33 and name  HB1) 3.051 1.164 2.164 weight 1.000 ! spec=Expt_11, no=1257, id=1609, vol=1.610263e+08
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   33 and name  HB1)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   33 and name  HB1)
assign (segid "   A" and resid   29 and name HD12) (segid "   A" and resid   28 and name  HB2) 3.110 1.209 2.890 weight 1.000 ! spec=Expt_11, no=1259, id=1610, vol=1.437379e+08
    or (segid "   A" and resid   29 and name HD11) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid   29 and name HD13) (segid "   A" and resid   28 and name  HB2)
assign (segid "   C" and resid   29 and name HD12) (segid "   C" and resid   28 and name  HB2) 3.110 1.209 2.890 weight 1.000 ! spec=Expt_11, no=1259, id=1610, vol=1.437379e+08
    or (segid "   C" and resid   29 and name HD11) (segid "   C" and resid   28 and name  HB2)
    or (segid "   C" and resid   29 and name HD13) (segid "   C" and resid   28 and name  HB2)
assign (segid "   A" and resid   29 and name HD12) (segid "   A" and resid   23 and name   HA) 3.526 1.554 1.554 weight 1.000 ! spec=Expt_11, no=1261, id=1612, vol=6.764832e+07
    or (segid "   A" and resid   29 and name HD11) (segid "   A" and resid   23 and name   HA)
    or (segid "   A" and resid   29 and name HD13) (segid "   A" and resid   23 and name   HA)
assign (segid "   C" and resid   29 and name HD12) (segid "   C" and resid   23 and name   HA) 3.526 1.554 1.554 weight 1.000 ! spec=Expt_11, no=1261, id=1612, vol=6.764832e+07
    or (segid "   C" and resid   29 and name HD11) (segid "   C" and resid   23 and name   HA)
    or (segid "   C" and resid   29 and name HD13) (segid "   C" and resid   23 and name   HA)
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   29 and name HD12) 3.094 1.197 2.906 weight 1.000 ! spec=Expt_11, no=1262, id=1613, vol=1.481121e+08
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   29 and name HD11)
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   29 and name HD13)
assign (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   29 and name HD12) 3.094 1.197 2.906 weight 1.000 ! spec=Expt_11, no=1262, id=1613, vol=1.481121e+08
    or (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   29 and name HD11)
    or (segid "   C" and resid   24 and name   HN) (segid "   C" and resid   29 and name HD13)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   12 and name HG22) 2.327 0.677 3.673 weight 1.000 ! spec=Expt_11, no=1263, id=1614, vol=8.184977e+08
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   12 and name HG23)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   12 and name HG22) 2.327 0.677 3.673 weight 1.000 ! spec=Expt_11, no=1263, id=1614, vol=8.184977e+08
    or (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   12 and name HG21)
    or (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   12 and name HG23)
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   12 and name HG22)
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   12 and name HG21)
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   12 and name HG23)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   12 and name HG22)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   12 and name HG21)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   12 and name HG23)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   30 and name  HB2) 2.707 0.916 3.293 weight 1.000 ! spec=Expt_11, no=1269, id=1617, vol=3.304692e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   30 and name  HB2)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   30 and name  HB2)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   30 and name  HB2) 2.707 0.916 3.293 weight 1.000 ! spec=Expt_11, no=1269, id=1617, vol=3.304692e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   30 and name  HB2)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   30 and name  HB2)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   33 and name   HA) 3.018 1.139 1.139 weight 1.000 ! spec=Expt_11, no=1270, id=1618, vol=1.720574e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   33 and name   HA)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   33 and name   HA)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   33 and name   HA) 3.018 1.139 1.139 weight 1.000 ! spec=Expt_11, no=1270, id=1618, vol=1.720574e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   33 and name   HA)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   33 and name   HA)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   21 and name  HA1) 3.101 1.202 2.899 weight 1.000 ! spec=Expt_11, no=1271, id=1619, vol=1.462868e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   21 and name  HA1)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   21 and name  HA1)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   21 and name  HA1) 3.101 1.202 2.899 weight 1.000 ! spec=Expt_11, no=1271, id=1619, vol=1.462868e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   21 and name  HA1)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   21 and name  HA1)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   31 and name   HA) 3.032 1.149 2.968 weight 1.000 ! spec=Expt_11, no=1272, id=1620, vol=1.672166e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   31 and name   HA)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   31 and name   HA)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   31 and name   HA) 3.032 1.149 2.968 weight 1.000 ! spec=Expt_11, no=1272, id=1620, vol=1.672166e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   31 and name   HA)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   31 and name   HA)
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   29 and name HG22) 3.285 1.349 1.349 weight 1.000 ! spec=Expt_11, no=1275, id=1623, vol=1.034787e+08
    or (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   29 and name HG22) 3.285 1.349 1.349 weight 1.000 ! spec=Expt_11, no=1275, id=1623, vol=1.034787e+08
    or (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   31 and name   HN) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   37 and name   HN) 3.211 1.289 2.789 weight 1.000 ! spec=Expt_11, no=1276, id=1624, vol=1.186387e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   37 and name   HN)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   37 and name   HN) 3.211 1.289 2.789 weight 1.000 ! spec=Expt_11, no=1276, id=1624, vol=1.186387e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   37 and name   HN)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   37 and name   HN)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   29 and name HG22) 2.648 0.876 0.876 weight 1.000 ! spec=Expt_11, no=1277, id=1625, vol=3.773141e+08
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   29 and name HG22) 2.648 0.876 0.876 weight 1.000 ! spec=Expt_11, no=1277, id=1625, vol=3.773141e+08
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   33 and name   HN) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   30 and name   HA) 2.223 0.617 0.617 weight 1.000 ! spec=Expt_11, no=1278, id=1626, vol=1.078570e+09
assign (segid "   C" and resid   30 and name  HB1) (segid "   C" and resid   30 and name   HA) 2.223 0.617 0.617 weight 1.000 ! spec=Expt_11, no=1278, id=1626, vol=1.078570e+09
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   18 and name  HG1) 2.926 1.070 3.074 weight 1.000 ! spec=Expt_11, no=1280, id=1627, vol=2.072391e+08
assign (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   18 and name  HG1) 2.926 1.070 3.074 weight 1.000 ! spec=Expt_11, no=1280, id=1627, vol=2.072391e+08
assign (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   30 and name   HA) 2.865 1.026 1.026 weight 1.000 ! spec=Expt_11, no=1284, id=1631, vol=2.351249e+08
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   30 and name   HA)
assign (segid "   C" and resid   28 and name  HE1) (segid "   C" and resid   30 and name   HA) 2.865 1.026 1.026 weight 1.000 ! spec=Expt_11, no=1284, id=1631, vol=2.351249e+08
    or (segid "   C" and resid   28 and name  HE2) (segid "   C" and resid   30 and name   HA)
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   29 and name   HA) 2.951 1.088 3.049 weight 1.000 ! spec=Expt_11, no=1285, id=1632, vol=1.970318e+08
assign (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   29 and name   HA) 2.951 1.088 3.049 weight 1.000 ! spec=Expt_11, no=1285, id=1632, vol=1.970318e+08
assign (segid "   A" and resid   21 and name  HA2) (segid "   A" and resid   30 and name   HA) 2.418 0.731 3.582 weight 1.000 ! spec=Expt_11, no=1286, id=1633, vol=6.509578e+08
assign (segid "   C" and resid   21 and name  HA2) (segid "   C" and resid   30 and name   HA) 2.418 0.731 3.582 weight 1.000 ! spec=Expt_11, no=1286, id=1633, vol=6.509578e+08
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name HD22) 2.931 1.074 3.069 weight 1.000 ! spec=Expt_11, no=1288, id=1634, vol=2.050267e+08
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name HD21)
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name HD23)
assign (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   31 and name HD22) 2.931 1.074 3.069 weight 1.000 ! spec=Expt_11, no=1288, id=1634, vol=2.050267e+08
    or (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   31 and name HD21)
    or (segid "   C" and resid   30 and name   HA) (segid "   C" and resid   31 and name HD23)
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   31 and name   HG) 3.070 1.178 2.930 weight 1.000 ! spec=Expt_11, no=1289, id=1635, vol=1.552214e+08
assign (segid "   C" and resid   30 and name  HB1) (segid "   C" and resid   31 and name   HG) 3.070 1.178 2.930 weight 1.000 ! spec=Expt_11, no=1289, id=1635, vol=1.552214e+08
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   21 and name  HA2) 3.229 1.303 2.771 weight 1.000 ! spec=Expt_11, no=1292, id=1637, vol=1.146909e+08
assign (segid "   C" and resid   30 and name  HB2) (segid "   C" and resid   21 and name  HA2) 3.229 1.303 2.771 weight 1.000 ! spec=Expt_11, no=1292, id=1637, vol=1.146909e+08
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   21 and name  HA2) 3.232 1.306 2.768 weight 1.000 ! spec=Expt_11, no=1293, id=1638, vol=1.140203e+08
assign (segid "   C" and resid   30 and name  HB1) (segid "   C" and resid   21 and name  HA2) 3.232 1.306 2.768 weight 1.000 ! spec=Expt_11, no=1293, id=1638, vol=1.140203e+08
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name   HA) 2.282 0.651 0.651 weight 1.000 ! spec=Expt_11, no=1299, id=1641, vol=9.199059e+08
assign (segid "   C" and resid   31 and name  HB2) (segid "   C" and resid   31 and name   HA) 2.282 0.651 0.651 weight 1.000 ! spec=Expt_11, no=1299, id=1641, vol=9.199059e+08
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name   HA) 2.532 0.802 0.802 weight 1.000 ! spec=Expt_11, no=1300, id=1642, vol=4.929378e+08
assign (segid "   C" and resid   32 and name   HN) (segid "   C" and resid   31 and name   HA) 2.532 0.802 0.802 weight 1.000 ! spec=Expt_11, no=1300, id=1642, vol=4.929378e+08
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   34 and name   HA) 2.990 1.117 3.010 weight 1.000 ! spec=Expt_11, no=1301, id=1643, vol=1.819803e+08
assign (segid "   C" and resid   31 and name   HA) (segid "   C" and resid   34 and name   HA) 2.990 1.117 3.010 weight 1.000 ! spec=Expt_11, no=1301, id=1643, vol=1.819803e+08
assign (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid   32 and name   HN) 2.614 0.854 3.386 weight 1.000 ! spec=Expt_11, no=1302, id=1644, vol=4.075590e+08
assign (segid "   C" and resid   31 and name  HB1) (segid "   C" and resid   32 and name   HN) 2.614 0.854 3.386 weight 1.000 ! spec=Expt_11, no=1302, id=1644, vol=4.075590e+08
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   21 and name  HA1) 3.403 1.447 1.447 weight 1.000 ! spec=Expt_11, no=1304, id=1646, vol=8.372544e+07
assign (segid "   C" and resid   31 and name  HB2) (segid "   C" and resid   21 and name  HA1) 3.403 1.447 1.447 weight 1.000 ! spec=Expt_11, no=1304, id=1646, vol=8.372544e+07
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   34 and name  HB2) 3.396 1.442 2.604 weight 1.000 ! spec=Expt_11, no=1306, id=1648, vol=8.473024e+07
assign (segid "   C" and resid   31 and name  HB2) (segid "   C" and resid   34 and name  HB2) 3.396 1.442 2.604 weight 1.000 ! spec=Expt_11, no=1306, id=1648, vol=8.473024e+07
assign (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid   34 and name  HB2) 3.288 1.351 2.712 weight 1.000 ! spec=Expt_11, no=1307, id=1649, vol=1.028668e+08
assign (segid "   C" and resid   31 and name  HB1) (segid "   C" and resid   34 and name  HB2) 3.288 1.351 2.712 weight 1.000 ! spec=Expt_11, no=1307, id=1649, vol=1.028668e+08
assign (segid "   A" and resid   31 and name HD22) (segid "   A" and resid   31 and name  HB1) 2.245 0.630 1.630 weight 1.000 ! spec=Expt_11, no=1309, id=1651, vol=1.016683e+09
    or (segid "   A" and resid   31 and name HD21) (segid "   A" and resid   31 and name  HB1)
    or (segid "   A" and resid   31 and name HD23) (segid "   A" and resid   31 and name  HB1)
assign (segid "   C" and resid   31 and name HD22) (segid "   C" and resid   31 and name  HB1) 2.245 0.630 1.630 weight 1.000 ! spec=Expt_11, no=1309, id=1651, vol=1.016683e+09
    or (segid "   C" and resid   31 and name HD21) (segid "   C" and resid   31 and name  HB1)
    or (segid "   C" and resid   31 and name HD23) (segid "   C" and resid   31 and name  HB1)
assign (segid "   A" and resid   31 and name HD22) (segid "   A" and resid   31 and name   HG) 2.198 0.604 0.604 weight 1.000 ! spec=Expt_11, no=1310, id=1652, vol=1.154112e+09
    or (segid "   A" and resid   31 and name HD21) (segid "   A" and resid   31 and name   HG)
    or (segid "   A" and resid   31 and name HD23) (segid "   A" and resid   31 and name   HG)
assign (segid "   C" and resid   31 and name HD22) (segid "   C" and resid   31 and name   HG) 2.198 0.604 0.604 weight 1.000 ! spec=Expt_11, no=1310, id=1652, vol=1.154112e+09
    or (segid "   C" and resid   31 and name HD21) (segid "   C" and resid   31 and name   HG)
    or (segid "   C" and resid   31 and name HD23) (segid "   C" and resid   31 and name   HG)
assign (segid "   A" and resid   31 and name   HG) (segid "   A" and resid   20 and name  HB2) 2.569 0.825 3.431 weight 1.000 ! spec=Expt_11, no=1311, id=1653, vol=4.524183e+08
assign (segid "   C" and resid   31 and name   HG) (segid "   C" and resid   20 and name  HB2) 2.569 0.825 3.431 weight 1.000 ! spec=Expt_11, no=1311, id=1653, vol=4.524183e+08
assign (segid "   A" and resid   31 and name   HG) (segid "   A" and resid   21 and name  HA1) 3.227 1.302 2.773 weight 1.000 ! spec=Expt_11, no=1312, id=1654, vol=1.151199e+08
assign (segid "   C" and resid   31 and name   HG) (segid "   C" and resid   21 and name  HA1) 3.227 1.302 2.773 weight 1.000 ! spec=Expt_11, no=1312, id=1654, vol=1.151199e+08
assign (segid "   A" and resid   31 and name   HG) (segid "   A" and resid   30 and name   HA) 3.243 1.315 2.757 weight 1.000 ! spec=Expt_11, no=1313, id=1655, vol=1.117075e+08
assign (segid "   C" and resid   31 and name   HG) (segid "   C" and resid   30 and name   HA) 3.243 1.315 2.757 weight 1.000 ! spec=Expt_11, no=1313, id=1655, vol=1.117075e+08
assign (segid "   A" and resid   31 and name   HG) (segid "   A" and resid   31 and name HD12) 2.039 0.520 0.520 weight 1.000 ! spec=Expt_11, no=1314, id=1656, vol=1.808971e+09
    or (segid "   A" and resid   31 and name   HG) (segid "   A" and resid   31 and name HD11)
    or (segid "   A" and resid   31 and name   HG) (segid "   A" and resid   31 and name HD13)
assign (segid "   C" and resid   31 and name   HG) (segid "   C" and resid   31 and name HD12) 2.039 0.520 0.520 weight 1.000 ! spec=Expt_11, no=1314, id=1656, vol=1.808971e+09
    or (segid "   C" and resid   31 and name   HG) (segid "   C" and resid   31 and name HD11)
    or (segid "   C" and resid   31 and name   HG) (segid "   C" and resid   31 and name HD13)
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name HD12) 2.095 0.549 1.549 weight 1.000 ! spec=Expt_11, no=1315, id=1657, vol=1.535587e+09
    or (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name HD11)
    or (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name HD13)
assign (segid "   C" and resid   31 and name  HB2) (segid "   C" and resid   31 and name HD12) 2.095 0.549 1.549 weight 1.000 ! spec=Expt_11, no=1315, id=1657, vol=1.535587e+09
    or (segid "   C" and resid   31 and name  HB2) (segid "   C" and resid   31 and name HD11)
    or (segid "   C" and resid   31 and name  HB2) (segid "   C" and resid   31 and name HD13)
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   20 and name  HD2) 2.660 0.884 3.340 weight 1.000 ! spec=Expt_11, no=1320, id=1659, vol=3.674218e+08
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   20 and name  HD2)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   20 and name  HD2)
assign (segid "   C" and resid   31 and name HD12) (segid "   C" and resid   20 and name  HD2) 2.660 0.884 3.340 weight 1.000 ! spec=Expt_11, no=1320, id=1659, vol=3.674218e+08
    or (segid "   C" and resid   31 and name HD11) (segid "   C" and resid   20 and name  HD2)
    or (segid "   C" and resid   31 and name HD13) (segid "   C" and resid   20 and name  HD2)
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   21 and name  HA1) 2.763 0.954 3.237 weight 1.000 ! spec=Expt_11, no=1321, id=1660, vol=2.924479e+08
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   21 and name  HA1)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   21 and name  HA1)
assign (segid "   C" and resid   31 and name HD12) (segid "   C" and resid   21 and name  HA1) 2.763 0.954 3.237 weight 1.000 ! spec=Expt_11, no=1321, id=1660, vol=2.924479e+08
    or (segid "   C" and resid   31 and name HD11) (segid "   C" and resid   21 and name  HA1)
    or (segid "   C" and resid   31 and name HD13) (segid "   C" and resid   21 and name  HA1)
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   31 and name   HN) 2.871 1.030 3.129 weight 1.000 ! spec=Expt_11, no=1322, id=1661, vol=2.322286e+08
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   31 and name   HN)
assign (segid "   C" and resid   31 and name HD12) (segid "   C" and resid   31 and name   HN) 2.871 1.030 3.129 weight 1.000 ! spec=Expt_11, no=1322, id=1661, vol=2.322286e+08
    or (segid "   C" and resid   31 and name HD11) (segid "   C" and resid   31 and name   HN)
    or (segid "   C" and resid   31 and name HD13) (segid "   C" and resid   31 and name   HN)
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name HD22) 1.934 0.468 2.468 weight 1.000 ! spec=Expt_11, no=1324, id=1663, vol=2.481207e+09
    or (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name HD21)
    or (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name HD23)
assign (segid "   C" and resid   31 and name  HB2) (segid "   C" and resid   31 and name HD22) 1.934 0.468 2.468 weight 1.000 ! spec=Expt_11, no=1324, id=1663, vol=2.481207e+09
    or (segid "   C" and resid   31 and name  HB2) (segid "   C" and resid   31 and name HD21)
    or (segid "   C" and resid   31 and name  HB2) (segid "   C" and resid   31 and name HD23)
assign (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid   32 and name   HA) 2.223 0.617 0.617 weight 1.000 ! spec=Expt_11, no=1329, id=1666, vol=1.078570e+09
assign (segid "   C" and resid   32 and name  HB1) (segid "   C" and resid   32 and name   HA) 2.223 0.617 0.617 weight 1.000 ! spec=Expt_11, no=1329, id=1666, vol=1.078570e+09
assign (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   32 and name   HA) 2.226 0.619 0.619 weight 1.000 ! spec=Expt_11, no=1330, id=1667, vol=1.068708e+09
assign (segid "   C" and resid   32 and name  HB2) (segid "   C" and resid   32 and name   HA) 2.226 0.619 0.619 weight 1.000 ! spec=Expt_11, no=1330, id=1667, vol=1.068708e+09
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   36 and name  HD2) 2.682 0.899 0.899 weight 1.000 ! spec=Expt_11, no=1332, id=1668, vol=3.495064e+08
assign (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   36 and name  HD2) 2.682 0.899 0.899 weight 1.000 ! spec=Expt_11, no=1332, id=1668, vol=3.495064e+08
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   13 and name HG22) 3.226 1.301 1.301 weight 1.000 ! spec=Expt_11, no=1333, id=1669, vol=1.153833e+08
    or (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   13 and name HG21)
    or (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   13 and name HG23)
assign (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   13 and name HG22) 3.226 1.301 1.301 weight 1.000 ! spec=Expt_11, no=1333, id=1669, vol=1.153833e+08
    or (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   13 and name HG21)
    or (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   13 and name HG23)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name   HA) 2.624 0.861 0.861 weight 1.000 ! spec=Expt_11, no=1336, id=1672, vol=3.984933e+08
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   33 and name   HA) 2.624 0.861 0.861 weight 1.000 ! spec=Expt_11, no=1336, id=1672, vol=3.984933e+08
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   36 and name  HE2) 2.683 0.900 3.317 weight 1.000 ! spec=Expt_11, no=1337, id=1673, vol=3.484911e+08
assign (segid "   C" and resid   33 and name   HA) (segid "   C" and resid   36 and name  HE2) 2.683 0.900 3.317 weight 1.000 ! spec=Expt_11, no=1337, id=1673, vol=3.484911e+08
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name   HN) 3.086 1.190 1.190 weight 1.000 ! spec=Expt_11, no=1346, id=1679, vol=1.505262e+08
assign (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   37 and name   HN) 3.086 1.190 1.190 weight 1.000 ! spec=Expt_11, no=1346, id=1679, vol=1.505262e+08
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name   HA) 2.339 0.684 0.684 weight 1.000 ! spec=Expt_11, no=1348, id=1681, vol=7.942902e+08
assign (segid "   C" and resid   34 and name  HB2) (segid "   C" and resid   34 and name   HA) 2.339 0.684 0.684 weight 1.000 ! spec=Expt_11, no=1348, id=1681, vol=7.942902e+08
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG12) 2.179 0.593 0.593 weight 1.000 ! spec=Expt_11, no=1350, id=1682, vol=1.215525e+09
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG13)
assign (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   37 and name HG12) 2.179 0.593 0.593 weight 1.000 ! spec=Expt_11, no=1350, id=1682, vol=1.215525e+09
    or (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   37 and name HG11)
    or (segid "   C" and resid   34 and name   HA) (segid "   C" and resid   37 and name HG13)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   34 and name   HA) 2.230 0.622 0.622 weight 1.000 ! spec=Expt_11, no=1351, id=1683, vol=1.056472e+09
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   34 and name   HA)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   34 and name   HA)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   34 and name   HA) 2.230 0.622 0.622 weight 1.000 ! spec=Expt_11, no=1351, id=1683, vol=1.056472e+09
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   34 and name   HA)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   34 and name   HA)
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   33 and name   HA) 3.353 1.406 2.647 weight 1.000 ! spec=Expt_11, no=1352, id=1684, vol=9.142560e+07
assign (segid "   C" and resid   34 and name  HB2) (segid "   C" and resid   33 and name   HA) 3.353 1.406 2.647 weight 1.000 ! spec=Expt_11, no=1352, id=1684, vol=9.142560e+07
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   21 and name  HA1) 3.413 1.456 2.587 weight 1.000 ! spec=Expt_11, no=1353, id=1685, vol=8.225197e+07
assign (segid "   C" and resid   34 and name  HB2) (segid "   C" and resid   21 and name  HA1) 3.413 1.456 2.587 weight 1.000 ! spec=Expt_11, no=1353, id=1685, vol=8.225197e+07
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   34 and name  HB2) 2.670 0.891 1.891 weight 1.000 ! spec=Expt_11, no=1356, id=1687, vol=3.587952e+08
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   34 and name  HB2)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   34 and name  HB2)
assign (segid "   C" and resid   29 and name HG22) (segid "   C" and resid   34 and name  HB2) 2.670 0.891 1.891 weight 1.000 ! spec=Expt_11, no=1356, id=1687, vol=3.587952e+08
    or (segid "   C" and resid   29 and name HG21) (segid "   C" and resid   34 and name  HB2)
    or (segid "   C" and resid   29 and name HG23) (segid "   C" and resid   34 and name  HB2)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   34 and name  HB2) 2.560 0.819 0.819 weight 1.000 ! spec=Expt_11, no=1359, id=1688, vol=4.614987e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   34 and name  HB2)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   34 and name  HB2)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   34 and name  HB2) 2.560 0.819 0.819 weight 1.000 ! spec=Expt_11, no=1359, id=1688, vol=4.614987e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   34 and name  HB2)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   34 and name  HB2)
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   35 and name   HN) 3.015 1.136 2.985 weight 1.000 ! spec=Expt_11, no=1363, id=1690, vol=1.730969e+08
assign (segid "   C" and resid   34 and name  HG1) (segid "   C" and resid   35 and name   HN) 3.015 1.136 2.985 weight 1.000 ! spec=Expt_11, no=1363, id=1690, vol=1.730969e+08
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   35 and name   HN) 3.202 1.282 2.798 weight 1.000 ! spec=Expt_11, no=1364, id=1691, vol=1.206213e+08
assign (segid "   C" and resid   34 and name  HG2) (segid "   C" and resid   35 and name   HN) 3.202 1.282 2.798 weight 1.000 ! spec=Expt_11, no=1364, id=1691, vol=1.206213e+08
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   31 and name   HA) 3.044 1.158 2.956 weight 1.000 ! spec=Expt_11, no=1365, id=1692, vol=1.633656e+08
assign (segid "   C" and resid   34 and name  HG2) (segid "   C" and resid   31 and name   HA) 3.044 1.158 2.956 weight 1.000 ! spec=Expt_11, no=1365, id=1692, vol=1.633656e+08
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   31 and name   HA) 2.933 1.076 3.067 weight 1.000 ! spec=Expt_11, no=1366, id=1693, vol=2.040399e+08
assign (segid "   C" and resid   34 and name  HG1) (segid "   C" and resid   31 and name   HA) 2.933 1.076 3.067 weight 1.000 ! spec=Expt_11, no=1366, id=1693, vol=2.040399e+08
assign (segid "   A" and resid   34 and name  HG1) (segid "   C" and resid   41 and name  HB2) 3.140 1.232 2.860 weight 1.000 ! spec=Expt_11, no=1367, id=1694, vol=1.356270e+08
assign (segid "   C" and resid   34 and name  HG1) (segid "   A" and resid   41 and name  HB2) 3.140 1.232 2.860 weight 1.000 ! spec=Expt_11, no=1367, id=1694, vol=1.356270e+08
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   29 and name HG22) 2.358 0.695 3.642 weight 1.000 ! spec=Expt_11, no=1368, id=1695, vol=7.557145e+08
    or (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   29 and name HG23)
assign (segid "   C" and resid   34 and name  HG2) (segid "   C" and resid   29 and name HG22) 2.358 0.695 3.642 weight 1.000 ! spec=Expt_11, no=1368, id=1695, vol=7.557145e+08
    or (segid "   C" and resid   34 and name  HG2) (segid "   C" and resid   29 and name HG21)
    or (segid "   C" and resid   34 and name  HG2) (segid "   C" and resid   29 and name HG23)
assign (segid "   A" and resid   22 and name HD12) (segid "   A" and resid   34 and name  HG2) 2.358 0.695 0.695 weight 1.000 ! spec=Expt_11, no=1369, id=1696, vol=7.557145e+08
    or (segid "   A" and resid   22 and name HD11) (segid "   A" and resid   34 and name  HG2)
    or (segid "   A" and resid   22 and name HD13) (segid "   A" and resid   34 and name  HG2)
assign (segid "   C" and resid   22 and name HD12) (segid "   C" and resid   34 and name  HG2) 2.358 0.695 0.695 weight 1.000 ! spec=Expt_11, no=1369, id=1696, vol=7.557145e+08
    or (segid "   C" and resid   22 and name HD11) (segid "   C" and resid   34 and name  HG2)
    or (segid "   C" and resid   22 and name HD13) (segid "   C" and resid   34 and name  HG2)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   34 and name  HG2) 2.284 0.652 3.716 weight 1.000 ! spec=Expt_11, no=1374, id=1700, vol=9.162105e+08
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   34 and name  HG2)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   34 and name  HG2)
assign (segid "   C" and resid   22 and name HG22) (segid "   C" and resid   34 and name  HG2) 2.284 0.652 3.716 weight 1.000 ! spec=Expt_11, no=1374, id=1700, vol=9.162105e+08
    or (segid "   C" and resid   22 and name HG21) (segid "   C" and resid   34 and name  HG2)
    or (segid "   C" and resid   22 and name HG23) (segid "   C" and resid   34 and name  HG2)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   35 and name   HA) 2.456 0.754 3.544 weight 1.000 ! spec=Expt_11, no=1376, id=1702, vol=5.922847e+08
assign (segid "   C" and resid   38 and name   HN) (segid "   C" and resid   35 and name   HA) 2.456 0.754 3.544 weight 1.000 ! spec=Expt_11, no=1376, id=1702, vol=5.922847e+08
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   39 and name   HN) 3.294 1.357 1.357 weight 1.000 ! spec=Expt_11, no=1378, id=1704, vol=1.017215e+08
assign (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   39 and name   HN) 3.294 1.357 1.357 weight 1.000 ! spec=Expt_11, no=1378, id=1704, vol=1.017215e+08
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   35 and name   HA) 2.436 0.742 0.742 weight 1.000 ! spec=Expt_11, no=1385, id=1709, vol=6.214632e+08
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   35 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   35 and name   HA)
assign (segid "   C" and resid   37 and name HG22) (segid "   C" and resid   35 and name   HA) 2.436 0.742 0.742 weight 1.000 ! spec=Expt_11, no=1385, id=1709, vol=6.214632e+08
    or (segid "   C" and resid   37 and name HG21) (segid "   C" and resid   35 and name   HA)
    or (segid "   C" and resid   37 and name HG23) (segid "   C" and resid   35 and name   HA)
assign (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   35 and name   HA) 2.762 0.954 0.954 weight 1.000 ! spec=Expt_11, no=1386, id=1710, vol=2.926805e+08
assign (segid "   C" and resid   38 and name HG11) (segid "   C" and resid   35 and name   HA) 2.762 0.954 0.954 weight 1.000 ! spec=Expt_11, no=1386, id=1710, vol=2.926805e+08
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name  HB2) 2.691 0.905 0.905 weight 1.000 ! spec=Expt_11, no=1388, id=1712, vol=3.424190e+08
assign (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   35 and name  HB2) 2.691 0.905 0.905 weight 1.000 ! spec=Expt_11, no=1388, id=1712, vol=3.424190e+08
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name  HB1) 2.777 0.964 0.964 weight 1.000 ! spec=Expt_11, no=1389, id=1713, vol=2.833393e+08
assign (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   35 and name  HB1) 2.777 0.964 0.964 weight 1.000 ! spec=Expt_11, no=1389, id=1713, vol=2.833393e+08
assign (segid "   A" and resid   35 and name  HD2) (segid "   A" and resid   35 and name  HB2) 2.816 0.992 0.992 weight 1.000 ! spec=Expt_11, no=1390, id=1714, vol=2.604763e+08
assign (segid "   C" and resid   35 and name  HD2) (segid "   C" and resid   35 and name  HB2) 2.816 0.992 0.992 weight 1.000 ! spec=Expt_11, no=1390, id=1714, vol=2.604763e+08
assign (segid "   A" and resid   35 and name  HD2) (segid "   A" and resid   35 and name  HB1) 2.783 0.968 0.968 weight 1.000 ! spec=Expt_11, no=1391, id=1715, vol=2.796917e+08
assign (segid "   C" and resid   35 and name  HD2) (segid "   C" and resid   35 and name  HB1) 2.783 0.968 0.968 weight 1.000 ! spec=Expt_11, no=1391, id=1715, vol=2.796917e+08
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name  HD2) 1.926 0.464 4.074 weight 1.000 ! spec=Expt_11, no=1400, id=1721, vol=2.543965e+09
assign (segid "   C" and resid   35 and name  HG2) (segid "   C" and resid   35 and name  HD2) 1.926 0.464 4.074 weight 1.000 ! spec=Expt_11, no=1400, id=1721, vol=2.543965e+09
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name  HD2) 3.134 1.228 2.866 weight 1.000 ! spec=Expt_11, no=1402, id=1723, vol=1.372739e+08
assign (segid "   C" and resid   36 and name   HN) (segid "   C" and resid   35 and name  HD2) 3.134 1.228 2.866 weight 1.000 ! spec=Expt_11, no=1402, id=1723, vol=1.372739e+08
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name   HA) 3.088 1.192 1.192 weight 1.000 ! spec=Expt_11, no=1403, id=1724, vol=1.497929e+08
assign (segid "   C" and resid   37 and name   HN) (segid "   C" and resid   36 and name   HA) 3.088 1.192 1.192 weight 1.000 ! spec=Expt_11, no=1403, id=1724, vol=1.497929e+08
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name   HA) 2.317 0.671 0.671 weight 1.000 ! spec=Expt_11, no=1406, id=1727, vol=8.413296e+08
assign (segid "   C" and resid   36 and name  HB2) (segid "   C" and resid   36 and name   HA) 2.317 0.671 0.671 weight 1.000 ! spec=Expt_11, no=1406, id=1727, vol=8.413296e+08
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name  HG2) 2.425 0.735 0.735 weight 1.000 ! spec=Expt_11, no=1407, id=1728, vol=6.400827e+08
assign (segid "   C" and resid   36 and name   HA) (segid "   C" and resid   36 and name  HG2) 2.425 0.735 0.735 weight 1.000 ! spec=Expt_11, no=1407, id=1728, vol=6.400827e+08
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   37 and name HG12) 3.145 1.237 2.737 weight 1.000 ! spec=Expt_11, no=1408, id=1729, vol=1.342587e+08
    or (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   37 and name HG13)
assign (segid "   C" and resid   36 and name   HA) (segid "   C" and resid   37 and name HG12) 3.145 1.237 2.737 weight 1.000 ! spec=Expt_11, no=1408, id=1729, vol=1.342587e+08
    or (segid "   C" and resid   36 and name   HA) (segid "   C" and resid   37 and name HG11)
    or (segid "   C" and resid   36 and name   HA) (segid "   C" and resid   37 and name HG13)
assign (segid "   A" and resid   36 and name   HA) (segid "   C" and resid   24 and name HD22) 3.153 1.243 2.243 weight 1.000 ! spec=Expt_11, no=1409, id=1730, vol=1.323260e+08
    or (segid "   A" and resid   36 and name   HA) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   36 and name   HA) (segid "   C" and resid   24 and name HD23)
assign (segid "   C" and resid   36 and name   HA) (segid "   A" and resid   24 and name HD22) 3.153 1.243 2.243 weight 1.000 ! spec=Expt_11, no=1409, id=1730, vol=1.323260e+08
    or (segid "   C" and resid   36 and name   HA) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   36 and name   HA) (segid "   A" and resid   24 and name HD23)
assign (segid "   A" and resid   36 and name   HA) (segid "   C" and resid   24 and name HD12) 3.132 1.226 2.868 weight 1.000 ! spec=Expt_11, no=1410, id=1731, vol=1.378246e+08
    or (segid "   A" and resid   36 and name   HA) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   36 and name   HA) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   36 and name   HA) (segid "   A" and resid   24 and name HD12) 3.132 1.226 2.868 weight 1.000 ! spec=Expt_11, no=1410, id=1731, vol=1.378246e+08
    or (segid "   C" and resid   36 and name   HA) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   36 and name   HA) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   38 and name   HN) 3.184 1.267 2.816 weight 1.000 ! spec=Expt_11, no=1411, id=1732, vol=1.247238e+08
assign (segid "   C" and resid   36 and name  HB1) (segid "   C" and resid   38 and name   HN) 3.184 1.267 2.816 weight 1.000 ! spec=Expt_11, no=1411, id=1732, vol=1.247238e+08
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HG1) 2.427 0.736 0.736 weight 1.000 ! spec=Expt_11, no=1415, id=1735, vol=6.364743e+08
assign (segid "   C" and resid   36 and name  HB1) (segid "   C" and resid   36 and name  HG1) 2.427 0.736 0.736 weight 1.000 ! spec=Expt_11, no=1415, id=1735, vol=6.364743e+08
assign (segid "   A" and resid   36 and name  HB1) (segid "   C" and resid   24 and name HD22) 2.544 0.809 0.809 weight 1.000 ! spec=Expt_11, no=1416, id=1736, vol=4.798748e+08
    or (segid "   A" and resid   36 and name  HB1) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   36 and name  HB1) (segid "   C" and resid   24 and name HD23)
assign (segid "   C" and resid   36 and name  HB1) (segid "   A" and resid   24 and name HD22) 2.544 0.809 0.809 weight 1.000 ! spec=Expt_11, no=1416, id=1736, vol=4.798748e+08
    or (segid "   C" and resid   36 and name  HB1) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   36 and name  HB1) (segid "   A" and resid   24 and name HD23)
assign (segid "   A" and resid   36 and name  HB2) (segid "   C" and resid   24 and name HD22) 2.721 0.925 0.925 weight 1.000 ! spec=Expt_11, no=1417, id=1737, vol=3.203517e+08
    or (segid "   A" and resid   36 and name  HB2) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   36 and name  HB2) (segid "   C" and resid   24 and name HD23)
assign (segid "   C" and resid   36 and name  HB2) (segid "   A" and resid   24 and name HD22) 2.721 0.925 0.925 weight 1.000 ! spec=Expt_11, no=1417, id=1737, vol=3.203517e+08
    or (segid "   C" and resid   36 and name  HB2) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   36 and name  HB2) (segid "   A" and resid   24 and name HD23)
assign (segid "   A" and resid   36 and name  HB2) (segid "   C" and resid   24 and name HD12) 2.596 0.842 0.842 weight 1.000 ! spec=Expt_11, no=1418, id=1738, vol=4.247812e+08
    or (segid "   A" and resid   36 and name  HB2) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   36 and name  HB2) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   36 and name  HB2) (segid "   A" and resid   24 and name HD12) 2.596 0.842 0.842 weight 1.000 ! spec=Expt_11, no=1418, id=1738, vol=4.247812e+08
    or (segid "   C" and resid   36 and name  HB2) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   36 and name  HB2) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HE2) 2.783 0.968 0.968 weight 1.000 ! spec=Expt_11, no=1422, id=1742, vol=2.800320e+08
assign (segid "   C" and resid   36 and name  HG2) (segid "   C" and resid   36 and name  HE2) 2.783 0.968 0.968 weight 1.000 ! spec=Expt_11, no=1422, id=1742, vol=2.800320e+08
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HB1) 2.400 0.720 0.720 weight 1.000 ! spec=Expt_11, no=1423, id=1743, vol=6.802799e+08
assign (segid "   C" and resid   36 and name  HG2) (segid "   C" and resid   36 and name  HB1) 2.400 0.720 0.720 weight 1.000 ! spec=Expt_11, no=1423, id=1743, vol=6.802799e+08
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HB2) 2.557 0.818 0.818 weight 1.000 ! spec=Expt_11, no=1424, id=1744, vol=4.646477e+08
assign (segid "   C" and resid   36 and name  HG2) (segid "   C" and resid   36 and name  HB2) 2.557 0.818 0.818 weight 1.000 ! spec=Expt_11, no=1424, id=1744, vol=4.646477e+08
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name  HG1) 2.615 0.854 0.854 weight 1.000 ! spec=Expt_11, no=1426, id=1746, vol=4.070266e+08
assign (segid "   C" and resid   36 and name  HB2) (segid "   C" and resid   36 and name  HG1) 2.615 0.854 0.854 weight 1.000 ! spec=Expt_11, no=1426, id=1746, vol=4.070266e+08
assign (segid "   A" and resid   36 and name  HG1) (segid "   C" and resid   24 and name HD12) 2.935 1.077 3.065 weight 1.000 ! spec=Expt_11, no=1428, id=1748, vol=2.031918e+08
    or (segid "   A" and resid   36 and name  HG1) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   36 and name  HG1) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   36 and name  HG1) (segid "   A" and resid   24 and name HD12) 2.935 1.077 3.065 weight 1.000 ! spec=Expt_11, no=1428, id=1748, vol=2.031918e+08
    or (segid "   C" and resid   36 and name  HG1) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   36 and name  HG1) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   36 and name  HG2) (segid "   C" and resid   24 and name HD12) 2.995 1.121 3.005 weight 1.000 ! spec=Expt_11, no=1430, id=1750, vol=1.802901e+08
    or (segid "   A" and resid   36 and name  HG2) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   36 and name  HG2) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   36 and name  HG2) (segid "   A" and resid   24 and name HD12) 2.995 1.121 3.005 weight 1.000 ! spec=Expt_11, no=1430, id=1750, vol=1.802901e+08
    or (segid "   C" and resid   36 and name  HG2) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   36 and name  HG2) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   36 and name  HD2) (segid "   A" and resid   36 and name   HA) 2.578 0.831 3.422 weight 1.000 ! spec=Expt_11, no=1432, id=1752, vol=4.424407e+08
assign (segid "   C" and resid   36 and name  HD2) (segid "   C" and resid   36 and name   HA) 2.578 0.831 3.422 weight 1.000 ! spec=Expt_11, no=1432, id=1752, vol=4.424407e+08
assign (segid "   A" and resid   36 and name  HE2) (segid "   C" and resid   25 and name  HE1) 3.107 1.207 1.207 weight 1.000 ! spec=Expt_11, no=1433, id=1753, vol=1.444528e+08
    or (segid "   A" and resid   36 and name  HE2) (segid "   C" and resid   25 and name  HE2)
assign (segid "   C" and resid   36 and name  HE2) (segid "   A" and resid   25 and name  HE1) 3.107 1.207 1.207 weight 1.000 ! spec=Expt_11, no=1433, id=1753, vol=1.444528e+08
    or (segid "   C" and resid   36 and name  HE2) (segid "   A" and resid   25 and name  HE2)
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   36 and name   HA) 3.083 1.188 2.917 weight 1.000 ! spec=Expt_11, no=1434, id=1754, vol=1.513114e+08
assign (segid "   C" and resid   36 and name  HE2) (segid "   C" and resid   36 and name   HA) 3.083 1.188 2.917 weight 1.000 ! spec=Expt_11, no=1434, id=1754, vol=1.513114e+08
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   37 and name   HA) 3.325 1.382 1.382 weight 1.000 ! spec=Expt_11, no=1438, id=1756, vol=9.619666e+07
assign (segid "   C" and resid   40 and name   HN) (segid "   C" and resid   37 and name   HA) 3.325 1.382 1.382 weight 1.000 ! spec=Expt_11, no=1438, id=1756, vol=9.619666e+07
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   40 and name HG21) 2.989 1.117 1.117 weight 1.000 ! spec=Expt_11, no=1440, id=1758, vol=1.822588e+08
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   40 and name HG23)
assign (segid "   C" and resid   37 and name   HA) (segid "   C" and resid   40 and name HG21) 2.989 1.117 1.117 weight 1.000 ! spec=Expt_11, no=1440, id=1758, vol=1.822588e+08
    or (segid "   C" and resid   37 and name   HA) (segid "   C" and resid   40 and name HG22)
    or (segid "   C" and resid   37 and name   HA) (segid "   C" and resid   40 and name HG23)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   37 and name HG22) 3.325 1.382 1.382 weight 1.000 ! spec=Expt_11, no=1445, id=1761, vol=9.617070e+07
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   37 and name HG22) 3.325 1.382 1.382 weight 1.000 ! spec=Expt_11, no=1445, id=1761, vol=9.617070e+07
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   37 and name HG21)
    or (segid "   C" and resid   34 and name   HN) (segid "   C" and resid   37 and name HG23)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   39 and name   HA) 3.006 1.130 2.994 weight 1.000 ! spec=Expt_11, no=1446, id=1762, vol=1.762006e+08
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   39 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   39 and name   HA)
assign (segid "   C" and resid   37 and name HG22) (segid "   C" and resid   39 and name   HA) 3.006 1.130 2.994 weight 1.000 ! spec=Expt_11, no=1446, id=1762, vol=1.762006e+08
    or (segid "   C" and resid   37 and name HG21) (segid "   C" and resid   39 and name   HA)
    or (segid "   C" and resid   37 and name HG23) (segid "   C" and resid   39 and name   HA)
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   37 and name   HB) 3.274 1.340 1.340 weight 1.000 ! spec=Expt_11, no=1448, id=1763, vol=1.055371e+08
assign (segid "   C" and resid   38 and name   HA) (segid "   C" and resid   37 and name   HB) 3.274 1.340 1.340 weight 1.000 ! spec=Expt_11, no=1448, id=1763, vol=1.055371e+08
assign (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   38 and name   HA) 2.419 0.732 1.732 weight 1.000 ! spec=Expt_11, no=1450, id=1765, vol=6.483909e+08
assign (segid "   C" and resid   38 and name HG12) (segid "   C" and resid   38 and name   HA) 2.419 0.732 1.732 weight 1.000 ! spec=Expt_11, no=1450, id=1765, vol=6.483909e+08
assign (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   38 and name   HA) 2.440 0.744 0.744 weight 1.000 ! spec=Expt_11, no=1451, id=1766, vol=6.155276e+08
assign (segid "   C" and resid   38 and name   HB) (segid "   C" and resid   38 and name   HA) 2.440 0.744 0.744 weight 1.000 ! spec=Expt_11, no=1451, id=1766, vol=6.155276e+08
assign (segid "   A" and resid   38 and name   HA) (segid "   C" and resid   38 and name HD12) 2.082 0.542 3.918 weight 1.000 ! spec=Expt_11, no=1452, id=1767, vol=1.596434e+09
    or (segid "   A" and resid   38 and name   HA) (segid "   C" and resid   38 and name HD11)
    or (segid "   A" and resid   38 and name   HA) (segid "   C" and resid   38 and name HD13)
assign (segid "   C" and resid   38 and name   HA) (segid "   A" and resid   38 and name HD12) 2.082 0.542 3.918 weight 1.000 ! spec=Expt_11, no=1452, id=1767, vol=1.596434e+09
    or (segid "   C" and resid   38 and name   HA) (segid "   A" and resid   38 and name HD11)
    or (segid "   C" and resid   38 and name   HA) (segid "   A" and resid   38 and name HD13)
assign (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   38 and name HG11) 2.360 0.696 0.696 weight 1.000 ! spec=Expt_11, no=1454, id=1769, vol=7.525056e+08
assign (segid "   C" and resid   38 and name   HB) (segid "   C" and resid   38 and name HG11) 2.360 0.696 0.696 weight 1.000 ! spec=Expt_11, no=1454, id=1769, vol=7.525056e+08
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   38 and name HG12) 2.784 0.969 0.969 weight 1.000 ! spec=Expt_11, no=1456, id=1770, vol=2.793684e+08
assign (segid "   C" and resid   35 and name   HA) (segid "   C" and resid   38 and name HG12) 2.784 0.969 0.969 weight 1.000 ! spec=Expt_11, no=1456, id=1770, vol=2.793684e+08
assign (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   38 and name HG22) 2.089 0.546 3.911 weight 1.000 ! spec=Expt_11, no=1458, id=1772, vol=1.562651e+09
    or (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   38 and name HG23)
assign (segid "   C" and resid   38 and name HG12) (segid "   C" and resid   38 and name HG22) 2.089 0.546 3.911 weight 1.000 ! spec=Expt_11, no=1458, id=1772, vol=1.562651e+09
    or (segid "   C" and resid   38 and name HG12) (segid "   C" and resid   38 and name HG21)
    or (segid "   C" and resid   38 and name HG12) (segid "   C" and resid   38 and name HG23)
assign (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name HG12) 2.146 0.576 0.576 weight 1.000 ! spec=Expt_11, no=1459, id=1773, vol=1.331649e+09
assign (segid "   C" and resid   38 and name HG11) (segid "   C" and resid   38 and name HG12) 2.146 0.576 0.576 weight 1.000 ! spec=Expt_11, no=1459, id=1773, vol=1.331649e+09
assign (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name HG22) 2.053 0.527 3.947 weight 1.000 ! spec=Expt_11, no=1460, id=1774, vol=1.734852e+09
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name HG23)
assign (segid "   C" and resid   38 and name HG11) (segid "   C" and resid   38 and name HG22) 2.053 0.527 3.947 weight 1.000 ! spec=Expt_11, no=1460, id=1774, vol=1.734852e+09
    or (segid "   C" and resid   38 and name HG11) (segid "   C" and resid   38 and name HG21)
    or (segid "   C" and resid   38 and name HG11) (segid "   C" and resid   38 and name HG23)
assign (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   38 and name HD12) 2.036 0.518 3.964 weight 1.000 ! spec=Expt_11, no=1462, id=1776, vol=1.822682e+09
    or (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   38 and name HD11)
    or (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   38 and name HD13)
assign (segid "   C" and resid   38 and name   HB) (segid "   C" and resid   38 and name HD12) 2.036 0.518 3.964 weight 1.000 ! spec=Expt_11, no=1462, id=1776, vol=1.822682e+09
    or (segid "   C" and resid   38 and name   HB) (segid "   C" and resid   38 and name HD11)
    or (segid "   C" and resid   38 and name   HB) (segid "   C" and resid   38 and name HD13)
assign (segid "   A" and resid   13 and name HD12) (segid "   A" and resid   34 and name   HA) 3.009 1.132 2.991 weight 1.000 ! spec=Expt_11, no=1466, id=1779, vol=1.751396e+08
    or (segid "   A" and resid   13 and name HD11) (segid "   A" and resid   34 and name   HA)
    or (segid "   A" and resid   13 and name HD13) (segid "   A" and resid   34 and name   HA)
assign (segid "   C" and resid   13 and name HD12) (segid "   C" and resid   34 and name   HA) 3.009 1.132 2.991 weight 1.000 ! spec=Expt_11, no=1466, id=1779, vol=1.751396e+08
    or (segid "   C" and resid   13 and name HD11) (segid "   C" and resid   34 and name   HA)
    or (segid "   C" and resid   13 and name HD13) (segid "   C" and resid   34 and name   HA)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   29 and name HG12) 2.548 0.811 0.811 weight 1.000 ! spec=Expt_12, no=1, id=1855, vol=3.388830e+07
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   29 and name HG12)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   29 and name HG12)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   29 and name HG12) 2.548 0.811 0.811 weight 1.000 ! spec=Expt_12, no=1, id=1855, vol=3.388830e+07
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   29 and name HG12)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   29 and name HG12)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   24 and name  HB1) 2.290 0.656 3.710 weight 1.000 ! spec=Expt_12, no=2, id=1856, vol=6.424044e+07
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   24 and name  HB1)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   24 and name  HB1)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   24 and name  HB1) 2.290 0.656 3.710 weight 1.000 ! spec=Expt_12, no=2, id=1856, vol=6.424044e+07
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   24 and name  HB1)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   24 and name  HB1)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   12 and name HG22) 2.339 0.684 3.661 weight 1.000 ! spec=Expt_12, no=3, id=1857, vol=5.652633e+07
    or (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   12 and name HG21)
    or (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   12 and name HG23)
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   12 and name HG22)
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   12 and name HG21)
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   12 and name HG23)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   12 and name HG22)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   12 and name HG21)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   12 and name HG23)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   12 and name HG22) 2.339 0.684 3.661 weight 1.000 ! spec=Expt_12, no=3, id=1857, vol=5.652633e+07
    or (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   12 and name HG21)
    or (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   12 and name HG23)
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   12 and name HG22)
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   12 and name HG21)
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   12 and name HG23)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   12 and name HG22)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   12 and name HG21)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   12 and name HG22) (segid "   C" and resid   12 and name   HB) 2.660 0.884 1.884 weight 1.000 ! spec=Expt_12, no=6, id=1860, vol=2.615681e+07
    or (segid "   A" and resid   12 and name HG21) (segid "   C" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG23) (segid "   C" and resid   12 and name   HB)
assign (segid "   C" and resid   12 and name HG22) (segid "   A" and resid   12 and name   HB) 2.660 0.884 1.884 weight 1.000 ! spec=Expt_12, no=6, id=1860, vol=2.615681e+07
    or (segid "   C" and resid   12 and name HG21) (segid "   A" and resid   12 and name   HB)
    or (segid "   C" and resid   12 and name HG23) (segid "   A" and resid   12 and name   HB)
assign (segid "   A" and resid   12 and name HG22) (segid "   C" and resid   13 and name HG12) 2.979 1.109 3.021 weight 1.000 ! spec=Expt_12, no=8, id=1862, vol=1.325705e+07
    or (segid "   A" and resid   12 and name HG21) (segid "   C" and resid   13 and name HG12)
    or (segid "   A" and resid   12 and name HG23) (segid "   C" and resid   13 and name HG12)
assign (segid "   C" and resid   12 and name HG22) (segid "   A" and resid   13 and name HG12) 2.979 1.109 3.021 weight 1.000 ! spec=Expt_12, no=8, id=1862, vol=1.325705e+07
    or (segid "   C" and resid   12 and name HG21) (segid "   A" and resid   13 and name HG12)
    or (segid "   C" and resid   12 and name HG23) (segid "   A" and resid   13 and name HG12)
assign (segid "   A" and resid   13 and name HD12) (segid "   C" and resid   12 and name   HB) 2.983 1.112 3.017 weight 1.000 ! spec=Expt_12, no=9, id=1863, vol=1.314934e+07
    or (segid "   A" and resid   13 and name HD11) (segid "   C" and resid   12 and name   HB)
    or (segid "   A" and resid   13 and name HD13) (segid "   C" and resid   12 and name   HB)
assign (segid "   C" and resid   13 and name HD12) (segid "   A" and resid   12 and name   HB) 2.983 1.112 3.017 weight 1.000 ! spec=Expt_12, no=9, id=1863, vol=1.314934e+07
    or (segid "   C" and resid   13 and name HD11) (segid "   A" and resid   12 and name   HB)
    or (segid "   C" and resid   13 and name HD13) (segid "   A" and resid   12 and name   HB)
assign (segid "   A" and resid   22 and name HD12) (segid "   C" and resid   37 and name   HA) 2.488 0.773 0.773 weight 1.000 ! spec=Expt_12, no=12, id=1866, vol=3.910174e+07
    or (segid "   A" and resid   22 and name HD11) (segid "   C" and resid   37 and name   HA)
    or (segid "   A" and resid   22 and name HD13) (segid "   C" and resid   37 and name   HA)
assign (segid "   C" and resid   22 and name HD12) (segid "   A" and resid   37 and name   HA) 2.488 0.773 0.773 weight 1.000 ! spec=Expt_12, no=12, id=1866, vol=3.910174e+07
    or (segid "   C" and resid   22 and name HD11) (segid "   A" and resid   37 and name   HA)
    or (segid "   C" and resid   22 and name HD13) (segid "   A" and resid   37 and name   HA)
assign (segid "   A" and resid   22 and name HD12) (segid "   C" and resid   40 and name   HB) 2.610 0.852 0.852 weight 1.000 ! spec=Expt_12, no=13, id=1867, vol=2.930245e+07
    or (segid "   A" and resid   22 and name HD11) (segid "   C" and resid   40 and name   HB)
    or (segid "   A" and resid   22 and name HD13) (segid "   C" and resid   40 and name   HB)
assign (segid "   C" and resid   22 and name HD12) (segid "   A" and resid   40 and name   HB) 2.610 0.852 0.852 weight 1.000 ! spec=Expt_12, no=13, id=1867, vol=2.930245e+07
    or (segid "   C" and resid   22 and name HD11) (segid "   A" and resid   40 and name   HB)
    or (segid "   C" and resid   22 and name HD13) (segid "   A" and resid   40 and name   HB)
assign (segid "   A" and resid   38 and name HD12) (segid "   C" and resid   39 and name   HA) 3.078 1.184 2.922 weight 1.000 ! spec=Expt_12, no=14, id=1868, vol=1.089008e+07
    or (segid "   A" and resid   38 and name HD11) (segid "   C" and resid   39 and name   HA)
    or (segid "   A" and resid   38 and name HD13) (segid "   C" and resid   39 and name   HA)
assign (segid "   C" and resid   38 and name HD12) (segid "   A" and resid   39 and name   HA) 3.078 1.184 2.922 weight 1.000 ! spec=Expt_12, no=14, id=1868, vol=1.089008e+07
    or (segid "   C" and resid   38 and name HD11) (segid "   A" and resid   39 and name   HA)
    or (segid "   C" and resid   38 and name HD13) (segid "   A" and resid   39 and name   HA)
assign (segid "   A" and resid   38 and name HD12) (segid "   C" and resid   35 and name   HA) 2.479 0.768 3.521 weight 1.000 ! spec=Expt_12, no=15, id=1869, vol=3.995902e+07
    or (segid "   A" and resid   38 and name HD11) (segid "   C" and resid   35 and name   HA)
    or (segid "   A" and resid   38 and name HD13) (segid "   C" and resid   35 and name   HA)
assign (segid "   C" and resid   38 and name HD12) (segid "   A" and resid   35 and name   HA) 2.479 0.768 3.521 weight 1.000 ! spec=Expt_12, no=15, id=1869, vol=3.995902e+07
    or (segid "   C" and resid   38 and name HD11) (segid "   A" and resid   35 and name   HA)
    or (segid "   C" and resid   38 and name HD13) (segid "   A" and resid   35 and name   HA)
assign (segid "   A" and resid   38 and name HD12) (segid "   C" and resid   38 and name   HB) 2.988 1.116 1.116 weight 1.000 ! spec=Expt_12, no=17, id=1871, vol=1.300576e+07
    or (segid "   A" and resid   38 and name HD11) (segid "   C" and resid   38 and name   HB)
    or (segid "   A" and resid   38 and name HD13) (segid "   C" and resid   38 and name   HB)
assign (segid "   C" and resid   38 and name HD12) (segid "   A" and resid   38 and name   HB) 2.988 1.116 1.116 weight 1.000 ! spec=Expt_12, no=17, id=1871, vol=1.300576e+07
    or (segid "   C" and resid   38 and name HD11) (segid "   A" and resid   38 and name   HB)
    or (segid "   C" and resid   38 and name HD13) (segid "   A" and resid   38 and name   HB)
assign (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   13 and name HG22) 2.373 0.704 3.627 weight 1.000 ! spec=Expt_12, no=18, id=1872, vol=5.188141e+07
    or (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   13 and name HG23)
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   13 and name HG22)
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   13 and name HG23)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   13 and name HG22)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   13 and name HG22) 2.373 0.704 3.627 weight 1.000 ! spec=Expt_12, no=18, id=1872, vol=5.188141e+07
    or (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   13 and name HG23)
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   13 and name HG22)
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   13 and name HG23)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   13 and name HG22)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   13 and name HG12) 2.754 0.948 2.948 weight 1.000 ! spec=Expt_12, no=19, id=1873, vol=2.124112e+07
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   13 and name HG12)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   13 and name HG12)
assign (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   13 and name HG12) 2.754 0.948 2.948 weight 1.000 ! spec=Expt_12, no=19, id=1873, vol=2.124112e+07
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   13 and name HG12)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   13 and name HG12)
assign (segid "   A" and resid   38 and name HG22) (segid "   C" and resid   38 and name   HB) 3.110 1.209 1.209 weight 1.000 ! spec=Expt_12, no=20, id=1874, vol=1.024484e+07
    or (segid "   A" and resid   38 and name HG21) (segid "   C" and resid   38 and name   HB)
    or (segid "   A" and resid   38 and name HG23) (segid "   C" and resid   38 and name   HB)
assign (segid "   C" and resid   38 and name HG22) (segid "   A" and resid   38 and name   HB) 3.110 1.209 1.209 weight 1.000 ! spec=Expt_12, no=20, id=1874, vol=1.024484e+07
    or (segid "   C" and resid   38 and name HG21) (segid "   A" and resid   38 and name   HB)
    or (segid "   C" and resid   38 and name HG23) (segid "   A" and resid   38 and name   HB)
assign (segid "   A" and resid   38 and name HG22) (segid "   C" and resid   38 and name HG12) 3.017 1.137 2.137 weight 1.000 ! spec=Expt_12, no=21, id=1875, vol=1.229672e+07
    or (segid "   A" and resid   38 and name HG21) (segid "   C" and resid   38 and name HG12)
    or (segid "   A" and resid   38 and name HG23) (segid "   C" and resid   38 and name HG12)
assign (segid "   C" and resid   38 and name HG22) (segid "   A" and resid   38 and name HG12) 3.017 1.137 2.137 weight 1.000 ! spec=Expt_12, no=21, id=1875, vol=1.229672e+07
    or (segid "   C" and resid   38 and name HG21) (segid "   A" and resid   38 and name HG12)
    or (segid "   C" and resid   38 and name HG23) (segid "   A" and resid   38 and name HG12)
assign (segid "   A" and resid   29 and name HG22) (segid "   C" and resid   12 and name HG12) 2.897 1.049 3.103 weight 1.000 ! spec=Expt_12, no=26, id=1880, vol=1.567361e+07
    or (segid "   A" and resid   29 and name HG22) (segid "   C" and resid   12 and name HG11)
    or (segid "   A" and resid   29 and name HG22) (segid "   C" and resid   12 and name HG13)
    or (segid "   A" and resid   29 and name HG21) (segid "   C" and resid   12 and name HG12)
    or (segid "   A" and resid   29 and name HG21) (segid "   C" and resid   12 and name HG11)
    or (segid "   A" and resid   29 and name HG21) (segid "   C" and resid   12 and name HG13)
    or (segid "   A" and resid   29 and name HG23) (segid "   C" and resid   12 and name HG12)
    or (segid "   A" and resid   29 and name HG23) (segid "   C" and resid   12 and name HG11)
    or (segid "   A" and resid   29 and name HG23) (segid "   C" and resid   12 and name HG13)
assign (segid "   C" and resid   29 and name HG22) (segid "   A" and resid   12 and name HG12) 2.897 1.049 3.103 weight 1.000 ! spec=Expt_12, no=26, id=1880, vol=1.567361e+07
    or (segid "   C" and resid   29 and name HG22) (segid "   A" and resid   12 and name HG11)
    or (segid "   C" and resid   29 and name HG22) (segid "   A" and resid   12 and name HG13)
    or (segid "   C" and resid   29 and name HG21) (segid "   A" and resid   12 and name HG12)
    or (segid "   C" and resid   29 and name HG21) (segid "   A" and resid   12 and name HG11)
    or (segid "   C" and resid   29 and name HG21) (segid "   A" and resid   12 and name HG13)
    or (segid "   C" and resid   29 and name HG23) (segid "   A" and resid   12 and name HG12)
    or (segid "   C" and resid   29 and name HG23) (segid "   A" and resid   12 and name HG11)
    or (segid "   C" and resid   29 and name HG23) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   25 and name  HD1) 2.250 0.633 0.633 weight 1.000 ! spec=Expt_12, no=27, id=1881, vol=7.134718e+07
    or (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   25 and name  HD2)
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   25 and name  HD1)
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   25 and name  HD2)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   25 and name  HD1)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   25 and name  HD2)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   25 and name  HD1) 2.250 0.633 0.633 weight 1.000 ! spec=Expt_12, no=27, id=1881, vol=7.134718e+07
    or (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   25 and name  HD2)
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   25 and name  HD1)
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   25 and name  HD2)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   25 and name  HD1)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   25 and name  HD2)
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   24 and name  HB1) 2.134 0.569 1.569 weight 1.000 ! spec=Expt_12, no=28, id=1882, vol=9.803721e+07
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   24 and name  HB1)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   24 and name  HB1)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   24 and name  HB1) 2.134 0.569 1.569 weight 1.000 ! spec=Expt_12, no=28, id=1882, vol=9.803721e+07
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   24 and name  HB1)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   24 and name  HB1)
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   24 and name HD22) 2.075 0.538 3.925 weight 1.000 ! spec=Expt_12, no=29, id=1883, vol=1.159707e+08
    or (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   24 and name HD23)
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   24 and name HD22)
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   24 and name HD23)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   24 and name HD22)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   24 and name HD23)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   24 and name HD22) 2.075 0.538 3.925 weight 1.000 ! spec=Expt_12, no=29, id=1883, vol=1.159707e+08
    or (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   24 and name HD23)
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   24 and name HD22)
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   24 and name HD23)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   24 and name HD22)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   24 and name HD23)
assign (segid "   A" and resid   12 and name HG22) (segid "   C" and resid   13 and name   HA) 2.814 0.990 3.186 weight 1.000 ! spec=Expt_12, no=32, id=1886, vol=1.867063e+07
    or (segid "   A" and resid   12 and name HG21) (segid "   C" and resid   13 and name   HA)
    or (segid "   A" and resid   12 and name HG23) (segid "   C" and resid   13 and name   HA)
assign (segid "   C" and resid   12 and name HG22) (segid "   A" and resid   13 and name   HA) 2.814 0.990 3.186 weight 1.000 ! spec=Expt_12, no=32, id=1886, vol=1.867063e+07
    or (segid "   C" and resid   12 and name HG21) (segid "   A" and resid   13 and name   HA)
    or (segid "   C" and resid   12 and name HG23) (segid "   A" and resid   13 and name   HA)
assign (segid "   A" and resid   37 and name HG22) (segid "   C" and resid   37 and name   HB) 2.437 0.742 0.742 weight 1.000 ! spec=Expt_12, no=33, id=1887, vol=4.424148e+07
    or (segid "   A" and resid   37 and name HG21) (segid "   C" and resid   37 and name   HB)
    or (segid "   A" and resid   37 and name HG23) (segid "   C" and resid   37 and name   HB)
assign (segid "   C" and resid   37 and name HG22) (segid "   A" and resid   37 and name   HB) 2.437 0.742 0.742 weight 1.000 ! spec=Expt_12, no=33, id=1887, vol=4.424148e+07
    or (segid "   C" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HB)
    or (segid "   C" and resid   37 and name HG23) (segid "   A" and resid   37 and name   HB)
assign (segid "   A" and resid   37 and name HG22) (segid "   C" and resid   34 and name  HG2) 2.698 0.910 1.910 weight 1.000 ! spec=Expt_12, no=34, id=1888, vol=2.400827e+07
    or (segid "   A" and resid   37 and name HG21) (segid "   C" and resid   34 and name  HG2)
    or (segid "   A" and resid   37 and name HG23) (segid "   C" and resid   34 and name  HG2)
assign (segid "   C" and resid   37 and name HG22) (segid "   A" and resid   34 and name  HG2) 2.698 0.910 1.910 weight 1.000 ! spec=Expt_12, no=34, id=1888, vol=2.400827e+07
    or (segid "   C" and resid   37 and name HG21) (segid "   A" and resid   34 and name  HG2)
    or (segid "   C" and resid   37 and name HG23) (segid "   A" and resid   34 and name  HG2)
assign (segid "   A" and resid   37 and name HG22) (segid "   C" and resid   34 and name  HG1) 2.523 0.795 3.477 weight 1.000 ! spec=Expt_12, no=35, id=1889, vol=3.595314e+07
    or (segid "   A" and resid   37 and name HG21) (segid "   C" and resid   34 and name  HG1)
    or (segid "   A" and resid   37 and name HG23) (segid "   C" and resid   34 and name  HG1)
assign (segid "   C" and resid   37 and name HG22) (segid "   A" and resid   34 and name  HG1) 2.523 0.795 3.477 weight 1.000 ! spec=Expt_12, no=35, id=1889, vol=3.595314e+07
    or (segid "   C" and resid   37 and name HG21) (segid "   A" and resid   34 and name  HG1)
    or (segid "   C" and resid   37 and name HG23) (segid "   A" and resid   34 and name  HG1)
assign (segid "   A" and resid   37 and name HG22) (segid "   C" and resid   34 and name   HA) 2.486 0.772 3.514 weight 1.000 ! spec=Expt_12, no=37, id=1891, vol=3.926644e+07
    or (segid "   A" and resid   37 and name HG21) (segid "   C" and resid   34 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   C" and resid   34 and name   HA)
assign (segid "   C" and resid   37 and name HG22) (segid "   A" and resid   34 and name   HA) 2.486 0.772 3.514 weight 1.000 ! spec=Expt_12, no=37, id=1891, vol=3.926644e+07
    or (segid "   C" and resid   37 and name HG21) (segid "   A" and resid   34 and name   HA)
    or (segid "   C" and resid   37 and name HG23) (segid "   A" and resid   34 and name   HA)
assign (segid "   A" and resid   40 and name HG21) (segid "   C" and resid   22 and name HD12) 2.111 0.557 0.557 weight 1.000 ! spec=Expt_12, no=38, id=1892, vol=1.046942e+08
    or (segid "   A" and resid   40 and name HG21) (segid "   C" and resid   22 and name HD11)
    or (segid "   A" and resid   40 and name HG21) (segid "   C" and resid   22 and name HD13)
    or (segid "   A" and resid   40 and name HG22) (segid "   C" and resid   22 and name HD12)
    or (segid "   A" and resid   40 and name HG22) (segid "   C" and resid   22 and name HD11)
    or (segid "   A" and resid   40 and name HG22) (segid "   C" and resid   22 and name HD13)
    or (segid "   A" and resid   40 and name HG23) (segid "   C" and resid   22 and name HD12)
    or (segid "   A" and resid   40 and name HG23) (segid "   C" and resid   22 and name HD11)
    or (segid "   A" and resid   40 and name HG23) (segid "   C" and resid   22 and name HD13)
assign (segid "   C" and resid   40 and name HG21) (segid "   A" and resid   22 and name HD12) 2.111 0.557 0.557 weight 1.000 ! spec=Expt_12, no=38, id=1892, vol=1.046942e+08
    or (segid "   C" and resid   40 and name HG21) (segid "   A" and resid   22 and name HD11)
    or (segid "   C" and resid   40 and name HG21) (segid "   A" and resid   22 and name HD13)
    or (segid "   C" and resid   40 and name HG22) (segid "   A" and resid   22 and name HD12)
    or (segid "   C" and resid   40 and name HG22) (segid "   A" and resid   22 and name HD11)
    or (segid "   C" and resid   40 and name HG22) (segid "   A" and resid   22 and name HD13)
    or (segid "   C" and resid   40 and name HG23) (segid "   A" and resid   22 and name HD12)
    or (segid "   C" and resid   40 and name HG23) (segid "   A" and resid   22 and name HD11)
    or (segid "   C" and resid   40 and name HG23) (segid "   A" and resid   22 and name HD13)
assign (segid "   A" and resid   26 and name HG21) (segid "   C" and resid   13 and name   HA) 2.494 0.778 3.506 weight 1.000 ! spec=Expt_12, no=40, id=1894, vol=3.849535e+07
    or (segid "   A" and resid   26 and name HG22) (segid "   C" and resid   13 and name   HA)
    or (segid "   A" and resid   26 and name HG23) (segid "   C" and resid   13 and name   HA)
assign (segid "   C" and resid   26 and name HG21) (segid "   A" and resid   13 and name   HA) 2.494 0.778 3.506 weight 1.000 ! spec=Expt_12, no=40, id=1894, vol=3.849535e+07
    or (segid "   C" and resid   26 and name HG22) (segid "   A" and resid   13 and name   HA)
    or (segid "   C" and resid   26 and name HG23) (segid "   A" and resid   13 and name   HA)
assign (segid "   A" and resid   12 and name HG12) (segid "   C" and resid   12 and name   HB) 3.009 1.132 1.132 weight 1.000 ! spec=Expt_12, no=41, id=1895, vol=1.248489e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   C" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG13) (segid "   C" and resid   12 and name   HB)
assign (segid "   C" and resid   12 and name HG12) (segid "   A" and resid   12 and name   HB) 3.009 1.132 1.132 weight 1.000 ! spec=Expt_12, no=41, id=1895, vol=1.248489e+07
    or (segid "   C" and resid   12 and name HG11) (segid "   A" and resid   12 and name   HB)
    or (segid "   C" and resid   12 and name HG13) (segid "   A" and resid   12 and name   HB)
assign (segid "   A" and resid   37 and name HG12) (segid "   C" and resid   37 and name   HB) 2.983 1.113 3.017 weight 1.000 ! spec=Expt_12, no=43, id=1896, vol=1.314190e+07
    or (segid "   A" and resid   37 and name HG11) (segid "   C" and resid   37 and name   HB)
    or (segid "   A" and resid   37 and name HG13) (segid "   C" and resid   37 and name   HB)
assign (segid "   C" and resid   37 and name HG12) (segid "   A" and resid   37 and name   HB) 2.983 1.113 3.017 weight 1.000 ! spec=Expt_12, no=43, id=1896, vol=1.314190e+07
    or (segid "   C" and resid   37 and name HG11) (segid "   A" and resid   37 and name   HB)
    or (segid "   C" and resid   37 and name HG13) (segid "   A" and resid   37 and name   HB)
assign (segid "   A" and resid   37 and name HG12) (segid "   C" and resid   24 and name   HG) 2.800 0.980 0.980 weight 1.000 ! spec=Expt_12, no=44, id=1897, vol=1.923304e+07
    or (segid "   A" and resid   37 and name HG11) (segid "   C" and resid   24 and name   HG)
    or (segid "   A" and resid   37 and name HG13) (segid "   C" and resid   24 and name   HG)
assign (segid "   C" and resid   37 and name HG12) (segid "   A" and resid   24 and name   HG) 2.800 0.980 0.980 weight 1.000 ! spec=Expt_12, no=44, id=1897, vol=1.923304e+07
    or (segid "   C" and resid   37 and name HG11) (segid "   A" and resid   24 and name   HG)
    or (segid "   C" and resid   37 and name HG13) (segid "   A" and resid   24 and name   HG)
assign (segid "   A" and resid   37 and name HG12) (segid "   C" and resid   34 and name   HA) 2.945 1.084 1.084 weight 1.000 ! spec=Expt_12, no=45, id=1898, vol=1.418755e+07
    or (segid "   A" and resid   37 and name HG11) (segid "   C" and resid   34 and name   HA)
    or (segid "   A" and resid   37 and name HG13) (segid "   C" and resid   34 and name   HA)
assign (segid "   C" and resid   37 and name HG12) (segid "   A" and resid   34 and name   HA) 2.945 1.084 1.084 weight 1.000 ! spec=Expt_12, no=45, id=1898, vol=1.418755e+07
    or (segid "   C" and resid   37 and name HG11) (segid "   A" and resid   34 and name   HA)
    or (segid "   C" and resid   37 and name HG13) (segid "   A" and resid   34 and name   HA)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   40 and name HG21) 2.867 1.027 3.133 weight 1.000 ! spec=Expt_12, no=49, id=1902, vol=1.668738e+07
    or (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   40 and name HG23)
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   40 and name HG21)
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   40 and name HG23)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   40 and name HG21)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   40 and name HG23)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   40 and name HG21) 2.867 1.027 3.133 weight 1.000 ! spec=Expt_12, no=49, id=1902, vol=1.668738e+07
    or (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   40 and name HG23)
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   40 and name HG21)
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   40 and name HG23)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   40 and name HG21)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   36 and name  HG1) 2.790 0.973 3.210 weight 1.000 ! spec=Expt_12, no=56, id=1907, vol=1.963257e+07
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   36 and name  HG1)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   36 and name  HG1)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   36 and name  HG1) 2.790 0.973 3.210 weight 1.000 ! spec=Expt_12, no=56, id=1907, vol=1.963257e+07
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   36 and name  HG1)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   36 and name  HG1)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   40 and name HG21) 2.766 0.957 3.234 weight 1.000 ! spec=Expt_12, no=57, id=1908, vol=2.067641e+07
    or (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   40 and name HG23)
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   40 and name HG21)
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   40 and name HG23)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   40 and name HG21)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   40 and name HG23)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   40 and name HG21) 2.766 0.957 3.234 weight 1.000 ! spec=Expt_12, no=57, id=1908, vol=2.067641e+07
    or (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   40 and name HG23)
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   40 and name HG21)
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   40 and name HG23)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   40 and name HG21)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   33 and name   HA) 2.883 1.039 1.039 weight 1.000 ! spec=Expt_12, no=62, id=1912, vol=1.611892e+07
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   33 and name   HA)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   33 and name   HA)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   33 and name   HA) 2.883 1.039 1.039 weight 1.000 ! spec=Expt_12, no=62, id=1912, vol=1.611892e+07
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   33 and name   HA)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   33 and name   HA)
assign (segid "   A" and resid   13 and name HG12) (segid "   C" and resid   29 and name HD12) 2.809 0.986 0.986 weight 1.000 ! spec=Expt_12, no=63, id=1913, vol=1.886449e+07
    or (segid "   A" and resid   13 and name HG12) (segid "   C" and resid   29 and name HD11)
    or (segid "   A" and resid   13 and name HG12) (segid "   C" and resid   29 and name HD13)
assign (segid "   C" and resid   13 and name HG12) (segid "   A" and resid   29 and name HD12) 2.809 0.986 0.986 weight 1.000 ! spec=Expt_12, no=63, id=1913, vol=1.886449e+07
    or (segid "   C" and resid   13 and name HG12) (segid "   A" and resid   29 and name HD11)
    or (segid "   C" and resid   13 and name HG12) (segid "   A" and resid   29 and name HD13)
assign (segid "   A" and resid   29 and name HG12) (segid "   C" and resid   29 and name HD12) 2.822 0.996 0.996 weight 1.000 ! spec=Expt_12, no=64, id=1914, vol=1.833134e+07
    or (segid "   A" and resid   29 and name HG12) (segid "   C" and resid   29 and name HD11)
    or (segid "   A" and resid   29 and name HG12) (segid "   C" and resid   29 and name HD13)
assign (segid "   C" and resid   29 and name HG12) (segid "   A" and resid   29 and name HD12) 2.822 0.996 0.996 weight 1.000 ! spec=Expt_12, no=64, id=1914, vol=1.833134e+07
    or (segid "   C" and resid   29 and name HG12) (segid "   A" and resid   29 and name HD11)
    or (segid "   C" and resid   29 and name HG12) (segid "   A" and resid   29 and name HD13)
assign (segid "   A" and resid   27 and name  HD2) (segid "   C" and resid   13 and name   HA) 2.682 0.899 1.899 weight 1.000 ! spec=Expt_12, no=66, id=1916, vol=2.489004e+07
assign (segid "   C" and resid   27 and name  HD2) (segid "   A" and resid   13 and name   HA) 2.682 0.899 1.899 weight 1.000 ! spec=Expt_12, no=66, id=1916, vol=2.489004e+07
assign (segid "   A" and resid   36 and name  HD2) (segid "   C" and resid   25 and name  HE1) 3.012 1.134 2.134 weight 1.000 ! spec=Expt_12, no=67, id=1917, vol=1.240009e+07
    or (segid "   A" and resid   36 and name  HD2) (segid "   C" and resid   25 and name  HE2)
assign (segid "   C" and resid   36 and name  HD2) (segid "   A" and resid   25 and name  HE1) 3.012 1.134 2.134 weight 1.000 ! spec=Expt_12, no=67, id=1917, vol=1.240009e+07
    or (segid "   C" and resid   36 and name  HD2) (segid "   A" and resid   25 and name  HE2)
assign (segid "   A" and resid   38 and name HG11) (segid "   C" and resid   38 and name   HA) 3.099 1.200 2.901 weight 1.000 ! spec=Expt_12, no=68, id=1918, vol=1.046915e+07
assign (segid "   C" and resid   38 and name HG11) (segid "   A" and resid   38 and name   HA) 3.099 1.200 2.901 weight 1.000 ! spec=Expt_12, no=68, id=1918, vol=1.046915e+07
assign (segid "   A" and resid   38 and name HG12) (segid "   C" and resid   38 and name HD12) 2.659 0.884 1.384 weight 1.000 ! spec=Expt_12, no=70, id=1920, vol=2.623414e+07
    or (segid "   A" and resid   38 and name HG12) (segid "   C" and resid   38 and name HD11)
    or (segid "   A" and resid   38 and name HG12) (segid "   C" and resid   38 and name HD13)
assign (segid "   C" and resid   38 and name HG12) (segid "   A" and resid   38 and name HD12) 2.659 0.884 1.384 weight 1.000 ! spec=Expt_12, no=70, id=1920, vol=2.623414e+07
    or (segid "   C" and resid   38 and name HG12) (segid "   A" and resid   38 and name HD11)
    or (segid "   C" and resid   38 and name HG12) (segid "   A" and resid   38 and name HD13)
assign (segid "   A" and resid   36 and name  HD2) (segid "   C" and resid   24 and name HD12) 2.577 0.830 3.423 weight 1.000 ! spec=Expt_12, no=71, id=1921, vol=3.165386e+07
    or (segid "   A" and resid   36 and name  HD2) (segid "   C" and resid   24 and name HD11)
    or (segid "   A" and resid   36 and name  HD2) (segid "   C" and resid   24 and name HD13)
assign (segid "   C" and resid   36 and name  HD2) (segid "   A" and resid   24 and name HD12) 2.577 0.830 3.423 weight 1.000 ! spec=Expt_12, no=71, id=1921, vol=3.165386e+07
    or (segid "   C" and resid   36 and name  HD2) (segid "   A" and resid   24 and name HD11)
    or (segid "   C" and resid   36 and name  HD2) (segid "   A" and resid   24 and name HD13)
assign (segid "   A" and resid   36 and name  HD2) (segid "   C" and resid   24 and name HD22) 2.676 0.895 0.895 weight 1.000 ! spec=Expt_12, no=72, id=1922, vol=2.525343e+07
    or (segid "   A" and resid   36 and name  HD2) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   36 and name  HD2) (segid "   C" and resid   24 and name HD23)
assign (segid "   C" and resid   36 and name  HD2) (segid "   A" and resid   24 and name HD22) 2.676 0.895 0.895 weight 1.000 ! spec=Expt_12, no=72, id=1922, vol=2.525343e+07
    or (segid "   C" and resid   36 and name  HD2) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   36 and name  HD2) (segid "   A" and resid   24 and name HD23)
assign (segid "   A" and resid   14 and name  HB1) (segid "   C" and resid   25 and name  HE1) 2.880 1.037 1.037 weight 1.000 ! spec=Expt_12, no=73, id=1923, vol=1.622150e+07
    or (segid "   A" and resid   14 and name  HB1) (segid "   C" and resid   25 and name  HE2)
assign (segid "   C" and resid   14 and name  HB1) (segid "   A" and resid   25 and name  HE1) 2.880 1.037 1.037 weight 1.000 ! spec=Expt_12, no=73, id=1923, vol=1.622150e+07
    or (segid "   C" and resid   14 and name  HB1) (segid "   A" and resid   25 and name  HE2)
assign (segid "   A" and resid   38 and name   HB) (segid "   C" and resid   38 and name HD12) 2.941 1.081 1.081 weight 1.000 ! spec=Expt_12, no=79, id=1928, vol=1.432208e+07
    or (segid "   A" and resid   38 and name   HB) (segid "   C" and resid   38 and name HD11)
    or (segid "   A" and resid   38 and name   HB) (segid "   C" and resid   38 and name HD13)
assign (segid "   C" and resid   38 and name   HB) (segid "   A" and resid   38 and name HD12) 2.941 1.081 1.081 weight 1.000 ! spec=Expt_12, no=79, id=1928, vol=1.432208e+07
    or (segid "   C" and resid   38 and name   HB) (segid "   A" and resid   38 and name HD11)
    or (segid "   C" and resid   38 and name   HB) (segid "   A" and resid   38 and name HD13)
assign (segid "   A" and resid   22 and name   HB) (segid "   C" and resid   40 and name HG21) 2.814 0.990 0.990 weight 1.000 ! spec=Expt_12, no=80, id=1929, vol=1.864848e+07
    or (segid "   A" and resid   22 and name   HB) (segid "   C" and resid   40 and name HG22)
    or (segid "   A" and resid   22 and name   HB) (segid "   C" and resid   40 and name HG23)
assign (segid "   C" and resid   22 and name   HB) (segid "   A" and resid   40 and name HG21) 2.814 0.990 0.990 weight 1.000 ! spec=Expt_12, no=80, id=1929, vol=1.864848e+07
    or (segid "   C" and resid   22 and name   HB) (segid "   A" and resid   40 and name HG22)
    or (segid "   C" and resid   22 and name   HB) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   22 and name   HB) (segid "   C" and resid   37 and name HG12) 3.092 1.195 2.908 weight 1.000 ! spec=Expt_12, no=81, id=1930, vol=1.060962e+07
    or (segid "   A" and resid   22 and name   HB) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   22 and name   HB) (segid "   C" and resid   37 and name HG13)
assign (segid "   C" and resid   22 and name   HB) (segid "   A" and resid   37 and name HG12) 3.092 1.195 2.908 weight 1.000 ! spec=Expt_12, no=81, id=1930, vol=1.060962e+07
    or (segid "   C" and resid   22 and name   HB) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   22 and name   HB) (segid "   A" and resid   37 and name HG13)
assign (segid "   A" and resid   24 and name  HB1) (segid "   C" and resid   13 and name HG22) 2.891 1.045 1.045 weight 1.000 ! spec=Expt_12, no=82, id=1931, vol=1.587315e+07
    or (segid "   A" and resid   24 and name  HB1) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   24 and name  HB1) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   24 and name  HB1) (segid "   A" and resid   13 and name HG22) 2.891 1.045 1.045 weight 1.000 ! spec=Expt_12, no=82, id=1931, vol=1.587315e+07
    or (segid "   C" and resid   24 and name  HB1) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   24 and name  HB1) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   24 and name  HB2) (segid "   C" and resid   13 and name HD12) 2.961 1.096 1.096 weight 1.000 ! spec=Expt_12, no=83, id=1932, vol=1.376070e+07
    or (segid "   A" and resid   24 and name  HB2) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   24 and name  HB2) (segid "   C" and resid   13 and name HD13)
assign (segid "   C" and resid   24 and name  HB2) (segid "   A" and resid   13 and name HD12) 2.961 1.096 1.096 weight 1.000 ! spec=Expt_12, no=83, id=1932, vol=1.376070e+07
    or (segid "   C" and resid   24 and name  HB2) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   24 and name  HB2) (segid "   A" and resid   13 and name HD13)
assign (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   13 and name   HA) 2.900 1.051 3.100 weight 1.000 ! spec=Expt_12, no=87, id=1933, vol=1.558251e+07
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   13 and name   HA)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   13 and name   HA)
assign (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   13 and name   HA) 2.900 1.051 3.100 weight 1.000 ! spec=Expt_12, no=87, id=1933, vol=1.558251e+07
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   13 and name   HA)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   13 and name   HA)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   37 and name HG12) 2.271 0.645 3.729 weight 1.000 ! spec=Expt_12, no=88, id=1934, vol=6.748503e+07
    or (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   37 and name HG13)
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   37 and name HG12)
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   37 and name HG13)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   37 and name HG12)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   37 and name HG13)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   37 and name HG12) 2.271 0.645 3.729 weight 1.000 ! spec=Expt_12, no=88, id=1934, vol=6.748503e+07
    or (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   37 and name HG13)
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   37 and name HG12)
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   37 and name HG13)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   37 and name HG12)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   37 and name HG13)
assign (segid "   A" and resid   37 and name   HA) (segid "   C" and resid   22 and name HD12) 2.484 0.771 0.771 weight 1.000 ! spec=Expt_12, no=91, id=1937, vol=3.944731e+07
    or (segid "   A" and resid   37 and name   HA) (segid "   C" and resid   22 and name HD11)
    or (segid "   A" and resid   37 and name   HA) (segid "   C" and resid   22 and name HD13)
assign (segid "   C" and resid   37 and name   HA) (segid "   A" and resid   22 and name HD12) 2.484 0.771 0.771 weight 1.000 ! spec=Expt_12, no=91, id=1937, vol=3.944731e+07
    or (segid "   C" and resid   37 and name   HA) (segid "   A" and resid   22 and name HD11)
    or (segid "   C" and resid   37 and name   HA) (segid "   A" and resid   22 and name HD13)
assign (segid "   A" and resid   37 and name   HA) (segid "   C" and resid   24 and name HD22) 2.800 0.980 3.200 weight 1.000 ! spec=Expt_12, no=92, id=1938, vol=1.921049e+07
    or (segid "   A" and resid   37 and name   HA) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   37 and name   HA) (segid "   C" and resid   24 and name HD23)
assign (segid "   C" and resid   37 and name   HA) (segid "   A" and resid   24 and name HD22) 2.800 0.980 3.200 weight 1.000 ! spec=Expt_12, no=92, id=1938, vol=1.921049e+07
    or (segid "   C" and resid   37 and name   HA) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   37 and name   HA) (segid "   A" and resid   24 and name HD23)
assign (segid "   A" and resid   25 and name  HD1) (segid "   C" and resid   14 and name   HA) 2.742 0.940 0.940 weight 1.000 ! spec=Expt_12, no=93, id=1939, vol=2.180645e+07
    or (segid "   A" and resid   25 and name  HD2) (segid "   C" and resid   14 and name   HA)
assign (segid "   C" and resid   25 and name  HD1) (segid "   A" and resid   14 and name   HA) 2.742 0.940 0.940 weight 1.000 ! spec=Expt_12, no=93, id=1939, vol=2.180645e+07
    or (segid "   C" and resid   25 and name  HD2) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   37 and name HG12) 2.134 0.569 0.569 weight 1.000 ! spec=Expt_12, no=96, id=1941, vol=9.807251e+07
    or (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   37 and name HG13)
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   37 and name HG12)
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   37 and name HG13)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   37 and name HG12)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   37 and name HG13)
assign (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   37 and name HG12) 2.134 0.569 0.569 weight 1.000 ! spec=Expt_12, no=96, id=1941, vol=9.807251e+07
    or (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   37 and name HG13)
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   37 and name HG12)
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   37 and name HG13)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   37 and name HG12)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   37 and name HG13)
assign (segid "   A" and resid   38 and name   HA) (segid "   C" and resid   38 and name HG11) 3.023 1.142 2.977 weight 1.000 ! spec=Expt_12, no=98, id=1943, vol=1.213630e+07
assign (segid "   C" and resid   38 and name   HA) (segid "   A" and resid   38 and name HG11) 3.023 1.142 2.977 weight 1.000 ! spec=Expt_12, no=98, id=1943, vol=1.213630e+07
assign (segid "   A" and resid   37 and name HG22) (segid "   C" and resid   38 and name   HA) 3.001 1.126 2.999 weight 1.000 ! spec=Expt_12, no=99, id=1944, vol=1.267294e+07
    or (segid "   A" and resid   37 and name HG21) (segid "   C" and resid   38 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   C" and resid   38 and name   HA)
assign (segid "   C" and resid   37 and name HG22) (segid "   A" and resid   38 and name   HA) 3.001 1.126 2.999 weight 1.000 ! spec=Expt_12, no=99, id=1944, vol=1.267294e+07
    or (segid "   C" and resid   37 and name HG21) (segid "   A" and resid   38 and name   HA)
    or (segid "   C" and resid   37 and name HG23) (segid "   A" and resid   38 and name   HA)
assign (segid "   A" and resid   12 and name   HB) (segid "   C" and resid   12 and name HG22) 2.851 1.016 1.016 weight 1.000 ! spec=Expt_12, no=104, id=1949, vol=1.724475e+07
    or (segid "   A" and resid   12 and name   HB) (segid "   C" and resid   12 and name HG21)
    or (segid "   A" and resid   12 and name   HB) (segid "   C" and resid   12 and name HG23)
assign (segid "   C" and resid   12 and name   HB) (segid "   A" and resid   12 and name HG22) 2.851 1.016 1.016 weight 1.000 ! spec=Expt_12, no=104, id=1949, vol=1.724475e+07
    or (segid "   C" and resid   12 and name   HB) (segid "   A" and resid   12 and name HG21)
    or (segid "   C" and resid   12 and name   HB) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   12 and name   HB) (segid "   C" and resid   12 and name HG12) 2.843 1.011 1.011 weight 1.000 ! spec=Expt_12, no=105, id=1950, vol=1.753609e+07
    or (segid "   A" and resid   12 and name   HB) (segid "   C" and resid   12 and name HG11)
    or (segid "   A" and resid   12 and name   HB) (segid "   C" and resid   12 and name HG13)
assign (segid "   C" and resid   12 and name   HB) (segid "   A" and resid   12 and name HG12) 2.843 1.011 1.011 weight 1.000 ! spec=Expt_12, no=105, id=1950, vol=1.753609e+07
    or (segid "   C" and resid   12 and name   HB) (segid "   A" and resid   12 and name HG11)
    or (segid "   C" and resid   12 and name   HB) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   12 and name HG22) (segid "   C" and resid   12 and name   HA) 2.894 1.047 3.106 weight 1.000 ! spec=Expt_12, no=107, id=1952, vol=1.575582e+07
    or (segid "   A" and resid   12 and name HG21) (segid "   C" and resid   12 and name   HA)
    or (segid "   A" and resid   12 and name HG23) (segid "   C" and resid   12 and name   HA)
assign (segid "   C" and resid   12 and name HG22) (segid "   A" and resid   12 and name   HA) 2.894 1.047 3.106 weight 1.000 ! spec=Expt_12, no=107, id=1952, vol=1.575582e+07
    or (segid "   C" and resid   12 and name HG21) (segid "   A" and resid   12 and name   HA)
    or (segid "   C" and resid   12 and name HG23) (segid "   A" and resid   12 and name   HA)
assign (segid "   A" and resid   13 and name HG22) (segid "   C" and resid   25 and name   HA) 2.866 1.027 3.134 weight 1.000 ! spec=Expt_12, no=109, id=1954, vol=1.670536e+07
    or (segid "   A" and resid   13 and name HG21) (segid "   C" and resid   25 and name   HA)
    or (segid "   A" and resid   13 and name HG23) (segid "   C" and resid   25 and name   HA)
assign (segid "   C" and resid   13 and name HG22) (segid "   A" and resid   25 and name   HA) 2.866 1.027 3.134 weight 1.000 ! spec=Expt_12, no=109, id=1954, vol=1.670536e+07
    or (segid "   C" and resid   13 and name HG21) (segid "   A" and resid   25 and name   HA)
    or (segid "   C" and resid   13 and name HG23) (segid "   A" and resid   25 and name   HA)
assign (segid "   A" and resid   14 and name  HB1) (segid "   C" and resid   25 and name  HD1) 3.056 1.168 2.168 weight 1.000 ! spec=Expt_12, no=111, id=1956, vol=1.137045e+07
    or (segid "   A" and resid   14 and name  HB1) (segid "   C" and resid   25 and name  HD2)
assign (segid "   C" and resid   14 and name  HB1) (segid "   A" and resid   25 and name  HD1) 3.056 1.168 2.168 weight 1.000 ! spec=Expt_12, no=111, id=1956, vol=1.137045e+07
    or (segid "   C" and resid   14 and name  HB1) (segid "   A" and resid   25 and name  HD2)
assign (segid "   A" and resid   12 and name HG12) (segid "   C" and resid   12 and name   HA) 2.550 0.813 3.450 weight 1.000 ! spec=Expt_12, no=112, id=1957, vol=3.373526e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   C" and resid   12 and name   HA)
    or (segid "   A" and resid   12 and name HG13) (segid "   C" and resid   12 and name   HA)
assign (segid "   C" and resid   12 and name HG12) (segid "   A" and resid   12 and name   HA) 2.550 0.813 3.450 weight 1.000 ! spec=Expt_12, no=112, id=1957, vol=3.373526e+07
    or (segid "   C" and resid   12 and name HG11) (segid "   A" and resid   12 and name   HA)
    or (segid "   C" and resid   12 and name HG13) (segid "   A" and resid   12 and name   HA)
assign (segid "   A" and resid   22 and name HG22) (segid "   C" and resid   40 and name   HB) 2.805 0.983 3.195 weight 1.000 ! spec=Expt_12, no=114, id=1958, vol=1.902559e+07
    or (segid "   A" and resid   22 and name HG21) (segid "   C" and resid   40 and name   HB)
    or (segid "   A" and resid   22 and name HG23) (segid "   C" and resid   40 and name   HB)
assign (segid "   C" and resid   22 and name HG22) (segid "   A" and resid   40 and name   HB) 2.805 0.983 3.195 weight 1.000 ! spec=Expt_12, no=114, id=1958, vol=1.902559e+07
    or (segid "   C" and resid   22 and name HG21) (segid "   A" and resid   40 and name   HB)
    or (segid "   C" and resid   22 and name HG23) (segid "   A" and resid   40 and name   HB)
assign (segid "   A" and resid   24 and name   HG) (segid "   C" and resid   13 and name HD12) 3.093 1.196 1.196 weight 1.000 ! spec=Expt_12, no=118, id=1962, vol=1.057928e+07
    or (segid "   A" and resid   24 and name   HG) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   24 and name   HG) (segid "   C" and resid   13 and name HD13)
assign (segid "   C" and resid   24 and name   HG) (segid "   A" and resid   13 and name HD12) 3.093 1.196 1.196 weight 1.000 ! spec=Expt_12, no=118, id=1962, vol=1.057928e+07
    or (segid "   C" and resid   24 and name   HG) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   24 and name   HG) (segid "   A" and resid   13 and name HD13)
assign (segid "   A" and resid   24 and name   HG) (segid "   C" and resid   13 and name HG22) 3.035 1.152 1.152 weight 1.000 ! spec=Expt_12, no=119, id=1963, vol=1.184802e+07
    or (segid "   A" and resid   24 and name   HG) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   24 and name   HG) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   24 and name   HG) (segid "   A" and resid   13 and name HG22) 3.035 1.152 1.152 weight 1.000 ! spec=Expt_12, no=119, id=1963, vol=1.184802e+07
    or (segid "   C" and resid   24 and name   HG) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   24 and name   HG) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   27 and name  HG1) (segid "   C" and resid   13 and name   HA) 2.949 1.087 1.087 weight 1.000 ! spec=Expt_12, no=124, id=1965, vol=1.408461e+07
assign (segid "   C" and resid   27 and name  HG1) (segid "   A" and resid   13 and name   HA) 2.949 1.087 1.087 weight 1.000 ! spec=Expt_12, no=124, id=1965, vol=1.408461e+07
assign (segid "   A" and resid   29 and name HG22) (segid "   C" and resid   37 and name HG12) 2.306 0.664 3.694 weight 1.000 ! spec=Expt_12, no=127, id=1967, vol=6.169280e+07
    or (segid "   A" and resid   29 and name HG22) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   29 and name HG22) (segid "   C" and resid   37 and name HG13)
    or (segid "   A" and resid   29 and name HG21) (segid "   C" and resid   37 and name HG12)
    or (segid "   A" and resid   29 and name HG21) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   29 and name HG21) (segid "   C" and resid   37 and name HG13)
    or (segid "   A" and resid   29 and name HG23) (segid "   C" and resid   37 and name HG12)
    or (segid "   A" and resid   29 and name HG23) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   29 and name HG23) (segid "   C" and resid   37 and name HG13)
assign (segid "   C" and resid   29 and name HG22) (segid "   A" and resid   37 and name HG12) 2.306 0.664 3.694 weight 1.000 ! spec=Expt_12, no=127, id=1967, vol=6.169280e+07
    or (segid "   C" and resid   29 and name HG22) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   29 and name HG22) (segid "   A" and resid   37 and name HG13)
    or (segid "   C" and resid   29 and name HG21) (segid "   A" and resid   37 and name HG12)
    or (segid "   C" and resid   29 and name HG21) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   29 and name HG21) (segid "   A" and resid   37 and name HG13)
    or (segid "   C" and resid   29 and name HG23) (segid "   A" and resid   37 and name HG12)
    or (segid "   C" and resid   29 and name HG23) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   29 and name HG23) (segid "   A" and resid   37 and name HG13)
assign (segid "   A" and resid   37 and name HG22) (segid "   C" and resid   37 and name   HN) 3.115 1.213 2.885 weight 1.000 ! spec=Expt_12, no=131, id=1969, vol=1.014915e+07
    or (segid "   A" and resid   37 and name HG21) (segid "   C" and resid   37 and name   HN)
    or (segid "   A" and resid   37 and name HG23) (segid "   C" and resid   37 and name   HN)
assign (segid "   C" and resid   37 and name HG22) (segid "   A" and resid   37 and name   HN) 3.115 1.213 2.885 weight 1.000 ! spec=Expt_12, no=131, id=1969, vol=1.014915e+07
    or (segid "   C" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HN)
    or (segid "   C" and resid   37 and name HG23) (segid "   A" and resid   37 and name   HN)
assign (segid "   A" and resid   37 and name HG22) (segid "   C" and resid   38 and name   HN) 3.242 1.314 1.314 weight 1.000 ! spec=Expt_12, no=133, id=1971, vol=7.976950e+06
    or (segid "   A" and resid   37 and name HG21) (segid "   C" and resid   38 and name   HN)
    or (segid "   A" and resid   37 and name HG23) (segid "   C" and resid   38 and name   HN)
assign (segid "   C" and resid   37 and name HG22) (segid "   A" and resid   38 and name   HN) 3.242 1.314 1.314 weight 1.000 ! spec=Expt_12, no=133, id=1971, vol=7.976950e+06
    or (segid "   C" and resid   37 and name HG21) (segid "   A" and resid   38 and name   HN)
    or (segid "   C" and resid   37 and name HG23) (segid "   A" and resid   38 and name   HN)
assign (segid "   A" and resid   38 and name   HA) (segid "   C" and resid   38 and name HG12) 3.127 1.222 2.873 weight 1.000 ! spec=Expt_12, no=134, id=1972, vol=9.911780e+06
assign (segid "   C" and resid   38 and name   HA) (segid "   A" and resid   38 and name HG12) 3.127 1.222 2.873 weight 1.000 ! spec=Expt_12, no=134, id=1972, vol=9.911780e+06
assign (segid "   A" and resid   38 and name HG22) (segid "   C" and resid   38 and name HG11) 3.018 1.139 1.139 weight 1.000 ! spec=Expt_12, no=137, id=1974, vol=1.225480e+07
    or (segid "   A" and resid   38 and name HG21) (segid "   C" and resid   38 and name HG11)
    or (segid "   A" and resid   38 and name HG23) (segid "   C" and resid   38 and name HG11)
assign (segid "   C" and resid   38 and name HG22) (segid "   A" and resid   38 and name HG11) 3.018 1.139 1.139 weight 1.000 ! spec=Expt_12, no=137, id=1974, vol=1.225480e+07
    or (segid "   C" and resid   38 and name HG21) (segid "   A" and resid   38 and name HG11)
    or (segid "   C" and resid   38 and name HG23) (segid "   A" and resid   38 and name HG11)
assign (segid "   A" and resid   38 and name HD12) (segid "   C" and resid   38 and name HG11) 3.001 1.126 1.126 weight 1.000 ! spec=Expt_12, no=138, id=1975, vol=1.268667e+07
    or (segid "   A" and resid   38 and name HD11) (segid "   C" and resid   38 and name HG11)
    or (segid "   A" and resid   38 and name HD13) (segid "   C" and resid   38 and name HG11)
assign (segid "   C" and resid   38 and name HD12) (segid "   A" and resid   38 and name HG11) 3.001 1.126 1.126 weight 1.000 ! spec=Expt_12, no=138, id=1975, vol=1.268667e+07
    or (segid "   C" and resid   38 and name HD11) (segid "   A" and resid   38 and name HG11)
    or (segid "   C" and resid   38 and name HD13) (segid "   A" and resid   38 and name HG11)
assign (segid "   A" and resid   38 and name HD12) (segid "   C" and resid   38 and name HG12) 3.334 1.390 1.390 weight 1.000 ! spec=Expt_12, no=139, id=1976, vol=6.743369e+06
    or (segid "   A" and resid   38 and name HD11) (segid "   C" and resid   38 and name HG12)
    or (segid "   A" and resid   38 and name HD13) (segid "   C" and resid   38 and name HG12)
assign (segid "   C" and resid   38 and name HD12) (segid "   A" and resid   38 and name HG12) 3.334 1.390 1.390 weight 1.000 ! spec=Expt_12, no=139, id=1976, vol=6.743369e+06
    or (segid "   C" and resid   38 and name HD11) (segid "   A" and resid   38 and name HG12)
    or (segid "   C" and resid   38 and name HD13) (segid "   A" and resid   38 and name HG12)
assign (segid "   A" and resid   12 and name HG12) (segid "   C" and resid   29 and name HD12) 2.384 0.711 3.616 weight 1.000 ! spec=Expt_12, no=140, id=1977, vol=5.044679e+07
    or (segid "   A" and resid   12 and name HG12) (segid "   C" and resid   29 and name HD11)
    or (segid "   A" and resid   12 and name HG12) (segid "   C" and resid   29 and name HD13)
    or (segid "   A" and resid   12 and name HG11) (segid "   C" and resid   29 and name HD12)
    or (segid "   A" and resid   12 and name HG11) (segid "   C" and resid   29 and name HD11)
    or (segid "   A" and resid   12 and name HG11) (segid "   C" and resid   29 and name HD13)
    or (segid "   A" and resid   12 and name HG13) (segid "   C" and resid   29 and name HD12)
    or (segid "   A" and resid   12 and name HG13) (segid "   C" and resid   29 and name HD11)
    or (segid "   A" and resid   12 and name HG13) (segid "   C" and resid   29 and name HD13)
assign (segid "   C" and resid   12 and name HG12) (segid "   A" and resid   29 and name HD12) 2.384 0.711 3.616 weight 1.000 ! spec=Expt_12, no=140, id=1977, vol=5.044679e+07
    or (segid "   C" and resid   12 and name HG12) (segid "   A" and resid   29 and name HD11)
    or (segid "   C" and resid   12 and name HG12) (segid "   A" and resid   29 and name HD13)
    or (segid "   C" and resid   12 and name HG11) (segid "   A" and resid   29 and name HD12)
    or (segid "   C" and resid   12 and name HG11) (segid "   A" and resid   29 and name HD11)
    or (segid "   C" and resid   12 and name HG11) (segid "   A" and resid   29 and name HD13)
    or (segid "   C" and resid   12 and name HG13) (segid "   A" and resid   29 and name HD12)
    or (segid "   C" and resid   12 and name HG13) (segid "   A" and resid   29 and name HD11)
    or (segid "   C" and resid   12 and name HG13) (segid "   A" and resid   29 and name HD13)
assign (segid "   A" and resid   12 and name HG12) (segid "   C" and resid   29 and name HG11) 2.457 0.754 3.543 weight 1.000 ! spec=Expt_12, no=141, id=1978, vol=4.214678e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   C" and resid   29 and name HG11)
    or (segid "   A" and resid   12 and name HG13) (segid "   C" and resid   29 and name HG11)
assign (segid "   C" and resid   12 and name HG12) (segid "   A" and resid   29 and name HG11) 2.457 0.754 3.543 weight 1.000 ! spec=Expt_12, no=141, id=1978, vol=4.214678e+07
    or (segid "   C" and resid   12 and name HG11) (segid "   A" and resid   29 and name HG11)
    or (segid "   C" and resid   12 and name HG13) (segid "   A" and resid   29 and name HG11)
assign (segid "   A" and resid   24 and name HD12) (segid "   C" and resid   36 and name  HD2) 2.500 0.781 3.500 weight 1.000 ! spec=Expt_12, no=146, id=1982, vol=3.796040e+07
    or (segid "   A" and resid   24 and name HD11) (segid "   C" and resid   36 and name  HD2)
    or (segid "   A" and resid   24 and name HD13) (segid "   C" and resid   36 and name  HD2)
assign (segid "   C" and resid   24 and name HD12) (segid "   A" and resid   36 and name  HD2) 2.500 0.781 3.500 weight 1.000 ! spec=Expt_12, no=146, id=1982, vol=3.796040e+07
    or (segid "   C" and resid   24 and name HD11) (segid "   A" and resid   36 and name  HD2)
    or (segid "   C" and resid   24 and name HD13) (segid "   A" and resid   36 and name  HD2)
assign (segid "   A" and resid   24 and name HD22) (segid "   C" and resid   36 and name  HD2) 2.492 0.776 1.776 weight 1.000 ! spec=Expt_12, no=147, id=1983, vol=3.866728e+07
    or (segid "   A" and resid   24 and name HD21) (segid "   C" and resid   36 and name  HD2)
    or (segid "   A" and resid   24 and name HD23) (segid "   C" and resid   36 and name  HD2)
assign (segid "   C" and resid   24 and name HD22) (segid "   A" and resid   36 and name  HD2) 2.492 0.776 1.776 weight 1.000 ! spec=Expt_12, no=147, id=1983, vol=3.866728e+07
    or (segid "   C" and resid   24 and name HD21) (segid "   A" and resid   36 and name  HD2)
    or (segid "   C" and resid   24 and name HD23) (segid "   A" and resid   36 and name  HD2)
assign (segid "   A" and resid   40 and name HG21) (segid "   C" and resid   24 and name HD22) 2.672 0.892 3.328 weight 1.000 ! spec=Expt_12, no=149, id=1984, vol=2.548017e+07
    or (segid "   A" and resid   40 and name HG21) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   40 and name HG21) (segid "   C" and resid   24 and name HD23)
    or (segid "   A" and resid   40 and name HG22) (segid "   C" and resid   24 and name HD22)
    or (segid "   A" and resid   40 and name HG22) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   40 and name HG22) (segid "   C" and resid   24 and name HD23)
    or (segid "   A" and resid   40 and name HG23) (segid "   C" and resid   24 and name HD22)
    or (segid "   A" and resid   40 and name HG23) (segid "   C" and resid   24 and name HD21)
    or (segid "   A" and resid   40 and name HG23) (segid "   C" and resid   24 and name HD23)
assign (segid "   C" and resid   40 and name HG21) (segid "   A" and resid   24 and name HD22) 2.672 0.892 3.328 weight 1.000 ! spec=Expt_12, no=149, id=1984, vol=2.548017e+07
    or (segid "   C" and resid   40 and name HG21) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   40 and name HG21) (segid "   A" and resid   24 and name HD23)
    or (segid "   C" and resid   40 and name HG22) (segid "   A" and resid   24 and name HD22)
    or (segid "   C" and resid   40 and name HG22) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   40 and name HG22) (segid "   A" and resid   24 and name HD23)
    or (segid "   C" and resid   40 and name HG23) (segid "   A" and resid   24 and name HD22)
    or (segid "   C" and resid   40 and name HG23) (segid "   A" and resid   24 and name HD21)
    or (segid "   C" and resid   40 and name HG23) (segid "   A" and resid   24 and name HD23)
assign (segid "   A" and resid   40 and name HG21) (segid "   C" and resid   22 and name HG22) 2.158 0.582 3.842 weight 1.000 ! spec=Expt_12, no=150, id=1985, vol=9.165332e+07
    or (segid "   A" and resid   40 and name HG21) (segid "   C" and resid   22 and name HG21)
    or (segid "   A" and resid   40 and name HG21) (segid "   C" and resid   22 and name HG23)
    or (segid "   A" and resid   40 and name HG22) (segid "   C" and resid   22 and name HG22)
    or (segid "   A" and resid   40 and name HG22) (segid "   C" and resid   22 and name HG21)
    or (segid "   A" and resid   40 and name HG22) (segid "   C" and resid   22 and name HG23)
    or (segid "   A" and resid   40 and name HG23) (segid "   C" and resid   22 and name HG22)
    or (segid "   A" and resid   40 and name HG23) (segid "   C" and resid   22 and name HG21)
    or (segid "   A" and resid   40 and name HG23) (segid "   C" and resid   22 and name HG23)
assign (segid "   C" and resid   40 and name HG21) (segid "   A" and resid   22 and name HG22) 2.158 0.582 3.842 weight 1.000 ! spec=Expt_12, no=150, id=1985, vol=9.165332e+07
    or (segid "   C" and resid   40 and name HG21) (segid "   A" and resid   22 and name HG21)
    or (segid "   C" and resid   40 and name HG21) (segid "   A" and resid   22 and name HG23)
    or (segid "   C" and resid   40 and name HG22) (segid "   A" and resid   22 and name HG22)
    or (segid "   C" and resid   40 and name HG22) (segid "   A" and resid   22 and name HG21)
    or (segid "   C" and resid   40 and name HG22) (segid "   A" and resid   22 and name HG23)
    or (segid "   C" and resid   40 and name HG23) (segid "   A" and resid   22 and name HG22)
    or (segid "   C" and resid   40 and name HG23) (segid "   A" and resid   22 and name HG21)
    or (segid "   C" and resid   40 and name HG23) (segid "   A" and resid   22 and name HG23)
assign (segid "   A" and resid   38 and name HD12) (segid "   C" and resid   42 and name HG21) 3.121 1.217 2.217 weight 1.000 ! spec=Expt_12, no=151, id=1986, vol=1.003407e+07
    or (segid "   A" and resid   38 and name HD12) (segid "   C" and resid   42 and name HG22)
    or (segid "   A" and resid   38 and name HD12) (segid "   C" and resid   42 and name HG23)
    or (segid "   A" and resid   38 and name HD11) (segid "   C" and resid   42 and name HG21)
    or (segid "   A" and resid   38 and name HD11) (segid "   C" and resid   42 and name HG22)
    or (segid "   A" and resid   38 and name HD11) (segid "   C" and resid   42 and name HG23)
    or (segid "   A" and resid   38 and name HD13) (segid "   C" and resid   42 and name HG21)
    or (segid "   A" and resid   38 and name HD13) (segid "   C" and resid   42 and name HG22)
    or (segid "   A" and resid   38 and name HD13) (segid "   C" and resid   42 and name HG23)
assign (segid "   C" and resid   38 and name HD12) (segid "   A" and resid   42 and name HG21) 3.121 1.217 2.217 weight 1.000 ! spec=Expt_12, no=151, id=1986, vol=1.003407e+07
    or (segid "   C" and resid   38 and name HD12) (segid "   A" and resid   42 and name HG22)
    or (segid "   C" and resid   38 and name HD12) (segid "   A" and resid   42 and name HG23)
    or (segid "   C" and resid   38 and name HD11) (segid "   A" and resid   42 and name HG21)
    or (segid "   C" and resid   38 and name HD11) (segid "   A" and resid   42 and name HG22)
    or (segid "   C" and resid   38 and name HD11) (segid "   A" and resid   42 and name HG23)
    or (segid "   C" and resid   38 and name HD13) (segid "   A" and resid   42 and name HG21)
    or (segid "   C" and resid   38 and name HD13) (segid "   A" and resid   42 and name HG22)
    or (segid "   C" and resid   38 and name HD13) (segid "   A" and resid   42 and name HG23)
assign (segid "   A" and resid   42 and name HG21) (segid "   C" and resid   38 and name HD12) 2.457 0.754 3.543 weight 1.000 ! spec=Expt_12, no=152, id=1987, vol=4.213044e+07
    or (segid "   A" and resid   42 and name HG21) (segid "   C" and resid   38 and name HD11)
    or (segid "   A" and resid   42 and name HG21) (segid "   C" and resid   38 and name HD13)
    or (segid "   A" and resid   42 and name HG22) (segid "   C" and resid   38 and name HD12)
    or (segid "   A" and resid   42 and name HG22) (segid "   C" and resid   38 and name HD11)
    or (segid "   A" and resid   42 and name HG22) (segid "   C" and resid   38 and name HD13)
    or (segid "   A" and resid   42 and name HG23) (segid "   C" and resid   38 and name HD12)
    or (segid "   A" and resid   42 and name HG23) (segid "   C" and resid   38 and name HD11)
    or (segid "   A" and resid   42 and name HG23) (segid "   C" and resid   38 and name HD13)
assign (segid "   C" and resid   42 and name HG21) (segid "   A" and resid   38 and name HD12) 2.457 0.754 3.543 weight 1.000 ! spec=Expt_12, no=152, id=1987, vol=4.213044e+07
    or (segid "   C" and resid   42 and name HG21) (segid "   A" and resid   38 and name HD11)
    or (segid "   C" and resid   42 and name HG21) (segid "   A" and resid   38 and name HD13)
    or (segid "   C" and resid   42 and name HG22) (segid "   A" and resid   38 and name HD12)
    or (segid "   C" and resid   42 and name HG22) (segid "   A" and resid   38 and name HD11)
    or (segid "   C" and resid   42 and name HG22) (segid "   A" and resid   38 and name HD13)
    or (segid "   C" and resid   42 and name HG23) (segid "   A" and resid   38 and name HD12)
    or (segid "   C" and resid   42 and name HG23) (segid "   A" and resid   38 and name HD11)
    or (segid "   C" and resid   42 and name HG23) (segid "   A" and resid   38 and name HD13)
assign (segid "   A" and resid   42 and name HG21) (segid "   C" and resid   22 and name HD12) 2.469 0.762 3.531 weight 1.000 ! spec=Expt_12, no=153, id=1988, vol=4.088625e+07
    or (segid "   A" and resid   42 and name HG21) (segid "   C" and resid   22 and name HD11)
    or (segid "   A" and resid   42 and name HG21) (segid "   C" and resid   22 and name HD13)
    or (segid "   A" and resid   42 and name HG22) (segid "   C" and resid   22 and name HD12)
    or (segid "   A" and resid   42 and name HG22) (segid "   C" and resid   22 and name HD11)
    or (segid "   A" and resid   42 and name HG22) (segid "   C" and resid   22 and name HD13)
    or (segid "   A" and resid   42 and name HG23) (segid "   C" and resid   22 and name HD12)
    or (segid "   A" and resid   42 and name HG23) (segid "   C" and resid   22 and name HD11)
    or (segid "   A" and resid   42 and name HG23) (segid "   C" and resid   22 and name HD13)
assign (segid "   C" and resid   42 and name HG21) (segid "   A" and resid   22 and name HD12) 2.469 0.762 3.531 weight 1.000 ! spec=Expt_12, no=153, id=1988, vol=4.088625e+07
    or (segid "   C" and resid   42 and name HG21) (segid "   A" and resid   22 and name HD11)
    or (segid "   C" and resid   42 and name HG21) (segid "   A" and resid   22 and name HD13)
    or (segid "   C" and resid   42 and name HG22) (segid "   A" and resid   22 and name HD12)
    or (segid "   C" and resid   42 and name HG22) (segid "   A" and resid   22 and name HD11)
    or (segid "   C" and resid   42 and name HG22) (segid "   A" and resid   22 and name HD13)
    or (segid "   C" and resid   42 and name HG23) (segid "   A" and resid   22 and name HD12)
    or (segid "   C" and resid   42 and name HG23) (segid "   A" and resid   22 and name HD11)
    or (segid "   C" and resid   42 and name HG23) (segid "   A" and resid   22 and name HD13)
assign (segid "   A" and resid   37 and name   HB) (segid "   C" and resid   37 and name HG22) 2.619 0.857 0.857 weight 1.000 ! spec=Expt_12, no=156, id=1989, vol=2.870608e+07
    or (segid "   A" and resid   37 and name   HB) (segid "   C" and resid   37 and name HG21)
    or (segid "   A" and resid   37 and name   HB) (segid "   C" and resid   37 and name HG23)
assign (segid "   C" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG22) 2.619 0.857 0.857 weight 1.000 ! spec=Expt_12, no=156, id=1989, vol=2.870608e+07
    or (segid "   C" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG21)
    or (segid "   C" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   36 and name  HD2) (segid "   C" and resid   24 and name   HA) 3.011 1.133 2.989 weight 1.000 ! spec=Expt_12, no=157, id=1990, vol=1.244428e+07
assign (segid "   C" and resid   36 and name  HD2) (segid "   A" and resid   24 and name   HA) 3.011 1.133 2.989 weight 1.000 ! spec=Expt_12, no=157, id=1990, vol=1.244428e+07
assign (segid "   A" and resid   34 and name   HA) (segid "   C" and resid   37 and name HG12) 2.423 0.734 3.577 weight 1.000 ! spec=Expt_12, no=160, id=1991, vol=4.579693e+07
    or (segid "   A" and resid   34 and name   HA) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   34 and name   HA) (segid "   C" and resid   37 and name HG13)
assign (segid "   C" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG12) 2.423 0.734 3.577 weight 1.000 ! spec=Expt_12, no=160, id=1991, vol=4.579693e+07
    or (segid "   C" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG13)
assign (segid "   A" and resid   34 and name  HB2) (segid "   C" and resid   37 and name HG12) 3.019 1.139 2.639 weight 1.000 ! spec=Expt_12, no=161, id=1992, vol=1.223672e+07
    or (segid "   A" and resid   34 and name  HB2) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   34 and name  HB2) (segid "   C" and resid   37 and name HG13)
assign (segid "   C" and resid   34 and name  HB2) (segid "   A" and resid   37 and name HG12) 3.019 1.139 2.639 weight 1.000 ! spec=Expt_12, no=161, id=1992, vol=1.223672e+07
    or (segid "   C" and resid   34 and name  HB2) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   34 and name  HB2) (segid "   A" and resid   37 and name HG13)
assign (segid "   A" and resid   34 and name  HG2) (segid "   C" and resid   37 and name HG22) 2.581 0.833 3.419 weight 1.000 ! spec=Expt_12, no=163, id=1994, vol=3.133357e+07
    or (segid "   A" and resid   34 and name  HG2) (segid "   C" and resid   37 and name HG21)
    or (segid "   A" and resid   34 and name  HG2) (segid "   C" and resid   37 and name HG23)
assign (segid "   C" and resid   34 and name  HG2) (segid "   A" and resid   37 and name HG22) 2.581 0.833 3.419 weight 1.000 ! spec=Expt_12, no=163, id=1994, vol=3.133357e+07
    or (segid "   C" and resid   34 and name  HG2) (segid "   A" and resid   37 and name HG21)
    or (segid "   C" and resid   34 and name  HG2) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   34 and name  HB1) (segid "   C" and resid   37 and name HG12) 2.544 0.809 3.456 weight 1.000 ! spec=Expt_12, no=164, id=1995, vol=3.417728e+07
    or (segid "   A" and resid   34 and name  HB1) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   34 and name  HB1) (segid "   C" and resid   37 and name HG13)
assign (segid "   C" and resid   34 and name  HB1) (segid "   A" and resid   37 and name HG12) 2.544 0.809 3.456 weight 1.000 ! spec=Expt_12, no=164, id=1995, vol=3.417728e+07
    or (segid "   C" and resid   34 and name  HB1) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   34 and name  HB1) (segid "   A" and resid   37 and name HG13)
assign (segid "   A" and resid   29 and name HG11) (segid "   C" and resid   29 and name HD12) 2.695 0.908 3.305 weight 1.000 ! spec=Expt_12, no=165, id=1996, vol=2.420619e+07
    or (segid "   A" and resid   29 and name HG11) (segid "   C" and resid   29 and name HD11)
    or (segid "   A" and resid   29 and name HG11) (segid "   C" and resid   29 and name HD13)
assign (segid "   C" and resid   29 and name HG11) (segid "   A" and resid   29 and name HD12) 2.695 0.908 3.305 weight 1.000 ! spec=Expt_12, no=165, id=1996, vol=2.420619e+07
    or (segid "   C" and resid   29 and name HG11) (segid "   A" and resid   29 and name HD11)
    or (segid "   C" and resid   29 and name HG11) (segid "   A" and resid   29 and name HD13)
assign (segid "   A" and resid   29 and name   HB) (segid "   C" and resid   29 and name HD12) 2.855 1.019 3.145 weight 1.000 ! spec=Expt_12, no=166, id=1997, vol=1.709724e+07
    or (segid "   A" and resid   29 and name   HB) (segid "   C" and resid   29 and name HD11)
    or (segid "   A" and resid   29 and name   HB) (segid "   C" and resid   29 and name HD13)
assign (segid "   C" and resid   29 and name   HB) (segid "   A" and resid   29 and name HD12) 2.855 1.019 3.145 weight 1.000 ! spec=Expt_12, no=166, id=1997, vol=1.709724e+07
    or (segid "   C" and resid   29 and name   HB) (segid "   A" and resid   29 and name HD11)
    or (segid "   C" and resid   29 and name   HB) (segid "   A" and resid   29 and name HD13)
assign (segid "   A" and resid   29 and name HG22) (segid "   C" and resid   29 and name HG12) 3.014 1.135 2.135 weight 1.000 ! spec=Expt_12, no=167, id=1998, vol=1.236699e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   C" and resid   29 and name HG12)
    or (segid "   A" and resid   29 and name HG23) (segid "   C" and resid   29 and name HG12)
assign (segid "   C" and resid   29 and name HG22) (segid "   A" and resid   29 and name HG12) 3.014 1.135 2.135 weight 1.000 ! spec=Expt_12, no=167, id=1998, vol=1.236699e+07
    or (segid "   C" and resid   29 and name HG21) (segid "   A" and resid   29 and name HG12)
    or (segid "   C" and resid   29 and name HG23) (segid "   A" and resid   29 and name HG12)
assign (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   12 and name HG12) 2.414 0.728 3.586 weight 1.000 ! spec=Expt_12, no=168, id=1999, vol=4.685411e+07
    or (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   12 and name HG11)
    or (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   12 and name HG13)
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   12 and name HG12)
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   12 and name HG11)
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   12 and name HG13)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   12 and name HG12)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   12 and name HG11)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   12 and name HG13)
assign (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   12 and name HG12) 2.414 0.728 3.586 weight 1.000 ! spec=Expt_12, no=168, id=1999, vol=4.685411e+07
    or (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   12 and name HG11)
    or (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   12 and name HG13)
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   12 and name HG12)
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   12 and name HG11)
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   12 and name HG13)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   12 and name HG12)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   12 and name HG11)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   29 and name HD12) (segid "   C" and resid   13 and name   HB) 3.061 1.171 2.939 weight 1.000 ! spec=Expt_12, no=170, id=2001, vol=1.126876e+07
    or (segid "   A" and resid   29 and name HD11) (segid "   C" and resid   13 and name   HB)
    or (segid "   A" and resid   29 and name HD13) (segid "   C" and resid   13 and name   HB)
assign (segid "   C" and resid   29 and name HD12) (segid "   A" and resid   13 and name   HB) 3.061 1.171 2.939 weight 1.000 ! spec=Expt_12, no=170, id=2001, vol=1.126876e+07
    or (segid "   C" and resid   29 and name HD11) (segid "   A" and resid   13 and name   HB)
    or (segid "   C" and resid   29 and name HD13) (segid "   A" and resid   13 and name   HB)
assign (segid "   A" and resid   22 and name HD12) (segid "   C" and resid   37 and name HG12) 2.111 0.557 0.557 weight 1.000 ! spec=Expt_12, no=172, id=2003, vol=1.046650e+08
    or (segid "   A" and resid   22 and name HD12) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   22 and name HD12) (segid "   C" and resid   37 and name HG13)
    or (segid "   A" and resid   22 and name HD11) (segid "   C" and resid   37 and name HG12)
    or (segid "   A" and resid   22 and name HD11) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   22 and name HD11) (segid "   C" and resid   37 and name HG13)
    or (segid "   A" and resid   22 and name HD13) (segid "   C" and resid   37 and name HG12)
    or (segid "   A" and resid   22 and name HD13) (segid "   C" and resid   37 and name HG11)
    or (segid "   A" and resid   22 and name HD13) (segid "   C" and resid   37 and name HG13)
assign (segid "   C" and resid   22 and name HD12) (segid "   A" and resid   37 and name HG12) 2.111 0.557 0.557 weight 1.000 ! spec=Expt_12, no=172, id=2003, vol=1.046650e+08
    or (segid "   C" and resid   22 and name HD12) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   22 and name HD12) (segid "   A" and resid   37 and name HG13)
    or (segid "   C" and resid   22 and name HD11) (segid "   A" and resid   37 and name HG12)
    or (segid "   C" and resid   22 and name HD11) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   22 and name HD11) (segid "   A" and resid   37 and name HG13)
    or (segid "   C" and resid   22 and name HD13) (segid "   A" and resid   37 and name HG12)
    or (segid "   C" and resid   22 and name HD13) (segid "   A" and resid   37 and name HG11)
    or (segid "   C" and resid   22 and name HD13) (segid "   A" and resid   37 and name HG13)
assign (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   28 and name  HD1) 2.498 0.780 0.780 weight 1.000 ! spec=Expt_14, no=2, id=1782, vol=2.385098e+08
    or (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   28 and name  HB1) (segid "   C" and resid   28 and name  HD1) 2.498 0.780 0.780 weight 1.000 ! spec=Expt_14, no=2, id=1782, vol=2.385098e+08
    or (segid "   C" and resid   28 and name  HB1) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   28 and name  HD1) 2.516 0.791 0.791 weight 1.000 ! spec=Expt_14, no=3, id=1783, vol=2.282154e+08
    or (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   28 and name  HB2) (segid "   C" and resid   28 and name  HD1) 2.516 0.791 0.791 weight 1.000 ! spec=Expt_14, no=3, id=1783, vol=2.282154e+08
    or (segid "   C" and resid   28 and name  HB2) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   28 and name  HD1) 2.358 0.695 0.695 weight 1.000 ! spec=Expt_14, no=9, id=1789, vol=3.365447e+08
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   11 and name   HA) (segid "   C" and resid   28 and name  HD1) 2.358 0.695 0.695 weight 1.000 ! spec=Expt_14, no=9, id=1789, vol=3.365447e+08
    or (segid "   C" and resid   11 and name   HA) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid   28 and name  HD1) 3.033 1.150 1.150 weight 1.000 ! spec=Expt_14, no=10, id=1790, vol=7.444891e+07
    or (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid    9 and name  HB1) (segid "   C" and resid   28 and name  HD1) 3.033 1.150 1.150 weight 1.000 ! spec=Expt_14, no=10, id=1790, vol=7.444891e+07
    or (segid "   C" and resid    9 and name  HB1) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   30 and name   HA) 3.229 1.303 1.303 weight 1.000 ! spec=Expt_14, no=13, id=1792, vol=5.109314e+07
assign (segid "   C" and resid   28 and name   HZ) (segid "   C" and resid   30 and name   HA) 3.229 1.303 1.303 weight 1.000 ! spec=Expt_14, no=13, id=1792, vol=5.109314e+07
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   28 and name  HD1) 3.286 1.350 1.350 weight 1.000 ! spec=Expt_14, no=16, id=1795, vol=4.598501e+07
    or (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   28 and name   HZ) (segid "   C" and resid   28 and name  HD1) 3.286 1.350 1.350 weight 1.000 ! spec=Expt_14, no=16, id=1795, vol=4.598501e+07
    or (segid "   C" and resid   28 and name   HZ) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   31 and name  HB1) 3.419 1.461 2.581 weight 1.000 ! spec=Expt_14, no=17, id=1796, vol=3.624441e+07
assign (segid "   C" and resid   28 and name   HZ) (segid "   C" and resid   31 and name  HB1) 3.419 1.461 2.581 weight 1.000 ! spec=Expt_14, no=17, id=1796, vol=3.624441e+07
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   18 and name  HB2) 3.220 1.296 1.296 weight 1.000 ! spec=Expt_14, no=18, id=1797, vol=5.199164e+07
assign (segid "   C" and resid   28 and name   HZ) (segid "   C" and resid   18 and name  HB2) 3.220 1.296 1.296 weight 1.000 ! spec=Expt_14, no=18, id=1797, vol=5.199164e+07
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   30 and name  HB1) 3.335 1.390 1.390 weight 1.000 ! spec=Expt_14, no=19, id=1798, vol=4.209106e+07
assign (segid "   C" and resid   28 and name   HZ) (segid "   C" and resid   30 and name  HB1) 3.335 1.390 1.390 weight 1.000 ! spec=Expt_14, no=19, id=1798, vol=4.209106e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   28 and name  HE1) 2.926 1.070 3.074 weight 1.000 ! spec=Expt_14, no=20, id=1799, vol=9.225290e+07
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   28 and name  HE1) 2.926 1.070 3.074 weight 1.000 ! spec=Expt_14, no=20, id=1799, vol=9.225290e+07
    or (segid "   C" and resid   18 and name   HN) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   28 and name  HE1) 3.049 1.162 2.162 weight 1.000 ! spec=Expt_14, no=23, id=1802, vol=7.201943e+07
    or (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   28 and name  HE1) 3.049 1.162 2.162 weight 1.000 ! spec=Expt_14, no=23, id=1802, vol=7.201943e+07
    or (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   28 and name  HE1) 3.024 1.143 1.143 weight 1.000 ! spec=Expt_14, no=24, id=1803, vol=7.579665e+07
    or (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   30 and name  HB2) (segid "   C" and resid   28 and name  HE1) 3.024 1.143 1.143 weight 1.000 ! spec=Expt_14, no=24, id=1803, vol=7.579665e+07
    or (segid "   C" and resid   30 and name  HB2) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   28 and name  HE1) 2.660 0.884 0.884 weight 1.000 ! spec=Expt_14, no=25, id=1804, vol=1.636404e+08
    or (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   30 and name  HB1) (segid "   C" and resid   28 and name  HE1) 2.660 0.884 0.884 weight 1.000 ! spec=Expt_14, no=25, id=1804, vol=1.636404e+08
    or (segid "   C" and resid   30 and name  HB1) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid   28 and name  HE1) 2.865 1.026 1.026 weight 1.000 ! spec=Expt_14, no=26, id=1805, vol=1.046893e+08
    or (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   18 and name  HB2) (segid "   C" and resid   28 and name  HE1) 2.865 1.026 1.026 weight 1.000 ! spec=Expt_14, no=26, id=1805, vol=1.046893e+08
    or (segid "   C" and resid   18 and name  HB2) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   18 and name  HG1) 3.034 1.151 1.151 weight 1.000 ! spec=Expt_14, no=27, id=1806, vol=7.426882e+07
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   18 and name  HG1)
assign (segid "   C" and resid   28 and name  HE1) (segid "   C" and resid   18 and name  HG1) 3.034 1.151 1.151 weight 1.000 ! spec=Expt_14, no=27, id=1806, vol=7.426882e+07
    or (segid "   C" and resid   28 and name  HE2) (segid "   C" and resid   18 and name  HG1)
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name  HD1) 2.406 0.724 0.724 weight 1.000 ! spec=Expt_14, no=28, id=1807, vol=2.983356e+08
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name  HD2)
assign (segid "   C" and resid   25 and name  HB1) (segid "   C" and resid   25 and name  HD1) 2.406 0.724 0.724 weight 1.000 ! spec=Expt_14, no=28, id=1807, vol=2.983356e+08
    or (segid "   C" and resid   25 and name  HB1) (segid "   C" and resid   25 and name  HD2)
assign (segid "   A" and resid   25 and name  HD1) (segid "   C" and resid   13 and name HG22) 2.423 0.734 0.734 weight 1.000 ! spec=Expt_14, no=29, id=1808, vol=2.860825e+08
    or (segid "   A" and resid   25 and name  HD1) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   25 and name  HD1) (segid "   C" and resid   13 and name HG23)
    or (segid "   A" and resid   25 and name  HD2) (segid "   C" and resid   13 and name HG22)
    or (segid "   A" and resid   25 and name  HD2) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   25 and name  HD2) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   25 and name  HD1) (segid "   A" and resid   13 and name HG22) 2.423 0.734 0.734 weight 1.000 ! spec=Expt_14, no=29, id=1808, vol=2.860825e+08
    or (segid "   C" and resid   25 and name  HD1) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   25 and name  HD1) (segid "   A" and resid   13 and name HG23)
    or (segid "   C" and resid   25 and name  HD2) (segid "   A" and resid   13 and name HG22)
    or (segid "   C" and resid   25 and name  HD2) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   25 and name  HD2) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   47 and name  HD1) 2.559 0.819 0.819 weight 1.000 ! spec=Expt_14, no=30, id=1809, vol=2.061308e+08
    or (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   47 and name  HD2)
assign (segid "   C" and resid   47 and name  HB2) (segid "   C" and resid   47 and name  HD1) 2.559 0.819 0.819 weight 1.000 ! spec=Expt_14, no=30, id=1809, vol=2.061308e+08
    or (segid "   C" and resid   47 and name  HB2) (segid "   C" and resid   47 and name  HD2)
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name  HD1) 2.469 0.762 0.762 weight 1.000 ! spec=Expt_14, no=31, id=1810, vol=2.554196e+08
    or (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name  HD2)
assign (segid "   C" and resid   47 and name  HB1) (segid "   C" and resid   47 and name  HD1) 2.469 0.762 0.762 weight 1.000 ! spec=Expt_14, no=31, id=1810, vol=2.554196e+08
    or (segid "   C" and resid   47 and name  HB1) (segid "   C" and resid   47 and name  HD2)
assign (segid "   A" and resid   47 and name  HD1) (segid "   A" and resid   46 and name  HB1) 3.313 1.372 1.372 weight 1.000 ! spec=Expt_14, no=32, id=1811, vol=4.382552e+07
    or (segid "   A" and resid   47 and name  HD2) (segid "   A" and resid   46 and name  HB1)
assign (segid "   C" and resid   47 and name  HD1) (segid "   C" and resid   46 and name  HB1) 3.313 1.372 1.372 weight 1.000 ! spec=Expt_14, no=32, id=1811, vol=4.382552e+07
    or (segid "   C" and resid   47 and name  HD2) (segid "   C" and resid   46 and name  HB1)
assign (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   24 and name  HB1) 2.875 1.033 1.033 weight 1.000 ! spec=Expt_14, no=33, id=1812, vol=1.025005e+08
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   24 and name  HB1)
assign (segid "   C" and resid   25 and name  HE1) (segid "   C" and resid   24 and name  HB1) 2.875 1.033 1.033 weight 1.000 ! spec=Expt_14, no=33, id=1812, vol=1.025005e+08
    or (segid "   C" and resid   25 and name  HE2) (segid "   C" and resid   24 and name  HB1)
assign (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   13 and name HG22) 2.674 0.894 0.894 weight 1.000 ! spec=Expt_14, no=34, id=1813, vol=1.585403e+08
    or (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   13 and name HG23)
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   13 and name HG22)
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   13 and name HG21)
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   13 and name HG23)
assign (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   13 and name HG22) 2.674 0.894 0.894 weight 1.000 ! spec=Expt_14, no=34, id=1813, vol=1.585403e+08
    or (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   13 and name HG23)
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   13 and name HG22)
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   13 and name HG21)
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   13 and name HG23)
assign (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   13 and name HD12) 2.830 1.001 3.170 weight 1.000 ! spec=Expt_14, no=35, id=1814, vol=1.127721e+08
    or (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   13 and name HD13)
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   13 and name HD12)
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   13 and name HD13)
assign (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   13 and name HD12) 2.830 1.001 3.170 weight 1.000 ! spec=Expt_14, no=35, id=1814, vol=1.127721e+08
    or (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   13 and name HD13)
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   13 and name HD12)
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   13 and name HD13)
assign (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   36 and name  HD2) 2.886 1.041 2.041 weight 1.000 ! spec=Expt_14, no=36, id=1815, vol=1.003269e+08
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   36 and name  HD2)
assign (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   36 and name  HD2) 2.886 1.041 2.041 weight 1.000 ! spec=Expt_14, no=36, id=1815, vol=1.003269e+08
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   36 and name  HD2)
assign (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   14 and name  HB1) 2.733 0.934 0.934 weight 1.000 ! spec=Expt_14, no=37, id=1816, vol=1.388263e+08
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   14 and name  HB1)
assign (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   14 and name  HB1) 2.733 0.934 0.934 weight 1.000 ! spec=Expt_14, no=37, id=1816, vol=1.388263e+08
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   14 and name  HB1)
assign (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   14 and name  HB2) 2.782 0.968 3.218 weight 1.000 ! spec=Expt_14, no=38, id=1817, vol=1.248506e+08
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   14 and name  HB2)
assign (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   14 and name  HB2) 2.782 0.968 3.218 weight 1.000 ! spec=Expt_14, no=38, id=1817, vol=1.248506e+08
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   14 and name  HB2)
assign (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name  HB2) 3.025 1.144 2.975 weight 1.000 ! spec=Expt_14, no=39, id=1818, vol=7.562301e+07
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HB2)
assign (segid "   C" and resid   25 and name  HE1) (segid "   C" and resid   25 and name  HB2) 3.025 1.144 2.975 weight 1.000 ! spec=Expt_14, no=39, id=1818, vol=7.562301e+07
    or (segid "   C" and resid   25 and name  HE2) (segid "   C" and resid   25 and name  HB2)
assign (segid "   A" and resid    9 and name  HD2) (segid "   A" and resid    9 and name  HB1) 2.978 1.108 1.108 weight 1.000 ! spec=Expt_14, no=41, id=1820, vol=8.304094e+07
assign (segid "   C" and resid    9 and name  HD2) (segid "   C" and resid    9 and name  HB1) 2.978 1.108 1.108 weight 1.000 ! spec=Expt_14, no=41, id=1820, vol=8.304094e+07
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name  HD2) 3.116 1.214 1.214 weight 1.000 ! spec=Expt_14, no=42, id=1821, vol=6.323383e+07
assign (segid "   C" and resid    9 and name  HB2) (segid "   C" and resid    9 and name  HD2) 3.116 1.214 1.214 weight 1.000 ! spec=Expt_14, no=42, id=1821, vol=6.323383e+07
assign (segid "   A" and resid   47 and name  HE1) (segid "   A" and resid   47 and name  HD1) 1.978 0.489 0.489 weight 1.000 ! spec=Expt_14, no=43, id=1822, vol=9.680875e+08
    or (segid "   A" and resid   47 and name  HE1) (segid "   A" and resid   47 and name  HD2)
    or (segid "   A" and resid   47 and name  HE2) (segid "   A" and resid   47 and name  HD1)
    or (segid "   A" and resid   47 and name  HE2) (segid "   A" and resid   47 and name  HD2)
assign (segid "   C" and resid   47 and name  HE1) (segid "   C" and resid   47 and name  HD1) 1.978 0.489 0.489 weight 1.000 ! spec=Expt_14, no=43, id=1822, vol=9.680875e+08
    or (segid "   C" and resid   47 and name  HE1) (segid "   C" and resid   47 and name  HD2)
    or (segid "   C" and resid   47 and name  HE2) (segid "   C" and resid   47 and name  HD1)
    or (segid "   C" and resid   47 and name  HE2) (segid "   C" and resid   47 and name  HD2)
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name  HD2) 2.769 0.959 0.959 weight 1.000 ! spec=Expt_14, no=44, id=1823, vol=1.283540e+08
assign (segid "   C" and resid   23 and name  HB2) (segid "   C" and resid   23 and name  HD2) 2.769 0.959 0.959 weight 1.000 ! spec=Expt_14, no=44, id=1823, vol=1.283540e+08
assign (segid "   A" and resid    9 and name  HD2) (segid "   A" and resid   28 and name  HD1) 3.240 1.312 2.312 weight 1.000 ! spec=Expt_14, no=45, id=1824, vol=5.004640e+07
    or (segid "   A" and resid    9 and name  HD2) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid    9 and name  HD2) (segid "   C" and resid   28 and name  HD1) 3.240 1.312 2.312 weight 1.000 ! spec=Expt_14, no=45, id=1824, vol=5.004640e+07
    or (segid "   C" and resid    9 and name  HD2) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   23 and name  HD2) 3.256 1.325 1.325 weight 1.000 ! spec=Expt_14, no=46, id=1825, vol=4.858301e+07
assign (segid "   C" and resid   23 and name   HA) (segid "   C" and resid   23 and name  HD2) 3.256 1.325 1.325 weight 1.000 ! spec=Expt_14, no=46, id=1825, vol=4.858301e+07
assign (segid "   A" and resid   47 and name   HA) (segid "   A" and resid   47 and name  HD1) 2.747 0.943 0.943 weight 1.000 ! spec=Expt_14, no=48, id=1827, vol=1.346954e+08
    or (segid "   A" and resid   47 and name   HA) (segid "   A" and resid   47 and name  HD2)
assign (segid "   C" and resid   47 and name   HA) (segid "   C" and resid   47 and name  HD1) 2.747 0.943 0.943 weight 1.000 ! spec=Expt_14, no=48, id=1827, vol=1.346954e+08
    or (segid "   C" and resid   47 and name   HA) (segid "   C" and resid   47 and name  HD2)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HD2) 3.107 1.207 2.893 weight 1.000 ! spec=Expt_14, no=49, id=1828, vol=6.438278e+07
assign (segid "   C" and resid   23 and name   HN) (segid "   C" and resid   23 and name  HD2) 3.107 1.207 2.893 weight 1.000 ! spec=Expt_14, no=49, id=1828, vol=6.438278e+07
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name  HD1) 2.406 0.724 0.724 weight 1.000 ! spec=Expt_14, no=50, id=1829, vol=2.983356e+08
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name  HD2)
assign (segid "   C" and resid   25 and name  HB2) (segid "   C" and resid   25 and name  HD1) 2.406 0.724 0.724 weight 1.000 ! spec=Expt_14, no=50, id=1829, vol=2.983356e+08
    or (segid "   C" and resid   25 and name  HB2) (segid "   C" and resid   25 and name  HD2)
assign (segid "   A" and resid   25 and name  HD1) (segid "   C" and resid   13 and name   HA) 2.572 0.827 3.428 weight 1.000 ! spec=Expt_14, no=51, id=1830, vol=2.000298e+08
    or (segid "   A" and resid   25 and name  HD2) (segid "   C" and resid   13 and name   HA)
assign (segid "   C" and resid   25 and name  HD1) (segid "   A" and resid   13 and name   HA) 2.572 0.827 3.428 weight 1.000 ! spec=Expt_14, no=51, id=1830, vol=2.000298e+08
    or (segid "   C" and resid   25 and name  HD2) (segid "   A" and resid   13 and name   HA)
assign (segid "   A" and resid   24 and name HD22) (segid "   A" and resid   25 and name  HE1) 2.840 1.008 1.008 weight 1.000 ! spec=Expt_14, no=52, id=1831, vol=1.104052e+08
    or (segid "   A" and resid   24 and name HD22) (segid "   A" and resid   25 and name  HE2)
    or (segid "   A" and resid   24 and name HD21) (segid "   A" and resid   25 and name  HE1)
    or (segid "   A" and resid   24 and name HD21) (segid "   A" and resid   25 and name  HE2)
    or (segid "   A" and resid   24 and name HD23) (segid "   A" and resid   25 and name  HE1)
    or (segid "   A" and resid   24 and name HD23) (segid "   A" and resid   25 and name  HE2)
assign (segid "   C" and resid   24 and name HD22) (segid "   C" and resid   25 and name  HE1) 2.840 1.008 1.008 weight 1.000 ! spec=Expt_14, no=52, id=1831, vol=1.104052e+08
    or (segid "   C" and resid   24 and name HD22) (segid "   C" and resid   25 and name  HE2)
    or (segid "   C" and resid   24 and name HD21) (segid "   C" and resid   25 and name  HE1)
    or (segid "   C" and resid   24 and name HD21) (segid "   C" and resid   25 and name  HE2)
    or (segid "   C" and resid   24 and name HD23) (segid "   C" and resid   25 and name  HE1)
    or (segid "   C" and resid   24 and name HD23) (segid "   C" and resid   25 and name  HE2)
assign (segid "   A" and resid   24 and name HD12) (segid "   A" and resid   25 and name  HE1) 2.841 1.009 1.009 weight 1.000 ! spec=Expt_14, no=53, id=1832, vol=1.100301e+08
    or (segid "   A" and resid   24 and name HD12) (segid "   A" and resid   25 and name  HE2)
    or (segid "   A" and resid   24 and name HD11) (segid "   A" and resid   25 and name  HE1)
    or (segid "   A" and resid   24 and name HD11) (segid "   A" and resid   25 and name  HE2)
    or (segid "   A" and resid   24 and name HD13) (segid "   A" and resid   25 and name  HE1)
    or (segid "   A" and resid   24 and name HD13) (segid "   A" and resid   25 and name  HE2)
assign (segid "   C" and resid   24 and name HD12) (segid "   C" and resid   25 and name  HE1) 2.841 1.009 1.009 weight 1.000 ! spec=Expt_14, no=53, id=1832, vol=1.100301e+08
    or (segid "   C" and resid   24 and name HD12) (segid "   C" and resid   25 and name  HE2)
    or (segid "   C" and resid   24 and name HD11) (segid "   C" and resid   25 and name  HE1)
    or (segid "   C" and resid   24 and name HD11) (segid "   C" and resid   25 and name  HE2)
    or (segid "   C" and resid   24 and name HD13) (segid "   C" and resid   25 and name  HE1)
    or (segid "   C" and resid   24 and name HD13) (segid "   C" and resid   25 and name  HE2)
assign (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name  HB1) 3.025 1.144 2.975 weight 1.000 ! spec=Expt_14, no=54, id=1833, vol=7.562301e+07
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HB1)
assign (segid "   C" and resid   25 and name  HE1) (segid "   C" and resid   25 and name  HB1) 3.025 1.144 2.975 weight 1.000 ! spec=Expt_14, no=54, id=1833, vol=7.562301e+07
    or (segid "   C" and resid   25 and name  HE2) (segid "   C" and resid   25 and name  HB1)
assign (segid "   A" and resid   25 and name  HE1) (segid "   C" and resid   36 and name  HE2) 2.782 0.968 3.218 weight 1.000 ! spec=Expt_14, no=55, id=1834, vol=1.248506e+08
    or (segid "   A" and resid   25 and name  HE2) (segid "   C" and resid   36 and name  HE2)
assign (segid "   C" and resid   25 and name  HE1) (segid "   A" and resid   36 and name  HE2) 2.782 0.968 3.218 weight 1.000 ! spec=Expt_14, no=55, id=1834, vol=1.248506e+08
    or (segid "   C" and resid   25 and name  HE2) (segid "   A" and resid   36 and name  HE2)
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   28 and name  HD1) 3.208 1.287 1.287 weight 1.000 ! spec=Expt_14, no=56, id=1835, vol=5.310630e+07
    or (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   28 and name  HD1) 3.208 1.287 1.287 weight 1.000 ! spec=Expt_14, no=56, id=1835, vol=5.310630e+07
    or (segid "   C" and resid   11 and name  HB2) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   12 and name   HA) 3.241 1.313 2.759 weight 1.000 ! spec=Expt_14, no=57, id=1836, vol=4.999243e+07
    or (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   12 and name   HA)
assign (segid "   C" and resid   28 and name  HD1) (segid "   C" and resid   12 and name   HA) 3.241 1.313 2.759 weight 1.000 ! spec=Expt_14, no=57, id=1836, vol=4.999243e+07
    or (segid "   C" and resid   28 and name  HD2) (segid "   C" and resid   12 and name   HA)
assign (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   18 and name  HD1) 2.597 0.843 3.403 weight 1.000 ! spec=Expt_14, no=60, id=1838, vol=1.886135e+08
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   18 and name  HD1)
assign (segid "   C" and resid   28 and name  HE1) (segid "   C" and resid   18 and name  HD1) 2.597 0.843 3.403 weight 1.000 ! spec=Expt_14, no=60, id=1838, vol=1.886135e+08
    or (segid "   C" and resid   28 and name  HE2) (segid "   C" and resid   18 and name  HD1)
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   28 and name  HE1) 2.713 0.920 3.287 weight 1.000 ! spec=Expt_14, no=61, id=1839, vol=1.453192e+08
    or (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   11 and name  HB1) (segid "   C" and resid   28 and name  HE1) 2.713 0.920 3.287 weight 1.000 ! spec=Expt_14, no=61, id=1839, vol=1.453192e+08
    or (segid "   C" and resid   11 and name  HB1) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   28 and name  HE1) 2.823 0.996 0.996 weight 1.000 ! spec=Expt_14, no=63, id=1841, vol=1.143535e+08
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   11 and name   HA) (segid "   C" and resid   28 and name  HE1) 2.823 0.996 0.996 weight 1.000 ! spec=Expt_14, no=63, id=1841, vol=1.143535e+08
    or (segid "   C" and resid   11 and name   HA) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   24 and name HD12) (segid "   A" and resid   25 and name  HD1) 2.985 1.113 1.113 weight 1.000 ! spec=Expt_14, no=66, id=1844, vol=8.193633e+07
    or (segid "   A" and resid   24 and name HD12) (segid "   A" and resid   25 and name  HD2)
    or (segid "   A" and resid   24 and name HD11) (segid "   A" and resid   25 and name  HD1)
    or (segid "   A" and resid   24 and name HD11) (segid "   A" and resid   25 and name  HD2)
    or (segid "   A" and resid   24 and name HD13) (segid "   A" and resid   25 and name  HD1)
    or (segid "   A" and resid   24 and name HD13) (segid "   A" and resid   25 and name  HD2)
assign (segid "   C" and resid   24 and name HD12) (segid "   C" and resid   25 and name  HD1) 2.985 1.113 1.113 weight 1.000 ! spec=Expt_14, no=66, id=1844, vol=8.193633e+07
    or (segid "   C" and resid   24 and name HD12) (segid "   C" and resid   25 and name  HD2)
    or (segid "   C" and resid   24 and name HD11) (segid "   C" and resid   25 and name  HD1)
    or (segid "   C" and resid   24 and name HD11) (segid "   C" and resid   25 and name  HD2)
    or (segid "   C" and resid   24 and name HD13) (segid "   C" and resid   25 and name  HD1)
    or (segid "   C" and resid   24 and name HD13) (segid "   C" and resid   25 and name  HD2)
assign (segid "   A" and resid   25 and name  HD1) (segid "   C" and resid   13 and name HD12) 2.969 1.102 3.031 weight 1.000 ! spec=Expt_14, no=67, id=1845, vol=8.447314e+07
    or (segid "   A" and resid   25 and name  HD1) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   25 and name  HD1) (segid "   C" and resid   13 and name HD13)
    or (segid "   A" and resid   25 and name  HD2) (segid "   C" and resid   13 and name HD12)
    or (segid "   A" and resid   25 and name  HD2) (segid "   C" and resid   13 and name HD11)
    or (segid "   A" and resid   25 and name  HD2) (segid "   C" and resid   13 and name HD13)
assign (segid "   C" and resid   25 and name  HD1) (segid "   A" and resid   13 and name HD12) 2.969 1.102 3.031 weight 1.000 ! spec=Expt_14, no=67, id=1845, vol=8.447314e+07
    or (segid "   C" and resid   25 and name  HD1) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   25 and name  HD1) (segid "   A" and resid   13 and name HD13)
    or (segid "   C" and resid   25 and name  HD2) (segid "   A" and resid   13 and name HD12)
    or (segid "   C" and resid   25 and name  HD2) (segid "   A" and resid   13 and name HD11)
    or (segid "   C" and resid   25 and name  HD2) (segid "   A" and resid   13 and name HD13)
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   25 and name  HD1) 2.632 0.866 0.866 weight 1.000 ! spec=Expt_14, no=68, id=1846, vol=1.741851e+08
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   25 and name  HD2)
assign (segid "   C" and resid   24 and name  HB1) (segid "   C" and resid   25 and name  HD1) 2.632 0.866 0.866 weight 1.000 ! spec=Expt_14, no=68, id=1846, vol=1.741851e+08
    or (segid "   C" and resid   24 and name  HB1) (segid "   C" and resid   25 and name  HD2)
assign (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   24 and name   HA) 2.695 0.908 0.908 weight 1.000 ! spec=Expt_14, no=69, id=1847, vol=1.511366e+08
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   24 and name   HA)
assign (segid "   C" and resid   25 and name  HD1) (segid "   C" and resid   24 and name   HA) 2.695 0.908 0.908 weight 1.000 ! spec=Expt_14, no=69, id=1847, vol=1.511366e+08
    or (segid "   C" and resid   25 and name  HD2) (segid "   C" and resid   24 and name   HA)
assign (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   18 and name  HG2) 3.262 1.330 2.738 weight 1.000 ! spec=Expt_14, no=70, id=1848, vol=4.806290e+07
    or (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   18 and name  HG2)
assign (segid "   C" and resid   28 and name  HD1) (segid "   C" and resid   18 and name  HG2) 3.262 1.330 2.738 weight 1.000 ! spec=Expt_14, no=70, id=1848, vol=4.806290e+07
    or (segid "   C" and resid   28 and name  HD2) (segid "   C" and resid   18 and name  HG2)
assign (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   28 and name  HD1) 2.556 0.817 0.817 weight 1.000 ! spec=Expt_14, no=71, id=1849, vol=2.076926e+08
    or (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   28 and name   HA) (segid "   C" and resid   28 and name  HD1) 2.556 0.817 0.817 weight 1.000 ! spec=Expt_14, no=71, id=1849, vol=2.076926e+08
    or (segid "   C" and resid   28 and name   HA) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   28 and name  HE1) 2.971 1.103 3.029 weight 1.000 ! spec=Expt_14, no=72, id=1850, vol=8.423543e+07
    or (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid    9 and name  HB2) (segid "   C" and resid   28 and name  HE1) 2.971 1.103 3.029 weight 1.000 ! spec=Expt_14, no=72, id=1850, vol=8.423543e+07
    or (segid "   C" and resid    9 and name  HB2) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   28 and name  HD1) 2.307 0.665 0.665 weight 1.000 ! spec=Expt_14, no=73, id=1851, vol=3.843501e+08
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   28 and name  HD2)
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   28 and name  HD1)
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   28 and name  HE1) (segid "   C" and resid   28 and name  HD1) 2.307 0.665 0.665 weight 1.000 ! spec=Expt_14, no=73, id=1851, vol=3.843501e+08
    or (segid "   C" and resid   28 and name  HE1) (segid "   C" and resid   28 and name  HD2)
    or (segid "   C" and resid   28 and name  HE2) (segid "   C" and resid   28 and name  HD1)
    or (segid "   C" and resid   28 and name  HE2) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   28 and name  HE1) 3.098 1.200 1.200 weight 1.000 ! spec=Expt_14, no=74, id=1852, vol=6.545716e+07
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   28 and name  HE2)
assign (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   28 and name  HE1) 3.098 1.200 1.200 weight 1.000 ! spec=Expt_14, no=74, id=1852, vol=6.545716e+07
    or (segid "   C" and resid   22 and name   HN) (segid "   C" and resid   28 and name  HE2)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   28 and name  HD1) 2.968 1.101 3.032 weight 1.000 ! spec=Expt_14, no=75, id=1853, vol=8.475116e+07
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   28 and name  HD2)
assign (segid "   C" and resid   10 and name   HN) (segid "   C" and resid   28 and name  HD1) 2.968 1.101 3.032 weight 1.000 ! spec=Expt_14, no=75, id=1853, vol=8.475116e+07
    or (segid "   C" and resid   10 and name   HN) (segid "   C" and resid   28 and name  HD2)
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   18 and name  HD1) 3.039 1.154 2.961 weight 1.000 ! spec=Expt_14, no=76, id=1854, vol=7.351567e+07
assign (segid "   C" and resid   28 and name   HZ) (segid "   C" and resid   18 and name  HD1) 3.039 1.154 2.961 weight 1.000 ! spec=Expt_14, no=76, id=1854, vol=7.351567e+07
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   0           H1       SER   0  -9.239  -9.511  -0.535
    2    H2   SER   0           H2       SER   0  -8.102 -10.761  -0.484
    3    H3   SER   0           H3       SER   0  -9.285 -10.746  -1.690
    4    HA   SER   0           HA       SER   0  -7.164  -8.712  -1.365
    5    HB2  SER   0           HB2      SER   0  -7.400 -10.954  -3.387
    6    HB3  SER   0           HB3      SER   0  -6.123  -9.738  -3.333
    7    HG   SER   0           HG       SER   0  -5.572 -10.561  -1.240
    8    H    MET   1           H        MET   1 -10.270  -9.090  -2.144
    9    HA   MET   1           HA       MET   1 -10.259  -6.752  -3.846
   10    HB2  MET   1           HB2      MET   1 -10.065  -8.765  -5.398
   11    HB3  MET   1           HB3      MET   1 -11.642  -9.268  -4.812
   12    HG2  MET   1           HG2      MET   1 -11.879  -8.149  -6.922
   13    HG3  MET   1           HG3      MET   1 -12.605  -7.170  -5.650
   14    HE1  MET   1           HE1      MET   1  -9.451  -7.695  -7.897
   15    HE2  MET   1           HE2      MET   1  -8.715  -7.498  -6.306
   16    HE3  MET   1           HE3      MET   1  -8.493  -6.258  -7.540
   17    H    ASP   2           H        ASP   2 -10.989  -7.130  -1.243
   18    HA   ASP   2           HA       ASP   2 -13.921  -7.389  -1.258
   19    HB2  ASP   2           HB2      ASP   2 -12.108  -8.546   0.865
   20    HB3  ASP   2           HB3      ASP   2 -13.844  -8.788   0.696
   21    H    GLU   3           H        GLU   3 -12.913  -4.950  -1.344
   22    HA   GLU   3           HA       GLU   3 -12.613  -4.012   1.404
   23    HB2  GLU   3           HB2      GLU   3 -12.105  -1.958  -0.466
   24    HB3  GLU   3           HB3      GLU   3 -11.022  -2.699   0.707
   25    HG2  GLU   3           HG2      GLU   3  -9.992  -3.062  -1.278
   26    HG3  GLU   3           HG3      GLU   3 -10.801  -4.583  -0.998
   27    H    THR   4           H        THR   4 -13.759  -2.452  -1.556
   28    HA   THR   4           HA       THR   4 -15.489  -1.071  -2.012
   29    HB   THR   4           HB       THR   4 -17.759  -1.836  -1.289
   30    HG1  THR   4           HG1      THR   4 -16.383  -3.114   0.583
   31   HG21  THR   4          HG21      THR   4 -17.703  -3.920  -2.574
   32   HG22  THR   4          HG22      THR   4 -15.945  -3.958  -2.436
   33   HG23  THR   4          HG23      THR   4 -16.730  -2.664  -3.342
   34    H    VAL   5           H        VAL   5 -14.931   0.866  -1.089
   35    HA   VAL   5           HA       VAL   5 -15.649   1.269   1.720
   36    HB   VAL   5           HB       VAL   5 -13.313   1.744   1.005
   37   HG11  VAL   5          HG11      VAL   5 -13.732   2.653  -1.188
   38   HG12  VAL   5          HG12      VAL   5 -12.852   3.823  -0.204
   39   HG13  VAL   5          HG13      VAL   5 -14.581   4.027  -0.483
   40   HG21  VAL   5          HG21      VAL   5 -14.201   2.720   3.035
   41   HG22  VAL   5          HG22      VAL   5 -14.871   4.069   2.119
   42   HG23  VAL   5          HG23      VAL   5 -13.124   3.863   2.232
   43    H    LYS   6           H        LYS   6 -17.610   1.222  -0.398
   44    HA   LYS   6           HA       LYS   6 -19.648   2.180  -0.659
   45    HB2  LYS   6           HB2      LYS   6 -18.609   4.291   1.190
   46    HB3  LYS   6           HB3      LYS   6 -20.263   4.199   0.629
   47    HG2  LYS   6           HG2      LYS   6 -20.646   2.219   1.821
   48    HG3  LYS   6           HG3      LYS   6 -18.930   1.963   2.118
   49    HD2  LYS   6           HD2      LYS   6 -20.054   2.764   4.125
   50    HD3  LYS   6           HD3      LYS   6 -18.889   3.950   3.550
   51    HE2  LYS   6           HE2      LYS   6 -20.725   5.179   2.487
   52    HE3  LYS   6           HE3      LYS   6 -21.872   4.011   3.130
   53    HZ1  LYS   6           HZ1      LYS   6 -21.807   5.946   4.528
   54    HZ2  LYS   6           HZ2      LYS   6 -20.131   5.827   4.706
   55    HZ3  LYS   6           HZ3      LYS   6 -21.137   4.642   5.372
   56    H    LEU   7           H        LEU   7 -17.652   5.105  -0.398
   57    HA   LEU   7           HA       LEU   7 -18.387   5.699  -3.182
   58    HB2  LEU   7           HB2      LEU   7 -18.498   8.053  -2.649
   59    HB3  LEU   7           HB3      LEU   7 -19.599   7.161  -1.632
   60    HG   LEU   7           HG       LEU   7 -16.880   7.919  -0.615
   61   HD11  LEU   7          HD11      LEU   7 -19.353   9.649  -0.576
   62   HD12  LEU   7          HD12      LEU   7 -17.870   9.980  -1.471
   63   HD13  LEU   7          HD13      LEU   7 -17.853   9.973   0.292
   64   HD21  LEU   7          HD21      LEU   7 -19.558   7.419   0.666
   65   HD22  LEU   7          HD22      LEU   7 -18.097   7.900   1.529
   66   HD23  LEU   7          HD23      LEU   7 -18.160   6.348   0.696
   67    H    ASN   8           H        ASN   8 -16.865   7.686  -3.894
   68    HA   ASN   8           HA       ASN   8 -14.357   6.416  -4.196
   69    HB2  ASN   8           HB2      ASN   8 -13.745   8.764  -5.188
   70    HB3  ASN   8           HB3      ASN   8 -14.775   7.666  -6.076
   71   HD21  ASN   8          HD21      ASN   8 -15.764   9.287  -7.212
   72   HD22  ASN   8          HD22      ASN   8 -16.841  10.427  -6.490
   73    H    HIS   9           H        HIS   9 -12.517   6.629  -3.256
   74    HA   HIS   9           HA       HIS   9 -11.888   9.110  -1.818
   75    HB2  HIS   9           HB2      HIS   9 -11.220   6.277  -1.017
   76    HB3  HIS   9           HB3      HIS   9 -10.304   7.654  -0.424
   77    HD1  HIS   9           HD1      HIS   9 -11.131   8.673   1.667
   78    HD2  HIS   9           HD2      HIS   9 -14.099   6.500  -0.277
   79    HE1  HIS   9           HE1      HIS   9 -13.108   8.691   3.215
   80    HE2  HIS   9           HE2      HIS   9 -14.932   7.483   1.970
   81    H    THR  10           H        THR  10  -9.718   9.787  -2.141
   82    HA   THR  10           HA       THR  10  -8.870   9.082  -4.805
   83    HB   THR  10           HB       THR  10  -7.529  11.035  -2.912
   84    HG1  THR  10           HG1      THR  10  -9.104  12.329  -4.590
   85   HG21  THR  10          HG21      THR  10  -7.728  11.014  -5.923
   86   HG22  THR  10          HG22      THR  10  -6.335  10.434  -5.009
   87   HG23  THR  10          HG23      THR  10  -6.793  12.135  -4.932
   88    H    CYS  11           H        CYS  11  -7.112   7.912  -5.414
   89    HA   CYS  11           HA       CYS  11  -5.889   6.250  -3.443
   90    HB2  CYS  11           HB2      CYS  11  -6.202   5.478  -5.752
   91    HB3  CYS  11           HB3      CYS  11  -5.087   6.707  -6.312
   92    H    VAL  12           H        VAL  12  -4.384   6.779  -2.089
   93    HA   VAL  12           HA       VAL  12  -2.651   8.841  -1.967
   94    HB   VAL  12           HB       VAL  12  -3.190   6.646  -0.547
   95   HG11  VAL  12          HG11      VAL  12  -0.538   6.047  -1.766
   96   HG12  VAL  12          HG12      VAL  12  -1.982   5.037  -1.723
   97   HG13  VAL  12          HG13      VAL  12  -1.089   5.360  -0.240
   98   HG21  VAL  12          HG21      VAL  12  -2.419   8.553   0.433
   99   HG22  VAL  12          HG22      VAL  12  -0.840   8.414  -0.336
  100   HG23  VAL  12          HG23      VAL  12  -1.318   7.262   0.911
  101    H    ILE  13           H        ILE  13  -2.636   6.282  -4.202
  102    HA   ILE  13           HA       ILE  13   0.187   6.595  -4.874
  103    HB   ILE  13           HB       ILE  13  -1.704   4.528  -5.939
  104   HG12  ILE  13          HG12      ILE  13  -1.575   4.470  -3.425
  105   HG13  ILE  13          HG13      ILE  13  -1.077   3.003  -4.245
  106   HG21  ILE  13          HG21      ILE  13   0.348   4.850  -7.163
  107   HG22  ILE  13          HG22      ILE  13   0.302   3.275  -6.366
  108   HG23  ILE  13          HG23      ILE  13   1.275   4.585  -5.685
  109   HD11  ILE  13          HD11      ILE  13   1.188   3.490  -3.881
  110   HD12  ILE  13          HD12      ILE  13   0.331   3.689  -2.350
  111   HD13  ILE  13          HD13      ILE  13   0.807   5.104  -3.289
  112    H    CYS  14           H        CYS  14  -2.933   6.186  -6.494
  113    HA   CYS  14           HA       CYS  14  -1.877   6.978  -9.029
  114    HB2  CYS  14           HB2      CYS  14  -4.664   6.379  -8.162
  115    HB3  CYS  14           HB3      CYS  14  -4.184   6.632  -9.816
  116    H    ASP  15           H        ASP  15  -3.666   8.476  -6.473
  117    HA   ASP  15           HA       ASP  15  -4.538  10.520  -6.112
  118    HB2  ASP  15           HB2      ASP  15  -2.885  11.133  -8.483
  119    HB3  ASP  15           HB3      ASP  15  -3.991  12.345  -7.867
  120    H    GLN  16           H        GLN  16  -6.097   8.577  -7.332
  121    HA   GLN  16           HA       GLN  16  -7.955  10.229  -8.871
  122    HB2  GLN  16           HB2      GLN  16  -7.007   7.476  -9.397
  123    HB3  GLN  16           HB3      GLN  16  -8.703   7.811  -9.690
  124    HG2  GLN  16           HG2      GLN  16  -7.692   8.149 -11.703
  125    HG3  GLN  16           HG3      GLN  16  -7.889   9.764 -11.068
  126   HE21  GLN  16          HE21      GLN  16  -6.285  10.643 -12.302
  127   HE22  GLN  16          HE22      GLN  16  -4.621  10.270 -12.061
  128    H    GLU  17           H        GLU  17 -10.158   9.709  -8.610
  129    HA   GLU  17           HA       GLU  17 -10.843   9.043  -5.887
  130    HB2  GLU  17           HB2      GLU  17 -12.498  10.063  -8.188
  131    HB3  GLU  17           HB3      GLU  17 -13.116   9.786  -6.573
  132    HG2  GLU  17           HG2      GLU  17 -11.661  11.426  -5.650
  133    HG3  GLU  17           HG3      GLU  17 -10.832  11.609  -7.189
  134    H    LYS  18           H        LYS  18 -10.852   7.048  -5.490
  135    HA   LYS  18           HA       LYS  18 -12.189   5.136  -7.284
  136    HB2  LYS  18           HB2      LYS  18 -10.198   4.181  -5.353
  137    HB3  LYS  18           HB3      LYS  18 -10.568   3.588  -6.941
  138    HG2  LYS  18           HG2      LYS  18  -8.966   6.036  -6.319
  139    HG3  LYS  18           HG3      LYS  18  -8.325   4.484  -6.851
  140    HD2  LYS  18           HD2      LYS  18 -10.335   5.930  -8.501
  141    HD3  LYS  18           HD3      LYS  18  -8.658   6.394  -8.546
  142    HE2  LYS  18           HE2      LYS  18  -9.192   4.897 -10.356
  143    HE3  LYS  18           HE3      LYS  18  -8.072   4.174  -9.228
  144    HZ1  LYS  18           HZ1      LYS  18 -10.981   3.639  -9.230
  145    HZ2  LYS  18           HZ2      LYS  18  -9.806   2.825  -8.325
  146    HZ3  LYS  18           HZ3      LYS  18  -9.844   2.658 -10.004
  147    H    ASN  19           H        ASN  19 -13.823   3.945  -6.434
  148    HA   ASN  19           HA       ASN  19 -14.413   4.362  -3.615
  149    HB2  ASN  19           HB2      ASN  19 -16.601   3.722  -4.027
  150    HB3  ASN  19           HB3      ASN  19 -16.145   4.504  -5.530
  151   HD21  ASN  19          HD21      ASN  19 -14.637   2.357  -6.650
  152   HD22  ASN  19          HD22      ASN  19 -15.776   1.083  -7.045
  153    H    ARG  20           H        ARG  20 -12.609   2.210  -5.316
  154    HA   ARG  20           HA       ARG  20 -13.037   0.137  -3.277
  155    HB2  ARG  20           HB2      ARG  20 -12.649  -0.182  -6.212
  156    HB3  ARG  20           HB3      ARG  20 -11.932  -1.359  -5.152
  157    HG2  ARG  20           HG2      ARG  20 -14.213  -1.661  -4.154
  158    HG3  ARG  20           HG3      ARG  20 -14.809  -0.692  -5.499
  159    HD2  ARG  20           HD2      ARG  20 -13.982  -2.166  -7.091
  160    HD3  ARG  20           HD3      ARG  20 -13.036  -2.985  -5.885
  161    HE   ARG  20           HE       ARG  20 -15.939  -3.197  -6.230
  162   HH11  ARG  20          HH11      ARG  20 -13.002  -4.402  -4.716
  163   HH12  ARG  20          HH12      ARG  20 -13.718  -5.922  -4.281
  164   HH21  ARG  20          HH21      ARG  20 -16.871  -5.186  -5.631
  165   HH22  ARG  20          HH22      ARG  20 -15.918  -6.363  -4.786
  166    H    GLY  21           H        GLY  21 -11.307  -0.711  -2.300
  167    HA2  GLY  21           HA2      GLY  21  -8.723  -0.857  -2.552
  168    HA3  GLY  21           HA3      GLY  21  -8.861   0.895  -2.532
  169    H    ILE  22           H        ILE  22  -7.393   0.343  -0.515
  170    HA   ILE  22           HA       ILE  22  -9.177  -0.228   1.749
  171    HB   ILE  22           HB       ILE  22  -7.545  -1.430   2.830
  172   HG12  ILE  22          HG12      ILE  22  -5.499  -0.108   1.080
  173   HG13  ILE  22          HG13      ILE  22  -5.905   0.399   2.687
  174   HG21  ILE  22          HG21      ILE  22  -8.171  -2.666   0.834
  175   HG22  ILE  22          HG22      ILE  22  -6.479  -2.969   1.228
  176   HG23  ILE  22          HG23      ILE  22  -6.896  -1.867  -0.090
  177   HD11  ILE  22          HD11      ILE  22  -5.157  -1.781   3.528
  178   HD12  ILE  22          HD12      ILE  22  -3.882  -0.845   2.755
  179   HD13  ILE  22          HD13      ILE  22  -4.639  -2.191   1.892
  180    H    HIS  23           H        HIS  23  -7.695   0.465   3.787
  181    HA   HIS  23           HA       HIS  23  -6.967   3.262   3.486
  182    HB2  HIS  23           HB2      HIS  23  -9.307   2.313   5.143
  183    HB3  HIS  23           HB3      HIS  23  -8.544   3.871   5.370
  184    HD1  HIS  23           HD1      HIS  23  -9.076   5.717   3.694
  185    HD2  HIS  23           HD2      HIS  23 -10.759   2.047   2.793
  186    HE1  HIS  23           HE1      HIS  23 -10.687   6.164   1.818
  187    HE2  HIS  23           HE2      HIS  23 -11.562   3.894   1.174
  188    H    LEU  24           H        LEU  24  -5.000   3.174   4.382
  189    HA   LEU  24           HA       LEU  24  -4.696   1.972   7.023
  190    HB2  LEU  24           HB2      LEU  24  -2.799   2.883   4.899
  191    HB3  LEU  24           HB3      LEU  24  -2.292   2.919   6.531
  192    HG   LEU  24           HG       LEU  24  -1.946   0.676   6.614
  193   HD11  LEU  24          HD11      LEU  24  -3.111  -1.018   5.442
  194   HD12  LEU  24          HD12      LEU  24  -4.076   0.198   4.591
  195   HD13  LEU  24          HD13      LEU  24  -4.237   0.003   6.339
  196   HD21  LEU  24          HD21      LEU  24  -0.699   1.629   4.716
  197   HD22  LEU  24          HD22      LEU  24  -1.952   0.996   3.650
  198   HD23  LEU  24          HD23      LEU  24  -0.976  -0.108   4.619
  199    H    TYR  25           H        TYR  25  -4.902   3.330   8.710
  200    HA   TYR  25           HA       TYR  25  -4.739   5.191  10.011
  201    HB2  TYR  25           HB2      TYR  25  -3.085   6.468   7.872
  202    HB3  TYR  25           HB3      TYR  25  -3.094   6.866   9.571
  203    HD1  TYR  25           HD1      TYR  25  -0.682   6.678   9.847
  204    HD2  TYR  25           HD2      TYR  25  -2.923   3.415   8.314
  205    HE1  TYR  25           HE1      TYR  25   1.285   5.207  10.094
  206    HE2  TYR  25           HE2      TYR  25  -1.011   1.943   8.523
  207    HH   TYR  25           HH       TYR  25   1.877   2.955  10.252
  208    H    THR  26           H        THR  26  -4.285   7.532   7.632
  209    HA   THR  26           HA       THR  26  -7.166   8.078   7.552
  210    HB   THR  26           HB       THR  26  -6.323   9.911   8.615
  211    HG1  THR  26           HG1      THR  26  -6.872  10.322   6.061
  212   HG21  THR  26          HG21      THR  26  -3.864   9.884   6.886
  213   HG22  THR  26          HG22      THR  26  -3.988   9.133   8.479
  214   HG23  THR  26          HG23      THR  26  -4.157  10.884   8.308
  215    H    LYS  27           H        LYS  27  -4.830   6.761   5.620
  216    HA   LYS  27           HA       LYS  27  -5.527   8.318   3.238
  217    HB2  LYS  27           HB2      LYS  27  -3.677   6.235   2.615
  218    HB3  LYS  27           HB3      LYS  27  -3.463   7.967   2.529
  219    HG2  LYS  27           HG2      LYS  27  -2.925   6.214   4.912
  220    HG3  LYS  27           HG3      LYS  27  -1.745   6.968   3.847
  221    HD2  LYS  27           HD2      LYS  27  -3.722   8.446   5.555
  222    HD3  LYS  27           HD3      LYS  27  -2.041   8.174   5.973
  223    HE2  LYS  27           HE2      LYS  27  -2.287   9.310   3.337
  224    HE3  LYS  27           HE3      LYS  27  -3.137  10.301   4.517
  225    HZ1  LYS  27           HZ1      LYS  27  -0.266   9.528   4.559
  226    HZ2  LYS  27           HZ2      LYS  27  -1.046  10.291   5.849
  227    HZ3  LYS  27           HZ3      LYS  27  -0.910  11.078   4.360
  228    H    PHE  28           H        PHE  28  -5.224   6.870   1.204
  229    HA   PHE  28           HA       PHE  28  -6.807   4.426   1.375
  230    HB2  PHE  28           HB2      PHE  28  -8.482   6.083   0.912
  231    HB3  PHE  28           HB3      PHE  28  -7.468   6.858  -0.296
  232    HD1  PHE  28           HD1      PHE  28  -7.419   6.123  -2.533
  233    HD2  PHE  28           HD2      PHE  28  -9.477   3.828   0.401
  234    HE1  PHE  28           HE1      PHE  28  -8.375   4.730  -4.305
  235    HE2  PHE  28           HE2      PHE  28 -10.450   2.435  -1.377
  236    HZ   PHE  28           HZ       PHE  28  -9.885   2.868  -3.746
  237    H    ILE  29           H        ILE  29  -5.416   3.011   0.530
  238    HA   ILE  29           HA       ILE  29  -3.981   3.677  -1.931
  239    HB   ILE  29           HB       ILE  29  -4.114   1.086  -0.359
  240   HG12  ILE  29          HG12      ILE  29  -1.553   1.713  -0.173
  241   HG13  ILE  29          HG13      ILE  29  -2.162   3.342  -0.438
  242   HG21  ILE  29          HG21      ILE  29  -2.392   0.222  -1.837
  243   HG22  ILE  29          HG22      ILE  29  -2.400   1.725  -2.756
  244   HG23  ILE  29          HG23      ILE  29  -3.826   0.682  -2.763
  245   HD11  ILE  29          HD11      ILE  29  -1.886   2.725   1.945
  246   HD12  ILE  29          HD12      ILE  29  -3.152   1.515   1.730
  247   HD13  ILE  29          HD13      ILE  29  -3.522   3.226   1.517
  248    H    CYS  30           H        CYS  30  -5.066   3.353  -3.858
  249    HA   CYS  30           HA       CYS  30  -7.620   2.140  -3.914
  250    HB2  CYS  30           HB2      CYS  30  -7.713   2.595  -6.167
  251    HB3  CYS  30           HB3      CYS  30  -6.508   3.753  -5.640
  252    H    LEU  31           H        LEU  31  -8.253   0.295  -5.065
  253    HA   LEU  31           HA       LEU  31  -7.278  -1.982  -3.942
  254    HB2  LEU  31           HB2      LEU  31  -8.949  -3.044  -5.088
  255    HB3  LEU  31           HB3      LEU  31  -9.534  -1.417  -5.003
  256    HG   LEU  31           HG       LEU  31  -8.315  -1.318  -7.400
  257   HD11  LEU  31          HD11      LEU  31  -8.808  -3.354  -8.654
  258   HD12  LEU  31          HD12      LEU  31  -9.300  -4.154  -7.163
  259   HD13  LEU  31          HD13      LEU  31  -7.625  -3.646  -7.379
  260   HD21  LEU  31          HD21      LEU  31 -10.595  -0.646  -6.943
  261   HD22  LEU  31          HD22      LEU  31 -11.099  -2.335  -6.876
  262   HD23  LEU  31          HD23      LEU  31 -10.525  -1.648  -8.395
  263    H    ASP  32           H        ASP  32  -6.222  -0.445  -6.789
  264    HA   ASP  32           HA       ASP  32  -5.253  -2.823  -8.094
  265    HB2  ASP  32           HB2      ASP  32  -6.064  -0.502  -9.105
  266    HB3  ASP  32           HB3      ASP  32  -4.370  -0.111  -8.880
  267    H    CYS  33           H        CYS  33  -4.116  -0.159  -6.261
  268    HA   CYS  33           HA       CYS  33  -1.323  -0.721  -6.468
  269    HB2  CYS  33           HB2      CYS  33  -2.894   1.226  -4.792
  270    HB3  CYS  33           HB3      CYS  33  -1.163   1.051  -4.708
  271    H    GLU  34           H        GLU  34  -3.945  -1.339  -4.265
  272    HA   GLU  34           HA       GLU  34  -2.489  -2.242  -2.085
  273    HB2  GLU  34           HB2      GLU  34  -4.936  -1.796  -2.118
  274    HB3  GLU  34           HB3      GLU  34  -5.165  -3.265  -3.020
  275    HG2  GLU  34           HG2      GLU  34  -3.820  -3.345  -0.396
  276    HG3  GLU  34           HG3      GLU  34  -5.564  -3.259  -0.489
  277    H    ARG  35           H        ARG  35  -3.589  -3.955  -4.962
  278    HA   ARG  35           HA       ARG  35  -2.215  -6.324  -4.148
  279    HB2  ARG  35           HB2      ARG  35  -2.849  -7.336  -6.209
  280    HB3  ARG  35           HB3      ARG  35  -4.214  -6.383  -5.654
  281    HG2  ARG  35           HG2      ARG  35  -3.326  -4.558  -7.211
  282    HG3  ARG  35           HG3      ARG  35  -2.357  -5.836  -7.921
  283    HD2  ARG  35           HD2      ARG  35  -5.322  -5.710  -7.734
  284    HD3  ARG  35           HD3      ARG  35  -4.352  -5.624  -9.190
  285    HE   ARG  35           HE       ARG  35  -3.811  -8.054  -7.917
  286   HH11  ARG  35          HH11      ARG  35  -6.418  -6.441  -9.594
  287   HH12  ARG  35          HH12      ARG  35  -7.175  -7.912 -10.110
  288   HH21  ARG  35          HH21      ARG  35  -4.812 -10.010  -8.596
  289   HH22  ARG  35          HH22      ARG  35  -6.261  -9.937  -9.549
  290    H    LYS  36           H        LYS  36  -1.267  -3.508  -5.826
  291    HA   LYS  36           HA       LYS  36   0.808  -4.588  -7.410
  292    HB2  LYS  36           HB2      LYS  36   0.449  -1.833  -6.332
  293    HB3  LYS  36           HB3      LYS  36   1.690  -2.270  -7.475
  294    HG2  LYS  36           HG2      LYS  36  -0.233  -2.972  -8.974
  295    HG3  LYS  36           HG3      LYS  36  -1.269  -2.169  -7.866
  296    HD2  LYS  36           HD2      LYS  36  -0.393  -0.173  -8.387
  297    HD3  LYS  36           HD3      LYS  36   1.077  -0.808  -9.077
  298    HE2  LYS  36           HE2      LYS  36  -0.232  -1.703 -10.941
  299    HE3  LYS  36           HE3      LYS  36  -1.702  -1.042 -10.230
  300    HZ1  LYS  36           HZ1      LYS  36  -0.790   1.176 -10.496
  301    HZ2  LYS  36           HZ2      LYS  36  -0.846   0.371 -11.985
  302    HZ3  LYS  36           HZ3      LYS  36   0.626   0.539 -11.173
  303    H    VAL  37           H        VAL  37   0.518  -3.238  -4.271
  304    HA   VAL  37           HA       VAL  37   3.160  -2.934  -3.591
  305    HB   VAL  37           HB       VAL  37   2.387  -2.990  -1.256
  306   HG11  VAL  37          HG11      VAL  37   0.246  -1.460  -2.605
  307   HG12  VAL  37          HG12      VAL  37   1.899  -1.085  -3.093
  308   HG13  VAL  37          HG13      VAL  37   1.423  -0.926  -1.398
  309   HG21  VAL  37          HG21      VAL  37  -0.178  -3.138  -1.041
  310   HG22  VAL  37          HG22      VAL  37   0.789  -4.611  -1.082
  311   HG23  VAL  37          HG23      VAL  37  -0.069  -4.081  -2.534
  312    H    ILE  38           H        ILE  38   1.032  -5.637  -3.028
  313    HA   ILE  38           HA       ILE  38   2.680  -7.296  -1.518
  314    HB   ILE  38           HB       ILE  38   0.759  -8.438  -3.520
  315   HG12  ILE  38          HG12      ILE  38   0.029  -6.799  -1.113
  316   HG13  ILE  38          HG13      ILE  38  -0.512  -6.590  -2.760
  317   HG21  ILE  38          HG21      ILE  38   1.858 -10.035  -2.169
  318   HG22  ILE  38          HG22      ILE  38   0.210  -9.898  -1.554
  319   HG23  ILE  38          HG23      ILE  38   1.538  -9.113  -0.704
  320   HD11  ILE  38          HD11      ILE  38  -2.148  -7.589  -1.061
  321   HD12  ILE  38          HD12      ILE  38  -1.199  -9.067  -1.237
  322   HD13  ILE  38          HD13      ILE  38  -1.998  -8.362  -2.640
  323    H    SER  39           H        SER  39   2.379  -6.595  -4.848
  324    HA   SER  39           HA       SER  39   3.957  -8.840  -5.605
  325    HB2  SER  39           HB2      SER  39   2.043  -8.154  -7.000
  326    HB3  SER  39           HB3      SER  39   2.851  -6.629  -7.340
  327    HG   SER  39           HG       SER  39   4.362  -8.872  -7.874
  328    H    THR  40           H        THR  40   4.494  -5.578  -4.808
  329    HA   THR  40           HA       THR  40   6.928  -5.264  -6.343
  330    HB   THR  40           HB       THR  40   5.938  -3.537  -4.072
  331    HG1  THR  40           HG1      THR  40   4.446  -3.895  -5.954
  332   HG21  THR  40          HG21      THR  40   7.223  -1.778  -5.227
  333   HG22  THR  40          HG22      THR  40   7.773  -2.970  -6.405
  334   HG23  THR  40          HG23      THR  40   8.250  -3.116  -4.714
  335    H    SER  41           H        SER  41   5.983  -6.078  -3.092
  336    HA   SER  41           HA       SER  41   8.521  -5.834  -1.876
  337    HB2  SER  41           HB2      SER  41   6.272  -5.736  -0.765
  338    HB3  SER  41           HB3      SER  41   6.264  -7.475  -0.912
  339    HG   SER  41           HG       SER  41   7.152  -6.307   1.092
  340    H    THR  42           H        THR  42   7.446  -8.057  -4.073
  341    HA   THR  42           HA       THR  42   8.333 -10.506  -2.937
  342    HB   THR  42           HB       THR  42   7.957 -11.456  -5.166
  343    HG1  THR  42           HG1      THR  42   8.691  -9.689  -6.430
  344   HG21  THR  42          HG21      THR  42   6.038 -11.138  -3.697
  345   HG22  THR  42          HG22      THR  42   5.576 -10.878  -5.379
  346   HG23  THR  42          HG23      THR  42   5.825  -9.497  -4.308
  347    H    SER  43           H        SER  43  10.459  -8.753  -2.687
  348    HA   SER  43           HA       SER  43  12.717  -8.820  -2.784
  349    HB2  SER  43           HB2      SER  43  12.453 -11.290  -2.850
  350    HB3  SER  43           HB3      SER  43  12.407 -11.212  -4.610
  351    HG   SER  43           HG       SER  43  14.521 -11.533  -3.243
  352    H    ASP  44           H        ASP  44  13.091  -6.921  -3.746
  353    HA   ASP  44           HA       ASP  44  13.173  -6.815  -6.656
  354    HB2  ASP  44           HB2      ASP  44  12.152  -4.885  -5.723
  355    HB3  ASP  44           HB3      ASP  44  13.448  -4.652  -4.565
  356    HA   PRO  45           HA       PRO  45  17.802  -6.209  -5.776
  357    HB2  PRO  45           HB2      PRO  45  18.408  -6.380  -2.967
  358    HB3  PRO  45           HB3      PRO  45  18.542  -4.976  -4.005
  359    HG2  PRO  45           HG2      PRO  45  16.807  -5.128  -1.996
  360    HG3  PRO  45           HG3      PRO  45  16.506  -4.168  -3.443
  361    HD2  PRO  45           HD2      PRO  45  15.517  -6.935  -2.787
  362    HD3  PRO  45           HD3      PRO  45  14.608  -5.546  -3.417
  363    H    ASP  46           H        ASP  46  19.645  -7.619  -5.276
  364    HA   ASP  46           HA       ASP  46  18.780 -10.328  -4.517
  365    HB2  ASP  46           HB2      ASP  46  19.597 -10.174  -6.819
  366    HB3  ASP  46           HB3      ASP  46  21.102  -9.456  -6.254
  367    H    TYR  47           H        TYR  47  21.040  -7.763  -3.910
  368    HA   TYR  47           HA       TYR  47  22.328  -9.370  -1.823
  369    HB2  TYR  47           HB2      TYR  47  23.236  -6.883  -3.234
  370    HB3  TYR  47           HB3      TYR  47  24.063  -7.549  -1.835
  371    HD1  TYR  47           HD1      TYR  47  25.173  -9.753  -1.996
  372    HD2  TYR  47           HD2      TYR  47  23.483  -7.856  -5.406
  373    HE1  TYR  47           HE1      TYR  47  26.456 -11.254  -3.459
  374    HE2  TYR  47           HE2      TYR  47  24.762  -9.353  -6.878
  375    HH   TYR  47           HH       TYR  47  26.321 -12.141  -5.759
  376    H    ALA  48           H        ALA  48  19.938  -8.745  -1.041
  377    HA   ALA  48           HA       ALA  48  20.114  -6.271   0.533
  378    HB1  ALA  48           HB1      ALA  48  17.697  -6.487   0.843
  379    HB2  ALA  48           HB2      ALA  48  17.710  -7.994  -0.072
  380    HB3  ALA  48           HB3      ALA  48  18.120  -6.476  -0.869
  381    H1   SER   0           H1       SER   0   8.986  -9.666   0.327
  382    H2   SER   0           H2       SER   0   7.825 -10.895   0.278
  383    H3   SER   0           H3       SER   0   9.010 -10.900   1.483
  384    HA   SER   0           HA       SER   0   6.927  -8.831   1.156
  385    HB2  SER   0           HB2      SER   0   7.121 -11.070   3.185
  386    HB3  SER   0           HB3      SER   0   5.875  -9.824   3.137
  387    HG   SER   0           HG       SER   0   5.322 -10.642   1.024
  388    H    MET   1           H        MET   1  10.024  -9.255   1.928
  389    HA   MET   1           HA       MET   1  10.057  -6.913   3.622
  390    HB2  MET   1           HB2      MET   1   9.823  -8.915   5.182
  391    HB3  MET   1           HB3      MET   1  11.390  -9.449   4.601
  392    HG2  MET   1           HG2      MET   1  11.645  -8.331   6.705
  393    HG3  MET   1           HG3      MET   1  12.392  -7.369   5.432
  394    HE1  MET   1           HE1      MET   1   9.231  -7.830   7.679
  395    HE2  MET   1           HE2      MET   1   8.501  -7.625   6.087
  396    HE3  MET   1           HE3      MET   1   8.298  -6.379   7.316
  397    H    ASP   2           H        ASP   2  10.779  -7.314   1.022
  398    HA   ASP   2           HA       ASP   2  13.706  -7.627   1.039
  399    HB2  ASP   2           HB2      ASP   2  11.873  -8.760  -1.080
  400    HB3  ASP   2           HB3      ASP   2  13.603  -9.032  -0.907
  401    H    GLU   3           H        GLU   3  12.745  -5.171   1.117
  402    HA   GLU   3           HA       GLU   3  12.458  -4.236  -1.635
  403    HB2  GLU   3           HB2      GLU   3  11.984  -2.166   0.226
  404    HB3  GLU   3           HB3      GLU   3  10.889  -2.895  -0.942
  405    HG2  GLU   3           HG2      GLU   3   9.852  -3.232   1.043
  406    HG3  GLU   3           HG3      GLU   3  10.637  -4.768   0.771
  407    H    THR   4           H        THR   4  13.632  -2.689   1.321
  408    HA   THR   4           HA       THR   4  15.386  -1.334   1.771
  409    HB   THR   4           HB       THR   4  17.643  -2.144   1.049
  410    HG1  THR   4           HG1      THR   4  16.250  -3.395  -0.821
  411   HG21  THR   4          HG21      THR   4  17.549  -4.221   2.342
  412   HG22  THR   4          HG22      THR   4  15.791  -4.226   2.205
  413   HG23  THR   4          HG23      THR   4  16.601  -2.944   3.106
  414    H    VAL   5           H        VAL   5  14.866   0.608   0.844
  415    HA   VAL   5           HA       VAL   5  15.587   0.991  -1.968
  416    HB   VAL   5           HB       VAL   5  13.261   1.510  -1.254
  417   HG11  VAL   5          HG11      VAL   5  13.697   2.418   0.935
  418   HG12  VAL   5          HG12      VAL   5  12.835   3.599  -0.052
  419   HG13  VAL   5          HG13      VAL   5  14.568   3.775   0.225
  420   HG21  VAL   5          HG21      VAL   5  14.166   2.462  -3.288
  421   HG22  VAL   5          HG22      VAL   5  14.859   3.805  -2.378
  422   HG23  VAL   5          HG23      VAL   5  13.109   3.627  -2.491
  423    H    LYS   6           H        LYS   6  17.548   0.914   0.146
  424    HA   LYS   6           HA       LYS   6  19.603   1.838   0.405
  425    HB2  LYS   6           HB2      LYS   6  18.602   3.962  -1.451
  426    HB3  LYS   6           HB3      LYS   6  20.253   3.843  -0.891
  427    HG2  LYS   6           HG2      LYS   6  20.599   1.852  -2.074
  428    HG3  LYS   6           HG3      LYS   6  18.879   1.628  -2.371
  429    HD2  LYS   6           HD2      LYS   6  20.016   2.403  -4.380
  430    HD3  LYS   6           HD3      LYS   6  18.875   3.612  -3.806
  431    HE2  LYS   6           HE2      LYS   6  20.738   4.809  -2.750
  432    HE3  LYS   6           HE3      LYS   6  21.860   3.615  -3.391
  433    HZ1  LYS   6           HZ1      LYS   6  21.826   5.549  -4.794
  434    HZ2  LYS   6           HZ2      LYS   6  20.149   5.453  -4.973
  435    HZ3  LYS   6           HZ3      LYS   6  21.138   4.253  -5.635
  436    H    LEU   7           H        LEU   7  17.656   4.793   0.136
  437    HA   LEU   7           HA       LEU   7  18.401   5.388   2.917
  438    HB2  LEU   7           HB2      LEU   7  18.556   7.736   2.375
  439    HB3  LEU   7           HB3      LEU   7  19.640   6.821   1.360
  440    HG   LEU   7           HG       LEU   7  16.933   7.625   0.344
  441   HD11  LEU   7          HD11      LEU   7  19.439   9.307   0.299
  442   HD12  LEU   7          HD12      LEU   7  17.963   9.667   1.193
  443   HD13  LEU   7          HD13      LEU   7  17.946   9.658  -0.570
  444   HD21  LEU   7          HD21      LEU   7  19.598   7.068  -0.939
  445   HD22  LEU   7          HD22      LEU   7  18.148   7.576  -1.803
  446   HD23  LEU   7          HD23      LEU   7  18.179   6.026  -0.966
  447    H    ASN   8           H        ASN   8  16.916   7.400   3.625
  448    HA   ASN   8           HA       ASN   8  14.386   6.179   3.928
  449    HB2  ASN   8           HB2      ASN   8  13.818   8.542   4.913
  450    HB3  ASN   8           HB3      ASN   8  14.827   7.427   5.804
  451   HD21  ASN   8          HD21      ASN   8  15.841   9.042   6.933
  452   HD22  ASN   8          HD22      ASN   8  16.935  10.159   6.207
  453    H    HIS   9           H        HIS   9  12.548   6.424   2.992
  454    HA   HIS   9           HA       HIS   9  11.965   8.909   1.543
  455    HB2  HIS   9           HB2      HIS   9  11.248   6.084   0.755
  456    HB3  HIS   9           HB3      HIS   9  10.354   7.473   0.157
  457    HD1  HIS   9           HD1      HIS   9  11.195   8.472  -1.936
  458    HD2  HIS   9           HD2      HIS   9  14.128   6.252   0.009
  459    HE1  HIS   9           HE1      HIS   9  13.170   8.448  -3.488
  460    HE2  HIS   9           HE2      HIS   9  14.980   7.235  -2.228
  461    H    THR  10           H        THR  10   9.804   9.625   1.863
  462    HA   THR  10           HA       THR  10   8.947   8.946   4.532
  463    HB   THR  10           HB       THR  10   7.635  10.911   2.633
  464    HG1  THR  10           HG1      THR  10   9.249  12.173   4.311
  465   HG21  THR  10          HG21      THR  10   7.845  10.903   5.642
  466   HG22  THR  10          HG22      THR  10   6.438  10.347   4.735
  467   HG23  THR  10          HG23      THR  10   6.931  12.039   4.650
  468    H    CYS  11           H        CYS  11   7.172   7.807   5.144
  469    HA   CYS  11           HA       CYS  11   5.917   6.161   3.180
  470    HB2  CYS  11           HB2      CYS  11   6.217   5.391   5.491
  471    HB3  CYS  11           HB3      CYS  11   5.124   6.643   6.047
  472    H    VAL  12           H        VAL  12   4.421   6.714   1.824
  473    HA   VAL  12           HA       VAL  12   2.725   8.807   1.698
  474    HB   VAL  12           HB       VAL  12   3.224   6.597   0.284
  475   HG11  VAL  12          HG11      VAL  12   0.561   6.050   1.507
  476   HG12  VAL  12          HG12      VAL  12   1.988   5.015   1.469
  477   HG13  VAL  12          HG13      VAL  12   1.101   5.347  -0.015
  478   HG21  VAL  12          HG21      VAL  12   2.488   8.513  -0.702
  479   HG22  VAL  12          HG22      VAL  12   0.906   8.406   0.068
  480   HG23  VAL  12          HG23      VAL  12   1.364   7.240  -1.174
  481    H    ILE  13           H        ILE  13   2.666   6.254   3.937
  482    HA   ILE  13           HA       ILE  13  -0.152   6.617   4.613
  483    HB   ILE  13           HB       ILE  13   1.703   4.521   5.682
  484   HG12  ILE  13          HG12      ILE  13   1.573   4.459   3.167
  485   HG13  ILE  13          HG13      ILE  13   1.051   3.001   3.992
  486   HG21  ILE  13          HG21      ILE  13  -0.343   4.883   6.905
  487   HG22  ILE  13          HG22      ILE  13  -0.324   3.304   6.114
  488   HG23  ILE  13          HG23      ILE  13  -1.274   4.627   5.427
  489   HD11  ILE  13          HD11      ILE  13  -1.206   3.529   3.631
  490   HD12  ILE  13          HD12      ILE  13  -0.348   3.703   2.098
  491   HD13  ILE  13          HD13      ILE  13  -0.797   5.132   3.031
  492    H    CYS  14           H        CYS  14   2.965   6.158   6.232
  493    HA   CYS  14           HA       CYS  14   1.922   6.978   8.764
  494    HB2  CYS  14           HB2      CYS  14   4.698   6.324   7.903
  495    HB3  CYS  14           HB3      CYS  14   4.220   6.593   9.555
  496    H    ASP  15           H        ASP  15   3.731   8.433   6.202
  497    HA   ASP  15           HA       ASP  15   4.641  10.458   5.833
  498    HB2  ASP  15           HB2      ASP  15   3.002  11.112   8.202
  499    HB3  ASP  15           HB3      ASP  15   4.132  12.300   7.580
  500    H    GLN  16           H        GLN  16   6.166   8.494   7.061
  501    HA   GLN  16           HA       GLN  16   8.052  10.120   8.594
  502    HB2  GLN  16           HB2      GLN  16   7.055   7.387   9.127
  503    HB3  GLN  16           HB3      GLN  16   8.757   7.692   9.419
  504    HG2  GLN  16           HG2      GLN  16   7.751   8.054  11.433
  505    HG3  GLN  16           HG3      GLN  16   7.981   9.663  10.793
  506   HE21  GLN  16          HE21      GLN  16   6.395  10.579  12.022
  507   HE22  GLN  16          HE22      GLN  16   4.723  10.239  11.786
  508    H    GLU  17           H        GLU  17  10.248   9.561   8.334
  509    HA   GLU  17           HA       GLU  17  10.919   8.873   5.614
  510    HB2  GLU  17           HB2      GLU  17  12.593   9.870   7.912
  511    HB3  GLU  17           HB3      GLU  17  13.205   9.576   6.295
  512    HG2  GLU  17           HG2      GLU  17  11.786  11.241   5.367
  513    HG3  GLU  17           HG3      GLU  17  10.953  11.441   6.903
  514    H    LYS  18           H        LYS  18  10.895   6.875   5.222
  515    HA   LYS  18           HA       LYS  18  12.198   4.946   7.024
  516    HB2  LYS  18           HB2      LYS  18  10.189   4.024   5.094
  517    HB3  LYS  18           HB3      LYS  18  10.548   3.425   6.683
  518    HG2  LYS  18           HG2      LYS  18   8.993   5.902   6.058
  519    HG3  LYS  18           HG3      LYS  18   8.323   4.363   6.593
  520    HD2  LYS  18           HD2      LYS  18  10.362   5.777   8.241
  521    HD3  LYS  18           HD3      LYS  18   8.691   6.271   8.284
  522    HE2  LYS  18           HE2      LYS  18   9.196   4.770  10.098
  523    HE3  LYS  18           HE3      LYS  18   8.065   4.066   8.970
  524    HZ1  LYS  18           HZ1      LYS  18  10.961   3.472   8.978
  525    HZ2  LYS  18           HZ2      LYS  18   9.773   2.682   8.071
  526    HZ3  LYS  18           HZ3      LYS  18   9.805   2.515   9.750
  527    H    ASN  19           H        ASN  19  13.815   3.727   6.175
  528    HA   ASN  19           HA       ASN  19  14.405   4.123   3.353
  529    HB2  ASN  19           HB2      ASN  19  16.583   3.446   3.766
  530    HB3  ASN  19           HB3      ASN  19  16.139   4.240   5.266
  531   HD21  ASN  19          HD21      ASN  19  14.599   2.125   6.396
  532   HD22  ASN  19          HD22      ASN  19  15.714   0.830   6.790
  533    H    ARG  20           H        ARG  20  12.564   2.014   5.053
  534    HA   ARG  20           HA       ARG  20  12.963  -0.094   3.044
  535    HB2  ARG  20           HB2      ARG  20  12.611  -0.301   5.976
  536    HB3  ARG  20           HB3      ARG  20  11.832  -1.519   5.000
  537    HG2  ARG  20           HG2      ARG  20  14.074  -1.883   3.922
  538    HG3  ARG  20           HG3      ARG  20  14.732  -0.939   5.252
  539    HD2  ARG  20           HD2      ARG  20  13.789  -2.407   6.797
  540    HD3  ARG  20           HD3      ARG  20  12.889  -3.264   5.590
  541    HE   ARG  20           HE       ARG  20  15.796  -3.442   6.003
  542   HH11  ARG  20          HH11      ARG  20  12.845  -4.619   4.486
  543   HH12  ARG  20          HH12      ARG  20  13.539  -6.152   4.053
  544   HH21  ARG  20          HH21      ARG  20  16.697  -5.465   5.409
  545   HH22  ARG  20          HH22      ARG  20  15.724  -6.624   4.561
  546    H    GLY  21           H        GLY  21  11.208  -0.905   2.059
  547    HA2  GLY  21           HA2      GLY  21   8.621  -1.000   2.311
  548    HA3  GLY  21           HA3      GLY  21   8.795   0.751   2.286
  549    H    ILE  22           H        ILE  22   7.314   0.213   0.270
  550    HA   ILE  22           HA       ILE  22   9.089  -0.396  -1.991
  551    HB   ILE  22           HB       ILE  22   7.433  -1.567  -3.068
  552   HG12  ILE  22          HG12      ILE  22   5.410  -0.204  -1.320
  553   HG13  ILE  22          HG13      ILE  22   5.825   0.291  -2.930
  554   HG21  ILE  22          HG21      ILE  22   8.041  -2.810  -1.071
  555   HG22  ILE  22          HG22      ILE  22   6.343  -3.084  -1.461
  556   HG23  ILE  22          HG23      ILE  22   6.782  -1.986  -0.146
  557   HD11  ILE  22          HD11      ILE  22   5.041  -1.880  -3.764
  558   HD12  ILE  22          HD12      ILE  22   3.782  -0.920  -2.996
  559   HD13  ILE  22          HD13      ILE  22   4.516  -2.273  -2.127
  560    H    HIS  23           H        HIS  23   7.613   0.318  -4.033
  561    HA   HIS  23           HA       HIS  23   6.941   3.128  -3.739
  562    HB2  HIS  23           HB2      HIS  23   9.264   2.136  -5.394
  563    HB3  HIS  23           HB3      HIS  23   8.528   3.706  -5.626
  564    HD1  HIS  23           HD1      HIS  23   9.096   5.547  -3.957
  565    HD2  HIS  23           HD2      HIS  23  10.710   1.852  -3.043
  566    HE1  HIS  23           HE1      HIS  23  10.715   5.973  -2.083
  567    HE2  HIS  23           HE2      HIS  23  11.549   3.688  -1.432
  568    H    LEU  24           H        LEU  24   4.974   3.075  -4.635
  569    HA   LEU  24           HA       LEU  24   4.647   1.869  -7.271
  570    HB2  LEU  24           HB2      LEU  24   2.766   2.820  -5.150
  571    HB3  LEU  24           HB3      LEU  24   2.259   2.861  -6.782
  572    HG   LEU  24           HG       LEU  24   1.871   0.623  -6.858
  573   HD11  LEU  24          HD11      LEU  24   3.009  -1.088  -5.681
  574   HD12  LEU  24          HD12      LEU  24   3.995   0.113  -4.834
  575   HD13  LEU  24          HD13      LEU  24   4.152  -0.088  -6.582
  576   HD21  LEU  24          HD21      LEU  24   0.642   1.605  -4.963
  577   HD22  LEU  24          HD22      LEU  24   1.884   0.955  -3.894
  578   HD23  LEU  24          HD23      LEU  24   0.890  -0.137  -4.859
  579    H    TYR  25           H        TYR  25   4.870   3.216  -8.968
  580    HA   TYR  25           HA       TYR  25   4.746   5.077 -10.273
  581    HB2  TYR  25           HB2      TYR  25   3.116   6.390  -8.137
  582    HB3  TYR  25           HB3      TYR  25   3.132   6.783  -9.837
  583    HD1  TYR  25           HD1      TYR  25   0.715   6.637 -10.114
  584    HD2  TYR  25           HD2      TYR  25   2.899   3.341  -8.569
  585    HE1  TYR  25           HE1      TYR  25  -1.278   5.199 -10.353
  586    HE2  TYR  25           HE2      TYR  25   0.961   1.903  -8.769
  587    HH   TYR  25           HH       TYR  25  -1.903   2.945 -10.505
  588    H    THR  26           H        THR  26   4.334   7.428  -7.898
  589    HA   THR  26           HA       THR  26   7.223   7.930  -7.820
  590    HB   THR  26           HB       THR  26   6.409   9.771  -8.888
  591    HG1  THR  26           HG1      THR  26   6.972  10.189  -6.341
  592   HG21  THR  26          HG21      THR  26   3.949   9.787  -7.160
  593   HG22  THR  26          HG22      THR  26   4.062   9.032  -8.752
  594   HG23  THR  26          HG23      THR  26   4.258  10.780  -8.585
  595    H    LYS  27           H        LYS  27   4.864   6.657  -5.886
  596    HA   LYS  27           HA       LYS  27   5.588   8.213  -3.509
  597    HB2  LYS  27           HB2      LYS  27   3.700   6.166  -2.875
  598    HB3  LYS  27           HB3      LYS  27   3.519   7.903  -2.798
  599    HG2  LYS  27           HG2      LYS  27   2.948   6.150  -5.174
  600    HG3  LYS  27           HG3      LYS  27   1.782   6.931  -4.113
  601    HD2  LYS  27           HD2      LYS  27   3.787   8.366  -5.827
  602    HD3  LYS  27           HD3      LYS  27   2.099   8.123  -6.246
  603    HE2  LYS  27           HE2      LYS  27   2.367   9.266  -3.613
  604    HE3  LYS  27           HE3      LYS  27   3.230  10.239  -4.798
  605    HZ1  LYS  27           HZ1      LYS  27   0.349   9.510  -4.834
  606    HZ2  LYS  27           HZ2      LYS  27   1.140  10.257  -6.129
  607    HZ3  LYS  27           HZ3      LYS  27   1.016  11.052  -4.643
  608    H    PHE  28           H        PHE  28   5.256   6.773  -1.468
  609    HA   PHE  28           HA       PHE  28   6.804   4.307  -1.633
  610    HB2  PHE  28           HB2      PHE  28   8.505   5.936  -1.173
  611    HB3  PHE  28           HB3      PHE  28   7.505   6.729   0.032
  612    HD1  PHE  28           HD1      PHE  28   7.443   6.005   2.270
  613    HD2  PHE  28           HD2      PHE  28   9.457   3.661  -0.658
  614    HE1  PHE  28           HE1      PHE  28   8.377   4.601   4.045
  615    HE2  PHE  28           HE2      PHE  28  10.407   2.258   1.123
  616    HZ   PHE  28           HZ       PHE  28   9.852   2.710   3.492
  617    H    ILE  29           H        ILE  29   5.388   2.918  -0.784
  618    HA   ILE  29           HA       ILE  29   3.965   3.617   1.675
  619    HB   ILE  29           HB       ILE  29   4.050   1.017   0.114
  620   HG12  ILE  29          HG12      ILE  29   1.503   1.688  -0.074
  621   HG13  ILE  29          HG13      ILE  29   2.139   3.308   0.183
  622   HG21  ILE  29          HG21      ILE  29   2.310   0.194   1.597
  623   HG22  ILE  29          HG22      ILE  29   2.350   1.700   2.511
  624   HG23  ILE  29          HG23      ILE  29   3.753   0.626   2.519
  625   HD11  ILE  29          HD11      ILE  29   1.852   2.689  -2.196
  626   HD12  ILE  29          HD12      ILE  29   3.094   1.455  -1.978
  627   HD13  ILE  29          HD13      ILE  29   3.497   3.160  -1.770
  628    H    CYS  30           H        CYS  30   5.041   3.280   3.602
  629    HA   CYS  30           HA       CYS  30   7.574   2.025   3.661
  630    HB2  CYS  30           HB2      CYS  30   7.674   2.482   5.916
  631    HB3  CYS  30           HB3      CYS  30   6.491   3.660   5.386
  632    H    LEU  31           H        LEU  31   8.175   0.170   4.822
  633    HA   LEU  31           HA       LEU  31   7.159  -2.095   3.707
  634    HB2  LEU  31           HB2      LEU  31   8.812  -3.182   4.857
  635    HB3  LEU  31           HB3      LEU  31   9.427  -1.565   4.765
  636    HG   LEU  31           HG       LEU  31   8.209  -1.434   7.163
  637   HD11  LEU  31          HD11      LEU  31   8.665  -3.477   8.423
  638   HD12  LEU  31          HD12      LEU  31   9.147  -4.289   6.935
  639   HD13  LEU  31          HD13      LEU  31   7.480  -3.753   7.146
  640   HD21  LEU  31          HD21      LEU  31  10.504  -0.805   6.706
  641   HD22  LEU  31          HD22      LEU  31  10.974  -2.505   6.646
  642   HD23  LEU  31          HD23      LEU  31  10.411  -1.797   8.161
  643    H    ASP  32           H        ASP  32   6.131  -0.530   6.549
  644    HA   ASP  32           HA       ASP  32   5.119  -2.885   7.862
  645    HB2  ASP  32           HB2      ASP  32   5.965  -0.570   8.860
  646    HB3  ASP  32           HB3      ASP  32   4.275  -0.161   8.640
  647    H    CYS  33           H        CYS  33   4.032  -0.207   6.020
  648    HA   CYS  33           HA       CYS  33   1.229  -0.719   6.229
  649    HB2  CYS  33           HB2      CYS  33   2.834   1.194   4.547
  650    HB3  CYS  33           HB3      CYS  33   1.099   1.049   4.463
  651    H    GLU  34           H        GLU  34   3.840  -1.391   4.027
  652    HA   GLU  34           HA       GLU  34   2.367  -2.275   1.850
  653    HB2  GLU  34           HB2      GLU  34   4.821  -1.872   1.880
  654    HB3  GLU  34           HB3      GLU  34   5.026  -3.341   2.789
  655    HG2  GLU  34           HG2      GLU  34   3.678  -3.405   0.164
  656    HG3  GLU  34           HG3      GLU  34   5.423  -3.353   0.259
  657    H    ARG  35           H        ARG  35   3.441  -3.999   4.729
  658    HA   ARG  35           HA       ARG  35   2.018  -6.343   3.922
  659    HB2  ARG  35           HB2      ARG  35   2.641  -7.359   5.988
  660    HB3  ARG  35           HB3      ARG  35   4.024  -6.434   5.428
  661    HG2  ARG  35           HG2      ARG  35   3.166  -4.587   6.981
  662    HG3  ARG  35           HG3      ARG  35   2.174  -5.846   7.693
  663    HD2  ARG  35           HD2      ARG  35   5.142  -5.771   7.514
  664    HD3  ARG  35           HD3      ARG  35   4.168  -5.665   8.967
  665    HE   ARG  35           HE       ARG  35   3.588  -8.089   7.695
  666   HH11  ARG  35          HH11      ARG  35   6.227  -6.521   9.368
  667   HH12  ARG  35          HH12      ARG  35   6.951  -8.004   9.901
  668   HH21  ARG  35          HH21      ARG  35   4.545 -10.062   8.385
  669   HH22  ARG  35          HH22      ARG  35   5.992 -10.021   9.341
  670    H    LYS  36           H        LYS  36   1.124  -3.506   5.595
  671    HA   LYS  36           HA       LYS  36  -0.970  -4.546   7.183
  672    HB2  LYS  36           HB2      LYS  36  -0.564  -1.801   6.094
  673    HB3  LYS  36           HB3      LYS  36  -1.811  -2.212   7.241
  674    HG2  LYS  36           HG2      LYS  36   0.100  -2.942   8.739
  675    HG3  LYS  36           HG3      LYS  36   1.148  -2.160   7.628
  676    HD2  LYS  36           HD2      LYS  36   0.308  -0.148   8.147
  677    HD3  LYS  36           HD3      LYS  36  -1.173  -0.756   8.839
  678    HE2  LYS  36           HE2      LYS  36   0.119  -1.670  10.705
  679    HE3  LYS  36           HE3      LYS  36   1.603  -1.040   9.993
  680    HZ1  LYS  36           HZ1      LYS  36   0.732   1.197  10.250
  681    HZ2  LYS  36           HZ2      LYS  36   0.778   0.396  11.741
  682    HZ3  LYS  36           HZ3      LYS  36  -0.691   0.587  10.932
  683    H    VAL  37           H        VAL  37  -0.656  -3.213   4.040
  684    HA   VAL  37           HA       VAL  37  -3.293  -2.861   3.361
  685    HB   VAL  37           HB       VAL  37  -2.522  -2.940   1.024
  686   HG11  VAL  37          HG11      VAL  37  -0.355  -1.443   2.366
  687   HG12  VAL  37          HG12      VAL  37  -1.999  -1.036   2.856
  688   HG13  VAL  37          HG13      VAL  37  -1.522  -0.892   1.159
  689   HG21  VAL  37          HG21      VAL  37   0.039  -3.135   0.811
  690   HG22  VAL  37          HG22      VAL  37  -0.953  -4.592   0.859
  691   HG23  VAL  37          HG23      VAL  37  -0.087  -4.068   2.308
  692    H    ILE  38           H        ILE  38  -1.214  -5.601   2.807
  693    HA   ILE  38           HA       ILE  38  -2.891  -7.235   1.304
  694    HB   ILE  38           HB       ILE  38  -0.987  -8.404   3.304
  695   HG12  ILE  38          HG12      ILE  38  -0.215  -6.795   0.877
  696   HG13  ILE  38          HG13      ILE  38   0.320  -6.581   2.531
  697   HG21  ILE  38          HG21      ILE  38  -2.117  -9.987   1.961
  698   HG22  ILE  38          HG22      ILE  38  -0.468  -9.882   1.343
  699   HG23  ILE  38          HG23      ILE  38  -1.783  -9.078   0.492
  700   HD11  ILE  38          HD11      ILE  38   1.938  -7.623   0.847
  701   HD12  ILE  38          HD12      ILE  38   0.961  -9.082   1.032
  702   HD13  ILE  38          HD13      ILE  38   1.770  -8.381   2.432
  703    H    SER  39           H        SER  39  -2.591  -6.523   4.649
  704    HA   SER  39           HA       SER  39  -4.195  -8.749   5.396
  705    HB2  SER  39           HB2      SER  39  -2.266  -8.090   6.787
  706    HB3  SER  39           HB3      SER  39  -3.051  -6.550   7.122
  707    HG   SER  39           HG       SER  39  -4.595  -8.768   7.668
  708    H    THR  40           H        THR  40  -4.676  -5.482   4.589
  709    HA   THR  40           HA       THR  40  -7.101  -5.118   6.122
  710    HB   THR  40           HB       THR  40  -6.078  -3.417   3.847
  711    HG1  THR  40           HG1      THR  40  -4.602  -3.797   5.742
  712   HG21  THR  40          HG21      THR  40  -7.330  -1.629   4.989
  713   HG22  THR  40          HG22      THR  40  -7.906  -2.803   6.173
  714   HG23  THR  40          HG23      THR  40  -8.384  -2.949   4.482
  715    H    SER  41           H        SER  41  -6.174  -5.956   2.873
  716    HA   SER  41           HA       SER  41  -8.706  -5.673   1.656
  717    HB2  SER  41           HB2      SER  41  -6.454  -5.622   0.545
  718    HB3  SER  41           HB3      SER  41  -6.477  -7.361   0.700
  719    HG   SER  41           HG       SER  41  -7.349  -6.173  -1.308
  720    H    THR  42           H        THR  42  -7.670  -7.906   3.861
  721    HA   THR  42           HA       THR  42  -8.599 -10.340   2.735
  722    HB   THR  42           HB       THR  42  -8.240 -11.286   4.970
  723    HG1  THR  42           HG1      THR  42  -8.933  -9.515   6.231
  724   HG21  THR  42          HG21      THR  42  -6.317 -11.016   3.497
  725   HG22  THR  42          HG22      THR  42  -5.850 -10.756   5.177
  726   HG23  THR  42          HG23      THR  42  -6.070  -9.375   4.100
  727    H    SER  43           H        SER  43 -10.695  -8.554   2.478
  728    HA   SER  43           HA       SER  43 -12.952  -8.581   2.576
  729    HB2  SER  43           HB2      SER  43 -12.733 -11.055   2.651
  730    HB3  SER  43           HB3      SER  43 -12.689 -10.971   4.411
  731    HG   SER  43           HG       SER  43 -14.808 -11.251   3.032
  732    H    ASP  44           H        ASP  44 -13.296  -6.671   3.528
  733    HA   ASP  44           HA       ASP  44 -13.371  -6.554   6.437
  734    HB2  ASP  44           HB2      ASP  44 -12.315  -4.650   5.493
  735    HB3  ASP  44           HB3      ASP  44 -13.613  -4.394   4.342
  736    HA   PRO  45           HA       PRO  45 -17.991  -5.870   5.561
  737    HB2  PRO  45           HB2      PRO  45 -18.600  -6.036   2.753
  738    HB3  PRO  45           HB3      PRO  45 -18.709  -4.626   3.787
  739    HG2  PRO  45           HG2      PRO  45 -16.980  -4.817   1.777
  740    HG3  PRO  45           HG3      PRO  45 -16.660  -3.858   3.220
  741    HD2  PRO  45           HD2      PRO  45 -15.721  -6.645   2.571
  742    HD3  PRO  45           HD3      PRO  45 -14.787  -5.271   3.195
  743    H    ASP  46           H        ASP  46 -19.860  -7.249   5.065
  744    HA   ASP  46           HA       ASP  46 -19.040  -9.973   4.314
  745    HB2  ASP  46           HB2      ASP  46 -19.854  -9.799   6.614
  746    HB3  ASP  46           HB3      ASP  46 -21.347  -9.055   6.046
  747    H    TYR  47           H        TYR  47 -21.254  -7.374   3.698
  748    HA   TYR  47           HA       TYR  47 -22.572  -8.963   1.616
  749    HB2  TYR  47           HB2      TYR  47 -23.435  -6.457   3.022
  750    HB3  TYR  47           HB3      TYR  47 -24.276  -7.113   1.626
  751    HD1  TYR  47           HD1      TYR  47 -25.423  -9.295   1.795
  752    HD2  TYR  47           HD2      TYR  47 -23.699  -7.417   5.198
  753    HE1  TYR  47           HE1      TYR  47 -26.732 -10.766   3.262
  754    HE2  TYR  47           HE2      TYR  47 -25.004  -8.886   6.677
  755    HH   TYR  47           HH       TYR  47 -26.610 -11.652   5.567
  756    H    ALA  48           H        ALA  48 -20.173  -8.381   0.833
  757    HA   ALA  48           HA       ALA  48 -20.304  -5.906  -0.742
  758    HB1  ALA  48           HB1      ALA  48 -17.892  -6.169  -1.056
  759    HB2  ALA  48           HB2      ALA  48 -17.933  -7.673  -0.136
  760    HB3  ALA  48           HB3      ALA  48 -18.313  -6.145   0.655
  Start of MODEL    2
    1    H1   SER   0           H1       SER   0  -5.360  18.249  11.976
    2    H2   SER   0           H2       SER   0  -6.771  17.559  11.354
    3    H3   SER   0           H3       SER   0  -6.773  19.167  11.875
    4    HA   SER   0           HA       SER   0  -6.726  19.053   9.487
    5    HB2  SER   0           HB2      SER   0  -4.569  20.380   9.183
    6    HB3  SER   0           HB3      SER   0  -5.680  20.983  10.411
    7    HG   SER   0           HG       SER   0  -3.418  20.845  11.054
    8    H    MET   1           H        MET   1  -3.628  17.854  10.781
    9    HA   MET   1           HA       MET   1  -2.959  16.605   8.280
   10    HB2  MET   1           HB2      MET   1  -1.243  17.617   9.735
   11    HB3  MET   1           HB3      MET   1  -1.606  16.432  10.980
   12    HG2  MET   1           HG2      MET   1   0.412  15.856   9.747
   13    HG3  MET   1           HG3      MET   1  -0.849  14.641   9.532
   14    HE1  MET   1           HE1      MET   1   0.504  13.646   7.470
   15    HE2  MET   1           HE2      MET   1   1.749  14.876   7.681
   16    HE3  MET   1           HE3      MET   1   1.034  14.610   6.092
   17    H    ASP   2           H        ASP   2  -3.010  14.489   7.761
   18    HA   ASP   2           HA       ASP   2  -3.558  12.297   7.772
   19    HB2  ASP   2           HB2      ASP   2  -1.918  12.307   9.701
   20    HB3  ASP   2           HB3      ASP   2  -3.302  12.393  10.782
   21    H    GLU   3           H        GLU   3  -5.628  13.864   7.446
   22    HA   GLU   3           HA       GLU   3  -7.823  12.243   7.995
   23    HB2  GLU   3           HB2      GLU   3  -7.535  13.143  10.324
   24    HB3  GLU   3           HB3      GLU   3  -7.825  14.755   9.687
   25    HG2  GLU   3           HG2      GLU   3 -10.045  13.953   8.884
   26    HG3  GLU   3           HG3      GLU   3  -9.745  12.444   9.742
   27    H    THR   4           H        THR   4  -8.281  12.647   5.820
   28    HA   THR   4           HA       THR   4  -9.528  15.201   5.267
   29    HB   THR   4           HB       THR   4  -7.182  14.347   3.563
   30    HG1  THR   4           HG1      THR   4  -7.381  15.937   5.811
   31   HG21  THR   4          HG21      THR   4  -8.974  16.775   3.489
   32   HG22  THR   4          HG22      THR   4  -8.898  15.491   2.282
   33   HG23  THR   4          HG23      THR   4  -7.518  16.567   2.514
   34    H    VAL   5           H        VAL   5  -8.205  12.464   3.367
   35    HA   VAL   5           HA       VAL   5 -10.169  12.684   1.386
   36    HB   VAL   5           HB       VAL   5  -9.397  10.419   0.624
   37   HG11  VAL   5          HG11      VAL   5  -7.182  11.220  -0.053
   38   HG12  VAL   5          HG12      VAL   5  -7.282  12.508   1.147
   39   HG13  VAL   5          HG13      VAL   5  -8.404  12.482  -0.215
   40   HG21  VAL   5          HG21      VAL   5  -7.418   9.477   1.687
   41   HG22  VAL   5          HG22      VAL   5  -8.774   9.531   2.814
   42   HG23  VAL   5          HG23      VAL   5  -7.484  10.724   2.931
   43    H    LYS   6           H        LYS   6 -12.191  12.108   1.293
   44    HA   LYS   6           HA       LYS   6 -13.133   9.777   2.795
   45    HB2  LYS   6           HB2      LYS   6 -14.355  12.497   2.834
   46    HB3  LYS   6           HB3      LYS   6 -15.245  11.056   3.291
   47    HG2  LYS   6           HG2      LYS   6 -13.326  10.636   4.903
   48    HG3  LYS   6           HG3      LYS   6 -12.880  12.313   4.612
   49    HD2  LYS   6           HD2      LYS   6 -15.028  13.065   5.386
   50    HD3  LYS   6           HD3      LYS   6 -15.591  11.398   5.547
   51    HE2  LYS   6           HE2      LYS   6 -14.987  12.177   7.705
   52    HE3  LYS   6           HE3      LYS   6 -13.773  11.016   7.197
   53    HZ1  LYS   6           HZ1      LYS   6 -12.290  12.799   6.650
   54    HZ2  LYS   6           HZ2      LYS   6 -12.820  13.010   8.241
   55    HZ3  LYS   6           HZ3      LYS   6 -13.464  13.964   7.002
   56    H    LEU   7           H        LEU   7 -15.605   9.468   2.083
   57    HA   LEU   7           HA       LEU   7 -16.871   8.562   0.446
   58    HB2  LEU   7           HB2      LEU   7 -16.046  11.090  -0.898
   59    HB3  LEU   7           HB3      LEU   7 -17.157   9.967  -1.642
   60    HG   LEU   7           HG       LEU   7 -18.558  10.264   0.507
   61   HD11  LEU   7          HD11      LEU   7 -16.848  11.421   1.813
   62   HD12  LEU   7          HD12      LEU   7 -18.295  12.409   1.617
   63   HD13  LEU   7          HD13      LEU   7 -16.860  12.747   0.652
   64   HD21  LEU   7          HD21      LEU   7 -19.268  11.055  -1.655
   65   HD22  LEU   7          HD22      LEU   7 -18.235  12.476  -1.511
   66   HD23  LEU   7          HD23      LEU   7 -19.617  12.279  -0.436
   67    H    ASN   8           H        ASN   8 -15.221   9.884  -2.239
   68    HA   ASN   8           HA       ASN   8 -14.080   7.296  -2.909
   69    HB2  ASN   8           HB2      ASN   8 -13.774   9.920  -4.385
   70    HB3  ASN   8           HB3      ASN   8 -13.435   8.339  -5.010
   71   HD21  ASN   8          HD21      ASN   8 -15.780  10.686  -4.490
   72   HD22  ASN   8          HD22      ASN   8 -17.074   9.817  -5.211
   73    H    HIS   9           H        HIS   9 -12.471   6.969  -1.442
   74    HA   HIS   9           HA       HIS   9 -10.672   8.995  -0.596
   75    HB2  HIS   9           HB2      HIS   9 -10.507   5.981  -0.431
   76    HB3  HIS   9           HB3      HIS   9  -9.349   7.068   0.322
   77    HD1  HIS   9           HD1      HIS   9  -9.849   7.670   2.679
   78    HD2  HIS   9           HD2      HIS   9 -13.245   6.421   0.634
   79    HE1  HIS   9           HE1      HIS   9 -11.679   7.580   4.400
   80    HE2  HIS   9           HE2      HIS   9 -13.726   6.818   3.141
   81    H    THR  10           H        THR  10  -9.213   9.902  -1.870
   82    HA   THR  10           HA       THR  10  -8.519   9.074  -4.407
   83    HB   THR  10           HB       THR  10  -6.682  10.668  -2.631
   84    HG1  THR  10           HG1      THR  10  -7.995  12.481  -3.439
   85   HG21  THR  10          HG21      THR  10  -7.336  10.795  -5.574
   86   HG22  THR  10          HG22      THR  10  -5.912  10.019  -4.886
   87   HG23  THR  10          HG23      THR  10  -6.122  11.769  -4.732
   88    H    CYS  11           H        CYS  11  -6.875   7.824  -5.318
   89    HA   CYS  11           HA       CYS  11  -5.641   5.937  -3.561
   90    HB2  CYS  11           HB2      CYS  11  -6.042   5.314  -5.888
   91    HB3  CYS  11           HB3      CYS  11  -4.938   6.564  -6.405
   92    H    VAL  12           H        VAL  12  -4.221   6.471  -2.167
   93    HA   VAL  12           HA       VAL  12  -2.461   8.496  -1.993
   94    HB   VAL  12           HB       VAL  12  -3.149   6.335  -0.614
   95   HG11  VAL  12          HG11      VAL  12  -1.144   4.958  -0.176
   96   HG12  VAL  12          HG12      VAL  12  -0.434   5.639  -1.642
   97   HG13  VAL  12          HG13      VAL  12  -1.923   4.694  -1.734
   98   HG21  VAL  12          HG21      VAL  12  -1.241   6.921   0.912
   99   HG22  VAL  12          HG22      VAL  12  -2.441   8.143   0.489
  100   HG23  VAL  12          HG23      VAL  12  -0.862   8.153  -0.291
  101    H    ILE  13           H        ILE  13  -2.392   5.963  -4.269
  102    HA   ILE  13           HA       ILE  13   0.450   6.308  -4.874
  103    HB   ILE  13           HB       ILE  13  -1.411   4.275  -6.073
  104   HG12  ILE  13          HG12      ILE  13  -1.362   4.145  -3.551
  105   HG13  ILE  13          HG13      ILE  13  -0.849   2.696  -4.402
  106   HG21  ILE  13          HG21      ILE  13   0.626   3.031  -6.484
  107   HG22  ILE  13          HG22      ILE  13   1.568   4.320  -5.729
  108   HG23  ILE  13          HG23      ILE  13   0.687   4.629  -7.227
  109   HD11  ILE  13          HD11      ILE  13   1.385   3.080  -3.911
  110   HD12  ILE  13          HD12      ILE  13   0.502   3.410  -2.417
  111   HD13  ILE  13          HD13      ILE  13   1.076   4.742  -3.420
  112    H    CYS  14           H        CYS  14  -2.665   5.990  -6.559
  113    HA   CYS  14           HA       CYS  14  -1.595   6.928  -9.047
  114    HB2  CYS  14           HB2      CYS  14  -4.405   6.381  -8.205
  115    HB3  CYS  14           HB3      CYS  14  -3.955   6.775  -9.836
  116    H    ASP  15           H        ASP  15  -3.305   8.355  -6.402
  117    HA   ASP  15           HA       ASP  15  -3.885  10.445  -5.847
  118    HB2  ASP  15           HB2      ASP  15  -2.341  11.123  -8.273
  119    HB3  ASP  15           HB3      ASP  15  -3.130  12.355  -7.318
  120    H    GLN  16           H        GLN  16  -5.735   8.842  -7.212
  121    HA   GLN  16           HA       GLN  16  -7.455  10.990  -8.222
  122    HB2  GLN  16           HB2      GLN  16  -7.184   8.199  -9.273
  123    HB3  GLN  16           HB3      GLN  16  -8.656   9.118  -9.503
  124    HG2  GLN  16           HG2      GLN  16  -7.516   9.453 -11.427
  125    HG3  GLN  16           HG3      GLN  16  -7.114  10.888 -10.513
  126   HE21  GLN  16          HE21      GLN  16  -5.249  11.262 -11.660
  127   HE22  GLN  16          HE22      GLN  16  -3.859  10.252 -11.515
  128    H    GLU  17           H        GLU  17  -9.587  10.865  -7.580
  129    HA   GLU  17           HA       GLU  17 -10.126   9.790  -5.052
  130    HB2  GLU  17           HB2      GLU  17 -11.927  11.033  -7.125
  131    HB3  GLU  17           HB3      GLU  17 -12.455  10.590  -5.510
  132    HG2  GLU  17           HG2      GLU  17 -10.968  12.151  -4.507
  133    HG3  GLU  17           HG3      GLU  17 -10.184  12.468  -6.048
  134    H    LYS  18           H        LYS  18 -10.324   7.793  -4.714
  135    HA   LYS  18           HA       LYS  18 -11.528   6.014  -6.702
  136    HB2  LYS  18           HB2      LYS  18  -9.018   5.960  -5.228
  137    HB3  LYS  18           HB3      LYS  18  -9.859   4.426  -5.275
  138    HG2  LYS  18           HG2      LYS  18  -8.161   4.724  -7.056
  139    HG3  LYS  18           HG3      LYS  18  -9.768   4.398  -7.635
  140    HD2  LYS  18           HD2      LYS  18 -10.061   6.815  -8.042
  141    HD3  LYS  18           HD3      LYS  18  -8.368   7.032  -7.637
  142    HE2  LYS  18           HE2      LYS  18  -8.660   6.909 -10.027
  143    HE3  LYS  18           HE3      LYS  18  -7.793   5.509  -9.432
  144    HZ1  LYS  18           HZ1      LYS  18 -10.674   5.558 -10.097
  145    HZ2  LYS  18           HZ2      LYS  18  -9.801   4.207  -9.578
  146    HZ3  LYS  18           HZ3      LYS  18  -9.459   4.909 -11.074
  147    H    ASN  19           H        ASN  19 -13.161   4.696  -5.996
  148    HA   ASN  19           HA       ASN  19 -13.767   4.873  -3.128
  149    HB2  ASN  19           HB2      ASN  19 -16.059   4.467  -3.648
  150    HB3  ASN  19           HB3      ASN  19 -15.479   5.685  -4.772
  151   HD21  ASN  19          HD21      ASN  19 -15.266   5.202  -6.938
  152   HD22  ASN  19          HD22      ASN  19 -15.987   3.763  -7.645
  153    H    ARG  20           H        ARG  20 -12.488   2.768  -5.378
  154    HA   ARG  20           HA       ARG  20 -13.174   0.476  -3.671
  155    HB2  ARG  20           HB2      ARG  20 -12.582   0.538  -6.622
  156    HB3  ARG  20           HB3      ARG  20 -12.505  -0.928  -5.680
  157    HG2  ARG  20           HG2      ARG  20 -14.850  -0.631  -5.073
  158    HG3  ARG  20           HG3      ARG  20 -14.896   0.808  -6.083
  159    HD2  ARG  20           HD2      ARG  20 -14.341  -0.419  -8.014
  160    HD3  ARG  20           HD3      ARG  20 -14.047  -1.829  -7.040
  161    HE   ARG  20           HE       ARG  20 -16.706  -0.984  -6.676
  162   HH11  ARG  20          HH11      ARG  20 -14.656  -2.537  -9.045
  163   HH12  ARG  20          HH12      ARG  20 -15.963  -3.369  -9.823
  164   HH21  ARG  20          HH21      ARG  20 -18.441  -2.059  -7.706
  165   HH22  ARG  20          HH22      ARG  20 -18.122  -3.089  -9.068
  166    H    GLY  21           H        GLY  21 -11.639  -0.087  -2.383
  167    HA2  GLY  21           HA2      GLY  21  -9.068  -0.847  -2.903
  168    HA3  GLY  21           HA3      GLY  21  -8.959   0.894  -2.655
  169    H    ILE  22           H        ILE  22  -7.613   0.203  -0.724
  170    HA   ILE  22           HA       ILE  22  -9.408  -0.405   1.518
  171    HB   ILE  22           HB       ILE  22  -7.808  -1.692   2.546
  172   HG12  ILE  22          HG12      ILE  22  -5.745  -0.275   0.890
  173   HG13  ILE  22          HG13      ILE  22  -6.119   0.059   2.545
  174   HG21  ILE  22          HG21      ILE  22  -8.402  -2.877   0.553
  175   HG22  ILE  22          HG22      ILE  22  -6.675  -3.113   0.844
  176   HG23  ILE  22          HG23      ILE  22  -7.215  -1.978  -0.393
  177   HD11  ILE  22          HD11      ILE  22  -4.087  -1.267   2.282
  178   HD12  ILE  22          HD12      ILE  22  -5.049  -2.545   1.538
  179   HD13  ILE  22          HD13      ILE  22  -5.328  -2.093   3.222
  180    H    HIS  23           H        HIS  23  -7.938   0.281   3.575
  181    HA   HIS  23           HA       HIS  23  -6.859   2.914   3.240
  182    HB2  HIS  23           HB2      HIS  23  -8.565   4.055   4.646
  183    HB3  HIS  23           HB3      HIS  23  -9.192   3.519   3.105
  184    HD1  HIS  23           HD1      HIS  23  -9.584   3.070   6.771
  185    HD2  HIS  23           HD2      HIS  23 -11.019   1.429   3.255
  186    HE1  HIS  23           HE1      HIS  23 -11.585   1.707   7.439
  187    HE2  HIS  23           HE2      HIS  23 -12.305   0.548   5.323
  188    H    LEU  24           H        LEU  24  -5.186   2.913   4.565
  189    HA   LEU  24           HA       LEU  24  -5.495   1.847   7.257
  190    HB2  LEU  24           HB2      LEU  24  -2.968   2.712   5.869
  191    HB3  LEU  24           HB3      LEU  24  -3.136   1.810   7.322
  192    HG   LEU  24           HG       LEU  24  -4.014   0.678   4.700
  193   HD11  LEU  24          HD11      LEU  24  -1.675   1.232   4.484
  194   HD12  LEU  24          HD12      LEU  24  -1.845  -0.511   4.692
  195   HD13  LEU  24          HD13      LEU  24  -1.323   0.493   6.046
  196   HD21  LEU  24          HD21      LEU  24  -3.753  -1.445   5.876
  197   HD22  LEU  24          HD22      LEU  24  -4.890  -0.393   6.723
  198   HD23  LEU  24          HD23      LEU  24  -3.243  -0.585   7.329
  199    H    TYR  25           H        TYR  25  -5.072   3.278   8.970
  200    HA   TYR  25           HA       TYR  25  -4.900   5.282  10.032
  201    HB2  TYR  25           HB2      TYR  25  -3.429   6.225   7.598
  202    HB3  TYR  25           HB3      TYR  25  -3.365   6.958   9.185
  203    HD1  TYR  25           HD1      TYR  25  -0.819   6.793   9.032
  204    HD2  TYR  25           HD2      TYR  25  -3.298   3.327   9.013
  205    HE1  TYR  25           HE1      TYR  25   1.134   5.379   9.550
  206    HE2  TYR  25           HE2      TYR  25  -1.372   1.933   9.512
  207    HH   TYR  25           HH       TYR  25   1.683   3.264  10.438
  208    H    THR  26           H        THR  26  -4.817   7.514   7.578
  209    HA   THR  26           HA       THR  26  -7.752   7.583   7.422
  210    HB   THR  26           HB       THR  26  -7.013   9.599   8.383
  211    HG1  THR  26           HG1      THR  26  -8.142   9.618   5.998
  212   HG21  THR  26          HG21      THR  26  -4.962   9.741   6.188
  213   HG22  THR  26          HG22      THR  26  -4.659   9.302   7.873
  214   HG23  THR  26          HG23      THR  26  -5.196  10.939   7.463
  215    H    LYS  27           H        LYS  27  -5.105   6.608   5.609
  216    HA   LYS  27           HA       LYS  27  -6.032   7.953   3.167
  217    HB2  LYS  27           HB2      LYS  27  -3.729   7.146   2.292
  218    HB3  LYS  27           HB3      LYS  27  -3.812   8.530   3.362
  219    HG2  LYS  27           HG2      LYS  27  -3.362   5.804   4.479
  220    HG3  LYS  27           HG3      LYS  27  -2.033   6.709   3.748
  221    HD2  LYS  27           HD2      LYS  27  -3.788   7.633   6.015
  222    HD3  LYS  27           HD3      LYS  27  -2.115   7.113   6.144
  223    HE2  LYS  27           HE2      LYS  27  -1.788   8.991   4.303
  224    HE3  LYS  27           HE3      LYS  27  -3.260   9.614   5.034
  225    HZ1  LYS  27           HZ1      LYS  27  -2.226   9.774   7.145
  226    HZ2  LYS  27           HZ2      LYS  27  -1.163  10.491   6.032
  227    HZ3  LYS  27           HZ3      LYS  27  -0.852   8.935   6.617
  228    H    PHE  28           H        PHE  28  -5.017   6.485   1.208
  229    HA   PHE  28           HA       PHE  28  -6.450   3.956   1.374
  230    HB2  PHE  28           HB2      PHE  28  -8.174   5.527   0.988
  231    HB3  PHE  28           HB3      PHE  28  -7.201   6.418  -0.171
  232    HD1  PHE  28           HD1      PHE  28  -6.781   5.359  -2.441
  233    HD2  PHE  28           HD2      PHE  28  -9.609   3.793   0.327
  234    HE1  PHE  28           HE1      PHE  28  -7.882   4.150  -4.258
  235    HE2  PHE  28           HE2      PHE  28 -10.716   2.574  -1.499
  236    HZ   PHE  28           HZ       PHE  28  -9.846   2.750  -3.802
  237    H    ILE  29           H        ILE  29  -5.250   2.507   0.276
  238    HA   ILE  29           HA       ILE  29  -3.807   3.408  -2.113
  239    HB   ILE  29           HB       ILE  29  -3.887   0.651  -0.841
  240   HG12  ILE  29          HG12      ILE  29  -1.384   1.231  -0.446
  241   HG13  ILE  29          HG13      ILE  29  -1.901   2.901  -0.634
  242   HG21  ILE  29          HG21      ILE  29  -3.545   0.559  -3.239
  243   HG22  ILE  29          HG22      ILE  29  -2.064   0.112  -2.384
  244   HG23  ILE  29          HG23      ILE  29  -2.213   1.712  -3.107
  245   HD11  ILE  29          HD11      ILE  29  -3.373   2.712   1.248
  246   HD12  ILE  29          HD12      ILE  29  -1.765   2.153   1.713
  247   HD13  ILE  29          HD13      ILE  29  -3.045   0.986   1.380
  248    H    CYS  30           H        CYS  30  -4.867   3.159  -4.100
  249    HA   CYS  30           HA       CYS  30  -7.441   1.996  -4.176
  250    HB2  CYS  30           HB2      CYS  30  -7.574   2.471  -6.427
  251    HB3  CYS  30           HB3      CYS  30  -6.374   3.620  -5.904
  252    H    LEU  31           H        LEU  31  -8.147   0.141  -5.144
  253    HA   LEU  31           HA       LEU  31  -7.039  -2.063  -3.987
  254    HB2  LEU  31           HB2      LEU  31  -8.805  -3.206  -4.908
  255    HB3  LEU  31           HB3      LEU  31  -9.400  -1.589  -4.781
  256    HG   LEU  31           HG       LEU  31  -8.543  -1.478  -7.300
  257   HD11  LEU  31          HD11      LEU  31  -9.060  -3.564  -8.476
  258   HD12  LEU  31          HD12      LEU  31  -9.285  -4.380  -6.928
  259   HD13  LEU  31          HD13      LEU  31  -7.696  -3.758  -7.375
  260   HD21  LEU  31          HD21      LEU  31 -11.152  -2.654  -6.369
  261   HD22  LEU  31          HD22      LEU  31 -10.843  -2.042  -7.992
  262   HD23  LEU  31          HD23      LEU  31 -10.776  -0.947  -6.613
  263    H    ASP  32           H        ASP  32  -6.225  -0.645  -6.935
  264    HA   ASP  32           HA       ASP  32  -5.306  -3.013  -8.287
  265    HB2  ASP  32           HB2      ASP  32  -6.235  -0.901  -9.360
  266    HB3  ASP  32           HB3      ASP  32  -4.702  -0.174  -8.958
  267    H    CYS  33           H        CYS  33  -4.064  -0.237  -6.695
  268    HA   CYS  33           HA       CYS  33  -1.316  -0.910  -6.885
  269    HB2  CYS  33           HB2      CYS  33  -2.728   1.140  -5.192
  270    HB3  CYS  33           HB3      CYS  33  -1.003   0.889  -5.193
  271    H    GLU  34           H        GLU  34  -3.893  -1.370  -4.643
  272    HA   GLU  34           HA       GLU  34  -2.437  -2.101  -2.404
  273    HB2  GLU  34           HB2      GLU  34  -4.891  -1.586  -2.527
  274    HB3  GLU  34           HB3      GLU  34  -5.135  -3.170  -3.207
  275    HG2  GLU  34           HG2      GLU  34  -3.819  -2.848  -0.581
  276    HG3  GLU  34           HG3      GLU  34  -5.553  -2.829  -0.728
  277    H    ARG  35           H        ARG  35  -3.573  -4.026  -5.128
  278    HA   ARG  35           HA       ARG  35  -2.231  -6.359  -4.152
  279    HB2  ARG  35           HB2      ARG  35  -2.720  -7.390  -6.332
  280    HB3  ARG  35           HB3      ARG  35  -4.152  -6.678  -5.607
  281    HG2  ARG  35           HG2      ARG  35  -3.883  -4.716  -7.065
  282    HG3  ARG  35           HG3      ARG  35  -2.507  -5.501  -7.819
  283    HD2  ARG  35           HD2      ARG  35  -5.277  -6.588  -7.761
  284    HD3  ARG  35           HD3      ARG  35  -4.560  -5.749  -9.125
  285    HE   ARG  35           HE       ARG  35  -2.865  -7.842  -8.495
  286   HH11  ARG  35          HH11      ARG  35  -6.179  -7.462  -9.552
  287   HH12  ARG  35          HH12      ARG  35  -6.215  -8.977 -10.394
  288   HH21  ARG  35          HH21      ARG  35  -2.903  -9.820  -9.605
  289   HH22  ARG  35          HH22      ARG  35  -4.347 -10.319 -10.427
  290    H    LYS  36           H        LYS  36  -1.263  -3.655  -5.992
  291    HA   LYS  36           HA       LYS  36   0.800  -4.763  -7.520
  292    HB2  LYS  36           HB2      LYS  36   0.338  -1.998  -6.437
  293    HB3  LYS  36           HB3      LYS  36   1.664  -2.402  -7.483
  294    HG2  LYS  36           HG2      LYS  36  -0.125  -3.168  -9.118
  295    HG3  LYS  36           HG3      LYS  36  -1.249  -2.359  -8.101
  296    HD2  LYS  36           HD2      LYS  36  -0.104  -0.343  -8.464
  297    HD3  LYS  36           HD3      LYS  36   1.151  -1.117  -9.397
  298    HE2  LYS  36           HE2      LYS  36  -0.575  -1.796 -11.034
  299    HE3  LYS  36           HE3      LYS  36  -1.775  -0.900 -10.105
  300    HZ1  LYS  36           HZ1      LYS  36  -0.951   0.362 -12.000
  301    HZ2  LYS  36           HZ2      LYS  36   0.624   0.284 -11.393
  302    HZ3  LYS  36           HZ3      LYS  36  -0.569   1.134 -10.543
  303    H    VAL  37           H        VAL  37   0.529  -3.324  -4.399
  304    HA   VAL  37           HA       VAL  37   3.163  -3.035  -3.721
  305    HB   VAL  37           HB       VAL  37   2.453  -3.072  -1.382
  306   HG11  VAL  37          HG11      VAL  37   0.414  -1.580  -3.015
  307   HG12  VAL  37          HG12      VAL  37   2.092  -1.057  -2.858
  308   HG13  VAL  37          HG13      VAL  37   1.057  -1.139  -1.431
  309   HG21  VAL  37          HG21      VAL  37   0.896  -4.703  -1.104
  310   HG22  VAL  37          HG22      VAL  37  -0.028  -4.222  -2.532
  311   HG23  VAL  37          HG23      VAL  37  -0.100  -3.247  -1.057
  312    H    ILE  38           H        ILE  38   1.053  -5.734  -3.128
  313    HA   ILE  38           HA       ILE  38   2.649  -7.323  -1.498
  314    HB   ILE  38           HB       ILE  38   0.765  -8.500  -3.516
  315   HG12  ILE  38          HG12      ILE  38   0.029  -6.827  -1.135
  316   HG13  ILE  38          HG13      ILE  38  -0.491  -6.630  -2.791
  317   HG21  ILE  38          HG21      ILE  38   0.170  -9.923  -1.523
  318   HG22  ILE  38          HG22      ILE  38   1.530  -9.164  -0.696
  319   HG23  ILE  38          HG23      ILE  38   1.806 -10.110  -2.153
  320   HD11  ILE  38          HD11      ILE  38  -1.996  -8.386  -2.668
  321   HD12  ILE  38          HD12      ILE  38  -2.153  -7.595  -1.097
  322   HD13  ILE  38          HD13      ILE  38  -1.217  -9.081  -1.252
  323    H    SER  39           H        SER  39   2.371  -6.843  -4.866
  324    HA   SER  39           HA       SER  39   3.980  -9.117  -5.477
  325    HB2  SER  39           HB2      SER  39   2.027  -8.445  -6.881
  326    HB3  SER  39           HB3      SER  39   2.928  -7.011  -7.366
  327    HG   SER  39           HG       SER  39   3.751  -9.698  -7.781
  328    H    THR  40           H        THR  40   4.355  -5.731  -5.103
  329    HA   THR  40           HA       THR  40   6.818  -5.512  -6.585
  330    HB   THR  40           HB       THR  40   5.360  -3.533  -4.832
  331    HG1  THR  40           HG1      THR  40   4.198  -4.136  -6.702
  332   HG21  THR  40          HG21      THR  40   7.758  -2.993  -5.073
  333   HG22  THR  40          HG22      THR  40   6.714  -1.813  -5.864
  334   HG23  THR  40          HG23      THR  40   7.568  -3.021  -6.827
  335    H    SER  41           H        SER  41   5.905  -6.038  -3.258
  336    HA   SER  41           HA       SER  41   8.005  -4.700  -1.994
  337    HB2  SER  41           HB2      SER  41   7.347  -6.548  -0.159
  338    HB3  SER  41           HB3      SER  41   6.370  -5.120  -0.493
  339    HG   SER  41           HG       SER  41   4.847  -6.449  -1.000
  340    H    THR  42           H        THR  42   7.694  -8.257  -2.335
  341    HA   THR  42           HA       THR  42  10.489  -8.412  -1.485
  342    HB   THR  42           HB       THR  42  10.005 -10.822  -1.067
  343    HG1  THR  42           HG1      THR  42   7.257 -10.331  -1.223
  344   HG21  THR  42          HG21      THR  42   8.168  -8.827   0.266
  345   HG22  THR  42          HG22      THR  42   9.825  -9.205   0.741
  346   HG23  THR  42          HG23      THR  42   8.562 -10.426   0.899
  347    H    SER  43           H        SER  43   8.505  -8.855  -4.230
  348    HA   SER  43           HA       SER  43  10.480 -10.484  -5.616
  349    HB2  SER  43           HB2      SER  43   8.035 -10.909  -5.901
  350    HB3  SER  43           HB3      SER  43   7.878  -9.322  -6.649
  351    HG   SER  43           HG       SER  43   9.368 -10.051  -8.260
  352    H    ASP  44           H        ASP  44  11.519  -8.091  -4.802
  353    HA   ASP  44           HA       ASP  44  11.880  -6.697  -7.350
  354    HB2  ASP  44           HB2      ASP  44  10.514  -5.185  -6.157
  355    HB3  ASP  44           HB3      ASP  44  11.404  -5.422  -4.664
  356    HA   PRO  45           HA       PRO  45  16.045  -6.442  -5.161
  357    HB2  PRO  45           HB2      PRO  45  16.412  -7.098  -2.603
  358    HB3  PRO  45           HB3      PRO  45  15.689  -5.578  -3.036
  359    HG2  PRO  45           HG2      PRO  45  14.435  -7.962  -2.044
  360    HG3  PRO  45           HG3      PRO  45  14.046  -6.305  -1.680
  361    HD2  PRO  45           HD2      PRO  45  12.682  -7.937  -3.485
  362    HD3  PRO  45           HD3      PRO  45  12.618  -6.172  -3.422
  363    H    ASP  46           H        ASP  46  17.832  -7.910  -4.756
  364    HA   ASP  46           HA       ASP  46  17.092 -10.722  -4.508
  365    HB2  ASP  46           HB2      ASP  46  18.728 -11.296  -6.228
  366    HB3  ASP  46           HB3      ASP  46  17.453 -10.287  -6.874
  367    H    TYR  47           H        TYR  47  19.043 -12.082  -4.028
  368    HA   TYR  47           HA       TYR  47  20.654 -10.631  -2.045
  369    HB2  TYR  47           HB2      TYR  47  19.466 -13.384  -1.910
  370    HB3  TYR  47           HB3      TYR  47  20.584 -12.741  -0.721
  371    HD1  TYR  47           HD1      TYR  47  17.347 -11.805  -2.370
  372    HD2  TYR  47           HD2      TYR  47  19.685 -11.814   1.189
  373    HE1  TYR  47           HE1      TYR  47  15.462 -10.823  -1.132
  374    HE2  TYR  47           HE2      TYR  47  17.806 -10.829   2.430
  375    HH   TYR  47           HH       TYR  47  14.646 -10.619   1.128
  376    H    ALA  48           H        ALA  48  22.363 -10.362  -3.524
  377    HA   ALA  48           HA       ALA  48  24.353 -10.847  -4.487
  378    HB1  ALA  48           HB1      ALA  48  25.715 -12.575  -3.430
  379    HB2  ALA  48           HB2      ALA  48  24.288 -13.200  -2.603
  380    HB3  ALA  48           HB3      ALA  48  24.888 -11.586  -2.228
  381    H1   SER   0           H1       SER   0   5.602  18.125 -12.282
  382    H2   SER   0           H2       SER   0   7.001  17.406 -11.663
  383    H3   SER   0           H3       SER   0   7.033  19.016 -12.181
  384    HA   SER   0           HA       SER   0   6.984  18.906  -9.793
  385    HB2  SER   0           HB2      SER   0   4.851  20.273  -9.495
  386    HB3  SER   0           HB3      SER   0   5.974  20.850 -10.725
  387    HG   SER   0           HG       SER   0   3.706  20.749 -11.362
  388    H    MET   1           H        MET   1   3.865  17.762 -11.084
  389    HA   MET   1           HA       MET   1   3.176  16.529  -8.581
  390    HB2  MET   1           HB2      MET   1   1.478  17.568 -10.038
  391    HB3  MET   1           HB3      MET   1   1.820  16.372 -11.280
  392    HG2  MET   1           HG2      MET   1  -0.206  15.837 -10.041
  393    HG3  MET   1           HG3      MET   1   1.032  14.600  -9.830
  394    HE1  MET   1           HE1      MET   1  -0.337  13.633  -7.761
  395    HE2  MET   1           HE2      MET   1  -1.556  14.889  -7.973
  396    HE3  MET   1           HE3      MET   1  -0.844  14.611  -6.384
  397    H    ASP   2           H        ASP   2   3.190  14.415  -8.056
  398    HA   ASP   2           HA       ASP   2   3.697  12.214  -8.056
  399    HB2  ASP   2           HB2      ASP   2   2.058  12.244  -9.983
  400    HB3  ASP   2           HB3      ASP   2   3.441  12.303 -11.066
  401    H    GLU   3           H        GLU   3   5.793  13.747  -7.739
  402    HA   GLU   3           HA       GLU   3   7.961  12.084  -8.278
  403    HB2  GLU   3           HB2      GLU   3   7.690  12.980 -10.613
  404    HB3  GLU   3           HB3      GLU   3   8.008  14.590  -9.982
  405    HG2  GLU   3           HG2      GLU   3  10.213  13.751  -9.169
  406    HG3  GLU   3           HG3      GLU   3   9.887  12.245 -10.024
  407    H    THR   4           H        THR   4   8.429  12.485  -6.108
  408    HA   THR   4           HA       THR   4   9.718  15.020  -5.560
  409    HB   THR   4           HB       THR   4   7.356  14.212  -3.853
  410    HG1  THR   4           HG1      THR   4   7.582  15.785  -6.109
  411   HG21  THR   4          HG21      THR   4   9.191  16.609  -3.789
  412   HG22  THR   4          HG22      THR   4   9.092  15.331  -2.578
  413   HG23  THR   4          HG23      THR   4   7.733  16.431  -2.813
  414    H    VAL   5           H        VAL   5   8.348  12.307  -3.655
  415    HA   VAL   5           HA       VAL   5  10.314  12.503  -1.670
  416    HB   VAL   5           HB       VAL   5   9.502  10.254  -0.902
  417   HG11  VAL   5          HG11      VAL   5   7.302  11.097  -0.228
  418   HG12  VAL   5          HG12      VAL   5   7.425  12.380  -1.432
  419   HG13  VAL   5          HG13      VAL   5   8.546  12.337  -0.071
  420   HG21  VAL   5          HG21      VAL   5   7.507   9.343  -1.962
  421   HG22  VAL   5          HG22      VAL   5   8.862   9.371  -3.089
  422   HG23  VAL   5          HG23      VAL   5   7.593  10.586  -3.209
  423    H    LYS   6           H        LYS   6  12.321  11.891  -1.576
  424    HA   LYS   6           HA       LYS   6  13.224   9.539  -3.072
  425    HB2  LYS   6           HB2      LYS   6  14.493  12.237  -3.118
  426    HB3  LYS   6           HB3      LYS   6  15.358  10.780  -3.571
  427    HG2  LYS   6           HG2      LYS   6  13.431  10.388  -5.180
  428    HG3  LYS   6           HG3      LYS   6  13.016  12.075  -4.897
  429    HD2  LYS   6           HD2      LYS   6  15.176  12.781  -5.673
  430    HD3  LYS   6           HD3      LYS   6  15.708  11.104  -5.827
  431    HE2  LYS   6           HE2      LYS   6  15.119  11.885  -7.989
  432    HE3  LYS   6           HE3      LYS   6  13.884  10.749  -7.476
  433    HZ1  LYS   6           HZ1      LYS   6  12.437  12.564  -6.929
  434    HZ2  LYS   6           HZ2      LYS   6  12.965  12.755  -8.523
  435    HZ3  LYS   6           HZ3      LYS   6  13.634  13.701  -7.294
  436    H    LEU   7           H        LEU   7  15.691   9.186  -2.360
  437    HA   LEU   7           HA       LEU   7  16.939   8.261  -0.717
  438    HB2  LEU   7           HB2      LEU   7  16.164  10.811   0.618
  439    HB3  LEU   7           HB3      LEU   7  17.253   9.672   1.366
  440    HG   LEU   7           HG       LEU   7  18.660   9.934  -0.784
  441   HD11  LEU   7          HD11      LEU   7  16.967  11.117  -2.094
  442   HD12  LEU   7          HD12      LEU   7  18.436  12.075  -1.908
  443   HD13  LEU   7          HD13      LEU   7  17.011  12.449  -0.940
  444   HD21  LEU   7          HD21      LEU   7  19.384  10.721   1.376
  445   HD22  LEU   7          HD22      LEU   7  18.376  12.159   1.225
  446   HD23  LEU   7          HD23      LEU   7  19.756  11.934   0.151
  447    H    ASN   8           H        ASN   8  15.312   9.630   1.965
  448    HA   ASN   8           HA       ASN   8  14.126   7.062   2.643
  449    HB2  ASN   8           HB2      ASN   8  13.869   9.693   4.110
  450    HB3  ASN   8           HB3      ASN   8  13.500   8.120   4.740
  451   HD21  ASN   8          HD21      ASN   8  15.894  10.419   4.215
  452   HD22  ASN   8          HD22      ASN   8  17.168   9.526   4.940
  453    H    HIS   9           H        HIS   9  12.512   6.758   1.178
  454    HA   HIS   9           HA       HIS   9  10.750   8.813   0.324
  455    HB2  HIS   9           HB2      HIS   9  10.530   5.801   0.169
  456    HB3  HIS   9           HB3      HIS   9   9.394   6.907  -0.587
  457    HD1  HIS   9           HD1      HIS   9   9.902   7.489  -2.948
  458    HD2  HIS   9           HD2      HIS   9  13.279   6.186  -0.899
  459    HE1  HIS   9           HE1      HIS   9  11.730   7.362  -4.667
  460    HE2  HIS   9           HE2      HIS   9  13.761   6.562  -3.410
  461    H    THR  10           H        THR  10   9.310   9.748   1.597
  462    HA   THR  10           HA       THR  10   8.598   8.940   4.135
  463    HB   THR  10           HB       THR  10   6.793  10.564   2.353
  464    HG1  THR  10           HG1      THR  10   8.143  12.351   3.155
  465   HG21  THR  10          HG21      THR  10   7.444  10.687   5.297
  466   HG22  THR  10          HG22      THR  10   6.005   9.936   4.610
  467   HG23  THR  10          HG23      THR  10   6.249  11.681   4.451
  468    H    CYS  11           H        CYS  11   6.931   7.725   5.047
  469    HA   CYS  11           HA       CYS  11   5.661   5.852   3.298
  470    HB2  CYS  11           HB2      CYS  11   6.056   5.232   5.629
  471    HB3  CYS  11           HB3      CYS  11   4.973   6.502   6.141
  472    H    VAL  12           H        VAL  12   4.254   6.408   1.904
  473    HA   VAL  12           HA       VAL  12   2.532   8.465   1.723
  474    HB   VAL  12           HB       VAL  12   3.181   6.286   0.350
  475   HG11  VAL  12          HG11      VAL  12   1.148   4.947  -0.085
  476   HG12  VAL  12          HG12      VAL  12   0.454   5.645   1.381
  477   HG13  VAL  12          HG13      VAL  12   1.923   4.672   1.474
  478   HG21  VAL  12          HG21      VAL  12   1.285   6.903  -1.180
  479   HG22  VAL  12          HG22      VAL  12   2.506   8.103  -0.760
  480   HG23  VAL  12          HG23      VAL  12   0.927   8.145   0.020
  481    H    ILE  13           H        ILE  13   2.416   5.942   4.005
  482    HA   ILE  13           HA       ILE  13  -0.419   6.340   4.610
  483    HB   ILE  13           HB       ILE  13   1.405   4.277   5.814
  484   HG12  ILE  13          HG12      ILE  13   1.353   4.139   3.293
  485   HG13  ILE  13          HG13      ILE  13   0.814   2.703   4.148
  486   HG21  ILE  13          HG21      ILE  13  -0.654   3.069   6.231
  487   HG22  ILE  13          HG22      ILE  13  -1.574   4.373   5.472
  488   HG23  ILE  13          HG23      ILE  13  -0.687   4.674   6.968
  489   HD11  ILE  13          HD11      ILE  13  -1.412   3.125   3.655
  490   HD12  ILE  13          HD12      ILE  13  -0.524   3.436   2.161
  491   HD13  ILE  13          HD13      ILE  13  -1.074   4.780   3.161
  492    H    CYS  14           H        CYS  14   2.691   5.971   6.295
  493    HA   CYS  14           HA       CYS  14   1.638   6.937   8.780
  494    HB2  CYS  14           HB2      CYS  14   4.436   6.336   7.939
  495    HB3  CYS  14           HB3      CYS  14   3.996   6.749   9.569
  496    H    ASP  15           H        ASP  15   3.367   8.325   6.129
  497    HA   ASP  15           HA       ASP  15   3.988  10.402   5.570
  498    HB2  ASP  15           HB2      ASP  15   2.453  11.114   7.994
  499    HB3  ASP  15           HB3      ASP  15   3.265  12.328   7.035
  500    H    GLN  16           H        GLN  16   5.810   8.768   6.937
  501    HA   GLN  16           HA       GLN  16   7.567  10.889   7.941
  502    HB2  GLN  16           HB2      GLN  16   7.247   8.107   9.003
  503    HB3  GLN  16           HB3      GLN  16   8.735   9.000   9.230
  504    HG2  GLN  16           HG2      GLN  16   7.601   9.362  11.149
  505    HG3  GLN  16           HG3      GLN  16   7.226  10.802  10.232
  506   HE21  GLN  16          HE21      GLN  16   5.370  11.217  11.372
  507   HE22  GLN  16          HE22      GLN  16   3.962  10.234  11.236
  508    H    GLU  17           H        GLU  17   9.697  10.718   7.305
  509    HA   GLU  17           HA       GLU  17  10.220   9.631   4.776
  510    HB2  GLU  17           HB2      GLU  17  12.040  10.849   6.847
  511    HB3  GLU  17           HB3      GLU  17  12.562  10.393   5.236
  512    HG2  GLU  17           HG2      GLU  17  11.101  11.973   4.225
  513    HG3  GLU  17           HG3      GLU  17  10.325  12.311   5.766
  514    H    LYS  18           H        LYS  18  10.377   7.630   4.449
  515    HA   LYS  18           HA       LYS  18  11.553   5.836   6.441
  516    HB2  LYS  18           HB2      LYS  18   9.042   5.823   4.966
  517    HB3  LYS  18           HB3      LYS  18   9.854   4.274   5.018
  518    HG2  LYS  18           HG2      LYS  18   8.162   4.609   6.795
  519    HG3  LYS  18           HG3      LYS  18   9.763   4.256   7.376
  520    HD2  LYS  18           HD2      LYS  18  10.096   6.672   7.773
  521    HD3  LYS  18           HD3      LYS  18   8.407   6.913   7.371
  522    HE2  LYS  18           HE2      LYS  18   8.706   6.793   9.763
  523    HE3  LYS  18           HE3      LYS  18   7.809   5.408   9.174
  524    HZ1  LYS  18           HZ1      LYS  18  10.694   5.406   9.829
  525    HZ2  LYS  18           HZ2      LYS  18   9.798   4.069   9.312
  526    HZ3  LYS  18           HZ3      LYS  18   9.471   4.775  10.808
  527    H    ASN  19           H        ASN  19  13.160   4.484   5.738
  528    HA   ASN  19           HA       ASN  19  13.767   4.645   2.871
  529    HB2  ASN  19           HB2      ASN  19  16.052   4.198   3.388
  530    HB3  ASN  19           HB3      ASN  19  15.496   5.429   4.508
  531   HD21  ASN  19          HD21      ASN  19  15.280   4.957   6.676
  532   HD22  ASN  19          HD22      ASN  19  15.980   3.509   7.388
  533    H    ARG  20           H        ARG  20  12.451   2.568   5.122
  534    HA   ARG  20           HA       ARG  20  13.112   0.246   3.448
  535    HB2  ARG  20           HB2      ARG  20  12.530   0.433   6.382
  536    HB3  ARG  20           HB3      ARG  20  12.388  -1.081   5.532
  537    HG2  ARG  20           HG2      ARG  20  14.719  -0.873   4.829
  538    HG3  ARG  20           HG3      ARG  20  14.847   0.562   5.836
  539    HD2  ARG  20           HD2      ARG  20  14.180  -0.715   7.709
  540    HD3  ARG  20           HD3      ARG  20  13.962  -2.144   6.752
  541    HE   ARG  20           HE       ARG  20  16.606  -1.221   6.463
  542   HH11  ARG  20          HH11      ARG  20  14.528  -2.765   8.811
  543   HH12  ARG  20          HH12      ARG  20  15.822  -3.612   9.593
  544   HH21  ARG  20          HH21      ARG  20  18.318  -2.346   7.476
  545   HH22  ARG  20          HH22      ARG  20  17.983  -3.372   8.834
  546    H    GLY  21           H        GLY  21  11.551  -0.279   2.142
  547    HA2  GLY  21           HA2      GLY  21   8.968  -0.993   2.665
  548    HA3  GLY  21           HA3      GLY  21   8.891   0.748   2.412
  549    H    ILE  22           H        ILE  22   7.534   0.077   0.481
  550    HA   ILE  22           HA       ILE  22   9.317  -0.571  -1.759
  551    HB   ILE  22           HB       ILE  22   7.693  -1.832  -2.784
  552   HG12  ILE  22          HG12      ILE  22   5.656  -0.372  -1.132
  553   HG13  ILE  22          HG13      ILE  22   6.036  -0.052  -2.787
  554   HG21  ILE  22          HG21      ILE  22   8.262  -3.023  -0.786
  555   HG22  ILE  22          HG22      ILE  22   6.532  -3.227  -1.079
  556   HG23  ILE  22          HG23      ILE  22   7.091  -2.099   0.155
  557   HD11  ILE  22          HD11      ILE  22   3.981  -1.340  -2.522
  558   HD12  ILE  22          HD12      ILE  22   4.920  -2.633  -1.772
  559   HD13  ILE  22          HD13      ILE  22   5.208  -2.191  -3.458
  560    H    HIS  23           H        HIS  23   7.855   0.134  -3.819
  561    HA   HIS  23           HA       HIS  23   6.828   2.786  -3.491
  562    HB2  HIS  23           HB2      HIS  23   8.552   3.893  -4.903
  563    HB3  HIS  23           HB3      HIS  23   9.170   3.350  -3.359
  564    HD1  HIS  23           HD1      HIS  23   9.565   2.900  -7.023
  565    HD2  HIS  23           HD2      HIS  23  10.956   1.222  -3.506
  566    HE1  HIS  23           HE1      HIS  23  11.535   1.486  -7.692
  567    HE2  HIS  23           HE2      HIS  23  12.222   0.312  -5.572
  568    H    LEU  24           H        LEU  24   5.153   2.813  -4.817
  569    HA   LEU  24           HA       LEU  24   5.444   1.732  -7.507
  570    HB2  LEU  24           HB2      LEU  24   2.933   2.645  -6.121
  571    HB3  LEU  24           HB3      LEU  24   3.086   1.736  -7.572
  572    HG   LEU  24           HG       LEU  24   3.944   0.596  -4.946
  573   HD11  LEU  24          HD11      LEU  24   1.615   1.194  -4.731
  574   HD12  LEU  24          HD12      LEU  24   1.752  -0.553  -4.934
  575   HD13  LEU  24          HD13      LEU  24   1.250   0.458  -6.290
  576   HD21  LEU  24          HD21      LEU  24   3.643  -1.526  -6.116
  577   HD22  LEU  24          HD22      LEU  24   4.799  -0.496  -6.966
  578   HD23  LEU  24          HD23      LEU  24   3.147  -0.661  -7.571
  579    H    TYR  25           H        TYR  25   5.046   3.165  -9.223
  580    HA   TYR  25           HA       TYR  25   4.915   5.169 -10.290
  581    HB2  TYR  25           HB2      TYR  25   3.458   6.146  -7.862
  582    HB3  TYR  25           HB3      TYR  25   3.408   6.873  -9.453
  583    HD1  TYR  25           HD1      TYR  25   0.859   6.754  -9.299
  584    HD2  TYR  25           HD2      TYR  25   3.276   3.244  -9.268
  585    HE1  TYR  25           HE1      TYR  25  -1.118   5.373  -9.811
  586    HE2  TYR  25           HE2      TYR  25   1.324   1.884  -9.759
  587    HH   TYR  25           HH       TYR  25  -1.705   3.257 -10.689
  588    H    THR  26           H        THR  26   4.868   7.411  -7.847
  589    HA   THR  26           HA       THR  26   7.804   7.428  -7.687
  590    HB   THR  26           HB       THR  26   7.101   9.453  -8.653
  591    HG1  THR  26           HG1      THR  26   8.245   9.460  -6.283
  592   HG21  THR  26          HG21      THR  26   5.051   9.640  -6.462
  593   HG22  THR  26          HG22      THR  26   4.741   9.201  -8.146
  594   HG23  THR  26          HG23      THR  26   5.309  10.828  -7.741
  595    H    LYS  27           H        LYS  27   5.140   6.504  -5.875
  596    HA   LYS  27           HA       LYS  27   6.090   7.841  -3.437
  597    HB2  LYS  27           HB2      LYS  27   3.774   7.078  -2.560
  598    HB3  LYS  27           HB3      LYS  27   3.881   8.457  -3.635
  599    HG2  LYS  27           HG2      LYS  27   3.382   5.736  -4.741
  600    HG3  LYS  27           HG3      LYS  27   2.070   6.667  -4.013
  601    HD2  LYS  27           HD2      LYS  27   3.843   7.553  -6.282
  602    HD3  LYS  27           HD3      LYS  27   2.160   7.061  -6.411
  603    HE2  LYS  27           HE2      LYS  27   1.866   8.954  -4.577
  604    HE3  LYS  27           HE3      LYS  27   3.350   9.546  -5.311
  605    HZ1  LYS  27           HZ1      LYS  27   2.317   9.717  -7.426
  606    HZ2  LYS  27           HZ2      LYS  27   1.269  10.459  -6.314
  607    HZ3  LYS  27           HZ3      LYS  27   0.928   8.908  -6.892
  608    H    PHE  28           H        PHE  28   5.051   6.398  -1.473
  609    HA   PHE  28           HA       PHE  28   6.437   3.842  -1.631
  610    HB2  PHE  28           HB2      PHE  28   8.190   5.384  -1.251
  611    HB3  PHE  28           HB3      PHE  28   7.233   6.295  -0.095
  612    HD1  PHE  28           HD1      PHE  28   6.793   5.253   2.178
  613    HD2  PHE  28           HD2      PHE  28   9.595   3.626  -0.584
  614    HE1  PHE  28           HE1      PHE  28   7.873   4.031   4.000
  615    HE2  PHE  28           HE2      PHE  28  10.679   2.394   1.248
  616    HZ   PHE  28           HZ       PHE  28   9.812   2.594   3.550
  617    H    ILE  29           H        ILE  29   5.215   2.418  -0.526
  618    HA   ILE  29           HA       ILE  29   3.784   3.354   1.858
  619    HB   ILE  29           HB       ILE  29   3.815   0.592   0.595
  620   HG12  ILE  29          HG12      ILE  29   1.323   1.217   0.198
  621   HG13  ILE  29          HG13      ILE  29   1.873   2.878   0.381
  622   HG21  ILE  29          HG21      ILE  29   3.472   0.513   2.992
  623   HG22  ILE  29          HG22      ILE  29   1.981   0.092   2.139
  624   HG23  ILE  29          HG23      ILE  29   2.163   1.690   2.859
  625   HD11  ILE  29          HD11      ILE  29   3.339   2.655  -1.500
  626   HD12  ILE  29          HD12      ILE  29   1.723   2.120  -1.965
  627   HD13  ILE  29          HD13      ILE  29   2.982   0.933  -1.625
  628    H    CYS  30           H        CYS  30   4.841   3.092   3.846
  629    HA   CYS  30           HA       CYS  30   7.393   1.885   3.923
  630    HB2  CYS  30           HB2      CYS  30   7.541   2.364   6.171
  631    HB3  CYS  30           HB3      CYS  30   6.356   3.532   5.649
  632    H    LEU  31           H        LEU  31   8.068   0.022   4.898
  633    HA   LEU  31           HA       LEU  31   6.921  -2.167   3.748
  634    HB2  LEU  31           HB2      LEU  31   8.664  -3.339   4.675
  635    HB3  LEU  31           HB3      LEU  31   9.289  -1.733   4.545
  636    HG   LEU  31           HG       LEU  31   8.430  -1.599   7.064
  637   HD11  LEU  31          HD11      LEU  31   8.909  -3.691   8.245
  638   HD12  LEU  31          HD12      LEU  31   9.120  -4.516   6.700
  639   HD13  LEU  31          HD13      LEU  31   7.542  -3.864   7.144
  640   HD21  LEU  31          HD21      LEU  31  11.018  -2.822   6.134
  641   HD22  LEU  31          HD22      LEU  31  10.722  -2.201   7.757
  642   HD23  LEU  31          HD23      LEU  31  10.673  -1.110   6.373
  643    H    ASP  32           H        ASP  32   6.127  -0.725   6.693
  644    HA   ASP  32           HA       ASP  32   5.170  -3.076   8.053
  645    HB2  ASP  32           HB2      ASP  32   6.138  -0.979   9.117
  646    HB3  ASP  32           HB3      ASP  32   4.625  -0.224   8.705
  647    H    CYS  33           H        CYS  33   3.976  -0.280   6.454
  648    HA   CYS  33           HA       CYS  33   1.216  -0.903   6.645
  649    HB2  CYS  33           HB2      CYS  33   2.666   1.118   4.947
  650    HB3  CYS  33           HB3      CYS  33   0.936   0.897   4.949
  651    H    GLU  34           H        GLU  34   3.784  -1.413   4.403
  652    HA   GLU  34           HA       GLU  34   2.317  -2.127   2.168
  653    HB2  GLU  34           HB2      GLU  34   4.780  -1.657   2.288
  654    HB3  GLU  34           HB3      GLU  34   4.995  -3.243   2.975
  655    HG2  GLU  34           HG2      GLU  34   3.683  -2.909   0.348
  656    HG3  GLU  34           HG3      GLU  34   5.418  -2.918   0.494
  657    H    ARG  35           H        ARG  35   3.417  -4.063   4.899
  658    HA   ARG  35           HA       ARG  35   2.034  -6.374   3.927
  659    HB2  ARG  35           HB2      ARG  35   2.506  -7.410   6.112
  660    HB3  ARG  35           HB3      ARG  35   3.951  -6.728   5.384
  661    HG2  ARG  35           HG2      ARG  35   3.718  -4.753   6.835
  662    HG3  ARG  35           HG3      ARG  35   2.329  -5.512   7.592
  663    HD2  ARG  35           HD2      ARG  35   5.078  -6.650   7.536
  664    HD3  ARG  35           HD3      ARG  35   4.377  -5.794   8.897
  665    HE   ARG  35           HE       ARG  35   2.640  -7.851   8.273
  666   HH11  ARG  35          HH11      ARG  35   5.958  -7.532   9.330
  667   HH12  ARG  35          HH12      ARG  35   5.966  -9.042  10.182
  668   HH21  ARG  35          HH21      ARG  35   2.644  -9.833   9.402
  669   HH22  ARG  35          HH22      ARG  35   4.082 -10.349  10.223
  670    H    LYS  36           H        LYS  36   1.116  -3.648   5.759
  671    HA   LYS  36           HA       LYS  36  -0.968  -4.715   7.291
  672    HB2  LYS  36           HB2      LYS  36  -0.454  -1.962   6.200
  673    HB3  LYS  36           HB3      LYS  36  -1.788  -2.338   7.245
  674    HG2  LYS  36           HG2      LYS  36  -0.016  -3.130   8.884
  675    HG3  LYS  36           HG3      LYS  36   1.124  -2.345   7.866
  676    HD2  LYS  36           HD2      LYS  36   0.014  -0.310   8.220
  677    HD3  LYS  36           HD3      LYS  36  -1.254  -1.057   9.155
  678    HE2  LYS  36           HE2      LYS  36   0.460  -1.760  10.794
  679    HE3  LYS  36           HE3      LYS  36   1.674  -0.885   9.863
  680    HZ1  LYS  36           HZ1      LYS  36   0.868   0.393  11.751
  681    HZ2  LYS  36           HZ2      LYS  36  -0.707   0.341  11.147
  682    HZ3  LYS  36           HZ3      LYS  36   0.500   1.169  10.292
  683    H    VAL  37           H        VAL  37  -0.671  -3.289   4.165
  684    HA   VAL  37           HA       VAL  37  -3.299  -2.956   3.487
  685    HB   VAL  37           HB       VAL  37  -2.591  -3.015   1.148
  686   HG11  VAL  37          HG11      VAL  37  -0.526  -1.555   2.777
  687   HG12  VAL  37          HG12      VAL  37  -2.194  -1.002   2.614
  688   HG13  VAL  37          HG13      VAL  37  -1.159  -1.108   1.191
  689   HG21  VAL  37          HG21      VAL  37  -1.063  -4.674   0.876
  690   HG22  VAL  37          HG22      VAL  37  -0.131  -4.207   2.302
  691   HG23  VAL  37          HG23      VAL  37  -0.040  -3.236   0.826
  692    H    ILE  38           H        ILE  38  -1.239  -5.694   2.902
  693    HA   ILE  38           HA       ILE  38  -2.862  -7.260   1.277
  694    HB   ILE  38           HB       ILE  38  -1.000  -8.464   3.300
  695   HG12  ILE  38          HG12      ILE  38  -0.233  -6.814   0.912
  696   HG13  ILE  38          HG13      ILE  38   0.290  -6.619   2.568
  697   HG21  ILE  38          HG21      ILE  38  -0.433  -9.904   1.313
  698   HG22  ILE  38          HG22      ILE  38  -1.777  -9.123   0.482
  699   HG23  ILE  38          HG23      ILE  38  -2.071 -10.058   1.944
  700   HD11  ILE  38          HD11      ILE  38   1.765  -8.401   2.455
  701   HD12  ILE  38          HD12      ILE  38   1.934  -7.623   0.877
  702   HD13  ILE  38          HD13      ILE  38   0.973  -9.090   1.041
  703    H    SER  39           H        SER  39  -2.576  -6.775   4.647
  704    HA   SER  39           HA       SER  39  -4.226  -9.018   5.265
  705    HB2  SER  39           HB2      SER  39  -2.262  -8.380   6.668
  706    HB3  SER  39           HB3      SER  39  -3.133  -6.925   7.146
  707    HG   SER  39           HG       SER  39  -4.025  -9.590   7.579
  708    H    THR  40           H        THR  40  -4.541  -5.628   4.877
  709    HA   THR  40           HA       THR  40  -7.001  -5.360   6.358
  710    HB   THR  40           HB       THR  40  -5.501  -3.412   4.605
  711    HG1  THR  40           HG1      THR  40  -4.353  -4.027   6.472
  712   HG21  THR  40          HG21      THR  40  -7.891  -2.828   4.840
  713   HG22  THR  40          HG22      THR  40  -6.827  -1.666   5.628
  714   HG23  THR  40          HG23      THR  40  -7.704  -2.855   6.594
  715    H    SER  41           H        SER  41  -6.093  -5.914   3.034
  716    HA   SER  41           HA       SER  41  -8.169  -4.543   1.763
  717    HB2  SER  41           HB2      SER  41  -7.547  -6.404  -0.067
  718    HB3  SER  41           HB3      SER  41  -6.540  -4.997   0.265
  719    HG   SER  41           HG       SER  41  -5.043  -6.351   0.777
  720    H    THR  42           H        THR  42  -7.926  -8.103   2.121
  721    HA   THR  42           HA       THR  42 -10.723  -8.211   1.268
  722    HB   THR  42           HB       THR  42 -10.275 -10.632   0.865
  723    HG1  THR  42           HG1      THR  42  -7.521 -10.190   1.005
  724   HG21  THR  42          HG21      THR  42  -8.413  -8.669  -0.483
  725   HG22  THR  42          HG22      THR  42 -10.076  -9.025  -0.952
  726   HG23  THR  42          HG23      THR  42  -8.833 -10.266  -1.106
  727    H    SER  43           H        SER  43  -8.749  -8.676   4.015
  728    HA   SER  43           HA       SER  43 -10.751 -10.266   5.406
  729    HB2  SER  43           HB2      SER  43  -8.312 -10.737   5.693
  730    HB3  SER  43           HB3      SER  43  -8.129  -9.151   6.441
  731    HG   SER  43           HG       SER  43  -9.616  -9.840   8.052
  732    H    ASP  44           H        ASP  44 -11.746  -7.860   4.585
  733    HA   ASP  44           HA       ASP  44 -12.077  -6.448   7.125
  734    HB2  ASP  44           HB2      ASP  44 -10.687  -4.968   5.925
  735    HB3  ASP  44           HB3      ASP  44 -11.587  -5.189   4.435
  736    HA   PRO  45           HA       PRO  45 -16.240  -6.133   4.949
  737    HB2  PRO  45           HB2      PRO  45 -16.621  -6.765   2.388
  738    HB3  PRO  45           HB3      PRO  45 -15.874  -5.237   2.837
  739    HG2  PRO  45           HG2      PRO  45 -14.650  -7.741   1.825
  740    HG3  PRO  45           HG3      PRO  45 -14.278  -6.063   1.461
  741    HD2  PRO  45           HD2      PRO  45 -12.894  -7.673   3.268
  742    HD3  PRO  45           HD3      PRO  45 -12.817  -5.905   3.194
  743    H    ASP  46           H        ASP  46 -18.043  -7.558   4.508
  744    HA   ASP  46           HA       ASP  46 -17.366 -10.387   4.298
  745    HB2  ASP  46           HB2      ASP  46 -19.001 -10.920   6.021
  746    HB3  ASP  46           HB3      ASP  46 -17.714  -9.926   6.662
  747    H    TYR  47           H        TYR  47 -19.339 -11.715   3.822
  748    HA   TYR  47           HA       TYR  47 -20.925 -10.242   1.838
  749    HB2  TYR  47           HB2      TYR  47 -19.787 -13.018   1.709
  750    HB3  TYR  47           HB3      TYR  47 -20.894 -12.358   0.518
  751    HD1  TYR  47           HD1      TYR  47 -17.639 -11.473   2.163
  752    HD2  TYR  47           HD2      TYR  47 -19.979 -11.453  -1.396
  753    HE1  TYR  47           HE1      TYR  47 -15.738 -10.530   0.919
  754    HE2  TYR  47           HE2      TYR  47 -18.085 -10.507  -2.642
  755    HH   TYR  47           HH       TYR  47 -14.915 -10.326  -1.322
  756    H    ALA  48           H        ALA  48 -22.631  -9.938   3.302
  757    HA   ALA  48           HA       ALA  48 -24.628 -10.380   4.274
  758    HB1  ALA  48           HB1      ALA  48 -26.022 -12.091   3.228
  759    HB2  ALA  48           HB2      ALA  48 -24.607 -12.746   2.406
  760    HB3  ALA  48           HB3      ALA  48 -25.177 -11.124   2.020
  Start of MODEL    3
    1    H1   SER   0           H1       SER   0   2.154  14.678  -4.882
    2    H2   SER   0           H2       SER   0   0.565  14.361  -4.401
    3    H3   SER   0           H3       SER   0   1.834  14.201  -3.290
    4    HA   SER   0           HA       SER   0   2.280  16.541  -3.387
    5    HB2  SER   0           HB2      SER   0  -0.136  16.692  -5.198
    6    HB3  SER   0           HB3      SER   0   0.855  18.041  -4.654
    7    HG   SER   0           HG       SER   0   1.360  17.253  -6.797
    8    H    MET   1           H        MET   1  -1.142  15.514  -3.653
    9    HA   MET   1           HA       MET   1  -1.493  16.111  -0.817
   10    HB2  MET   1           HB2      MET   1  -3.487  17.463  -1.220
   11    HB3  MET   1           HB3      MET   1  -2.084  18.193  -1.985
   12    HG2  MET   1           HG2      MET   1  -2.790  17.311  -4.142
   13    HG3  MET   1           HG3      MET   1  -4.188  16.555  -3.380
   14    HE1  MET   1           HE1      MET   1  -4.452  18.430  -5.902
   15    HE2  MET   1           HE2      MET   1  -5.831  19.429  -5.441
   16    HE3  MET   1           HE3      MET   1  -5.835  17.703  -5.083
   17    H    ASP   2           H        ASP   2  -3.285  15.092   0.128
   18    HA   ASP   2           HA       ASP   2  -4.641  13.079  -1.540
   19    HB2  ASP   2           HB2      ASP   2  -4.500  11.496   0.352
   20    HB3  ASP   2           HB3      ASP   2  -2.903  11.959  -0.226
   21    H    GLU   3           H        GLU   3  -6.811  12.784  -1.123
   22    HA   GLU   3           HA       GLU   3  -8.056  14.095   1.135
   23    HB2  GLU   3           HB2      GLU   3  -7.665  15.891  -0.592
   24    HB3  GLU   3           HB3      GLU   3  -8.743  15.009  -1.663
   25    HG2  GLU   3           HG2      GLU   3 -10.564  15.287  -0.055
   26    HG3  GLU   3           HG3      GLU   3  -9.479  16.180   1.011
   27    H    THR   4           H        THR   4 -10.399  13.737   1.186
   28    HA   THR   4           HA       THR   4 -11.279  11.429  -0.428
   29    HB   THR   4           HB       THR   4 -11.985  12.084   2.438
   30    HG1  THR   4           HG1      THR   4  -9.967  11.107   2.318
   31   HG21  THR   4          HG21      THR   4 -13.907  11.143   1.356
   32   HG22  THR   4          HG22      THR   4 -13.167   9.879   2.340
   33   HG23  THR   4          HG23      THR   4 -12.920   9.899   0.592
   34    H    VAL   5           H        VAL   5 -13.033  11.832  -1.671
   35    HA   VAL   5           HA       VAL   5 -14.698  14.147  -0.938
   36    HB   VAL   5           HB       VAL   5 -14.441  12.963  -3.704
   37   HG11  VAL   5          HG11      VAL   5 -16.531  14.149  -3.291
   38   HG12  VAL   5          HG12      VAL   5 -15.513  15.048  -4.415
   39   HG13  VAL   5          HG13      VAL   5 -15.633  15.559  -2.733
   40   HG21  VAL   5          HG21      VAL   5 -13.042  14.888  -4.259
   41   HG22  VAL   5          HG22      VAL   5 -12.295  13.899  -3.005
   42   HG23  VAL   5          HG23      VAL   5 -13.089  15.414  -2.577
   43    H    LYS   6           H        LYS   6 -15.798  12.686   0.501
   44    HA   LYS   6           HA       LYS   6 -17.672  11.593   1.109
   45    HB2  LYS   6           HB2      LYS   6 -18.521  11.967  -1.736
   46    HB3  LYS   6           HB3      LYS   6 -19.574  11.520  -0.413
   47    HG2  LYS   6           HG2      LYS   6 -19.179  13.648   0.635
   48    HG3  LYS   6           HG3      LYS   6 -18.043  14.097  -0.632
   49    HD2  LYS   6           HD2      LYS   6 -19.882  13.878  -2.280
   50    HD3  LYS   6           HD3      LYS   6 -20.992  13.578  -0.948
   51    HE2  LYS   6           HE2      LYS   6 -20.456  15.764  -0.006
   52    HE3  LYS   6           HE3      LYS   6 -19.355  16.058  -1.344
   53    HZ1  LYS   6           HZ1      LYS   6 -22.277  15.635  -1.579
   54    HZ2  LYS   6           HZ2      LYS   6 -21.220  15.912  -2.870
   55    HZ3  LYS   6           HZ3      LYS   6 -21.483  17.121  -1.717
   56    H    LEU   7           H        LEU   7 -17.852  10.320  -2.168
   57    HA   LEU   7           HA       LEU   7 -17.927   7.662  -1.029
   58    HB2  LEU   7           HB2      LEU   7 -18.719   6.889  -3.128
   59    HB3  LEU   7           HB3      LEU   7 -19.559   8.374  -2.768
   60    HG   LEU   7           HG       LEU   7 -17.183   8.303  -4.611
   61   HD11  LEU   7          HD11      LEU   7 -18.854   6.728  -5.459
   62   HD12  LEU   7          HD12      LEU   7 -18.754   8.169  -6.470
   63   HD13  LEU   7          HD13      LEU   7 -20.093   7.977  -5.339
   64   HD21  LEU   7          HD21      LEU   7 -17.776  10.486  -3.833
   65   HD22  LEU   7          HD22      LEU   7 -19.477  10.197  -4.183
   66   HD23  LEU   7          HD23      LEU   7 -18.316  10.329  -5.502
   67    H    ASN   8           H        ASN   8 -15.834   9.528  -3.185
   68    HA   ASN   8           HA       ASN   8 -14.108   7.229  -3.587
   69    HB2  ASN   8           HB2      ASN   8 -12.566   8.964  -4.669
   70    HB3  ASN   8           HB3      ASN   8 -14.061   8.666  -5.502
   71   HD21  ASN   8          HD21      ASN   8 -15.533  10.291  -5.673
   72   HD22  ASN   8          HD22      ASN   8 -15.187  11.903  -5.166
   73    H    HIS   9           H        HIS   9 -12.129   6.945  -2.760
   74    HA   HIS   9           HA       HIS   9 -11.035   9.038  -1.005
   75    HB2  HIS   9           HB2      HIS   9 -10.590   6.037  -0.906
   76    HB3  HIS   9           HB3      HIS   9  -9.710   7.209   0.062
   77    HD1  HIS   9           HD1      HIS   9 -13.125   5.651  -0.287
   78    HD2  HIS   9           HD2      HIS   9 -11.002   8.074   2.337
   79    HE1  HIS   9           HE1      HIS   9 -14.536   5.801   1.784
   80    HE2  HIS   9           HE2      HIS   9 -13.323   7.426   3.274
   81    H    THR  10           H        THR  10  -9.114   9.869  -1.763
   82    HA   THR  10           HA       THR  10  -8.406   9.120  -4.434
   83    HB   THR  10           HB       THR  10  -6.888  11.002  -2.606
   84    HG1  THR  10           HG1      THR  10  -8.927  11.830  -2.643
   85   HG21  THR  10          HG21      THR  10  -5.757  10.372  -4.719
   86   HG22  THR  10          HG22      THR  10  -6.187  12.081  -4.664
   87   HG23  THR  10          HG23      THR  10  -7.160  10.959  -5.615
   88    H    CYS  11           H        CYS  11  -6.817   7.835  -5.134
   89    HA   CYS  11           HA       CYS  11  -5.435   6.158  -3.300
   90    HB2  CYS  11           HB2      CYS  11  -6.005   5.368  -5.573
   91    HB3  CYS  11           HB3      CYS  11  -4.929   6.576  -6.265
   92    H    VAL  12           H        VAL  12  -3.780   6.741  -2.099
   93    HA   VAL  12           HA       VAL  12  -2.178   9.004  -2.370
   94    HB   VAL  12           HB       VAL  12  -0.533   7.810  -0.926
   95   HG11  VAL  12          HG11      VAL  12  -3.416   7.579  -0.088
   96   HG12  VAL  12          HG12      VAL  12  -2.361   8.977   0.132
   97   HG13  VAL  12          HG13      VAL  12  -2.032   7.475   1.000
   98   HG21  VAL  12          HG21      VAL  12  -2.431   5.487  -1.232
   99   HG22  VAL  12          HG22      VAL  12  -1.076   5.565  -0.107
  100   HG23  VAL  12          HG23      VAL  12  -0.780   5.571  -1.844
  101    H    ILE  13           H        ILE  13  -2.268   6.257  -4.263
  102    HA   ILE  13           HA       ILE  13   0.505   6.424  -5.126
  103    HB   ILE  13           HB       ILE  13  -1.499   4.440  -6.095
  104   HG12  ILE  13          HG12      ILE  13  -1.463   4.489  -3.588
  105   HG13  ILE  13          HG13      ILE  13  -0.969   2.959  -4.306
  106   HG21  ILE  13          HG21      ILE  13   0.663   4.665  -7.237
  107   HG22  ILE  13          HG22      ILE  13   0.414   3.080  -6.509
  108   HG23  ILE  13          HG23      ILE  13   1.472   4.255  -5.721
  109   HD11  ILE  13          HD11      ILE  13   0.381   3.806  -2.388
  110   HD12  ILE  13          HD12      ILE  13   0.983   5.059  -3.482
  111   HD13  ILE  13          HD13      ILE  13   1.268   3.348  -3.845
  112    H    CYS  14           H        CYS  14  -2.693   6.106  -6.584
  113    HA   CYS  14           HA       CYS  14  -1.700   6.873  -9.176
  114    HB2  CYS  14           HB2      CYS  14  -4.452   6.251  -8.227
  115    HB3  CYS  14           HB3      CYS  14  -4.044   6.518  -9.897
  116    H    ASP  15           H        ASP  15  -3.087   8.473  -6.506
  117    HA   ASP  15           HA       ASP  15  -3.801  10.585  -6.108
  118    HB2  ASP  15           HB2      ASP  15  -1.755  11.070  -7.443
  119    HB3  ASP  15           HB3      ASP  15  -2.778  11.276  -8.849
  120    H    GLN  16           H        GLN  16  -5.447   8.664  -7.274
  121    HA   GLN  16           HA       GLN  16  -7.377  10.267  -8.791
  122    HB2  GLN  16           HB2      GLN  16  -6.832   7.306  -9.010
  123    HB3  GLN  16           HB3      GLN  16  -8.096   8.167  -9.867
  124    HG2  GLN  16           HG2      GLN  16  -5.170   8.668 -10.150
  125    HG3  GLN  16           HG3      GLN  16  -6.153   7.750 -11.271
  126   HE21  GLN  16          HE21      GLN  16  -4.575  10.126 -11.715
  127   HE22  GLN  16          HE22      GLN  16  -5.667  11.307 -12.333
  128    H    GLU  17           H        GLU  17  -9.452  10.162  -8.238
  129    HA   GLU  17           HA       GLU  17 -10.193   9.452  -5.579
  130    HB2  GLU  17           HB2      GLU  17 -11.780  10.485  -7.922
  131    HB3  GLU  17           HB3      GLU  17 -12.396  10.345  -6.281
  132    HG2  GLU  17           HG2      GLU  17 -11.047  12.035  -5.499
  133    HG3  GLU  17           HG3      GLU  17  -9.915  11.870  -6.823
  134    H    LYS  18           H        LYS  18 -10.175   7.341  -5.245
  135    HA   LYS  18           HA       LYS  18 -11.883   5.663  -6.956
  136    HB2  LYS  18           HB2      LYS  18  -9.826   4.531  -5.171
  137    HB3  LYS  18           HB3      LYS  18 -10.529   3.833  -6.594
  138    HG2  LYS  18           HG2      LYS  18  -8.403   5.921  -6.406
  139    HG3  LYS  18           HG3      LYS  18  -8.321   4.329  -7.156
  140    HD2  LYS  18           HD2      LYS  18 -10.282   6.283  -8.199
  141    HD3  LYS  18           HD3      LYS  18  -8.598   6.523  -8.572
  142    HE2  LYS  18           HE2      LYS  18  -9.796   5.307 -10.319
  143    HE3  LYS  18           HE3      LYS  18  -8.497   4.388  -9.599
  144    HZ1  LYS  18           HZ1      LYS  18 -10.479   3.044  -9.950
  145    HZ2  LYS  18           HZ2      LYS  18 -11.365   4.070  -8.945
  146    HZ3  LYS  18           HZ3      LYS  18 -10.099   3.150  -8.309
  147    H    ASN  19           H        ASN  19 -13.569   4.633  -6.038
  148    HA   ASN  19           HA       ASN  19 -13.890   5.013  -3.163
  149    HB2  ASN  19           HB2      ASN  19 -16.239   4.394  -3.517
  150    HB3  ASN  19           HB3      ASN  19 -15.759   5.737  -4.531
  151   HD21  ASN  19          HD21      ASN  19 -17.535   5.327  -5.866
  152   HD22  ASN  19          HD22      ASN  19 -17.518   4.005  -7.026
  153    H    ARG  20           H        ARG  20 -12.432   2.825  -4.981
  154    HA   ARG  20           HA       ARG  20 -13.144   0.635  -3.171
  155    HB2  ARG  20           HB2      ARG  20 -12.851   0.434  -6.166
  156    HB3  ARG  20           HB3      ARG  20 -12.786  -0.951  -5.104
  157    HG2  ARG  20           HG2      ARG  20 -15.025  -0.554  -4.382
  158    HG3  ARG  20           HG3      ARG  20 -15.079   0.951  -5.288
  159    HD2  ARG  20           HD2      ARG  20 -14.706  -0.248  -7.344
  160    HD3  ARG  20           HD3      ARG  20 -14.667  -1.722  -6.424
  161    HE   ARG  20           HE       ARG  20 -17.070  -0.750  -5.758
  162   HH11  ARG  20          HH11      ARG  20 -15.529  -1.194  -8.866
  163   HH12  ARG  20          HH12      ARG  20 -17.026  -1.377  -9.724
  164   HH21  ARG  20          HH21      ARG  20 -19.042  -0.980  -6.885
  165   HH22  ARG  20          HH22      ARG  20 -19.025  -1.262  -8.594
  166    H    GLY  21           H        GLY  21 -11.528   0.111  -2.022
  167    HA2  GLY  21           HA2      GLY  21  -9.100  -0.917  -2.708
  168    HA3  GLY  21           HA3      GLY  21  -8.792   0.807  -2.582
  169    H    ILE  22           H        ILE  22  -7.462   0.360  -0.539
  170    HA   ILE  22           HA       ILE  22  -9.296  -0.220   1.673
  171    HB   ILE  22           HB       ILE  22  -7.743  -1.457   2.787
  172   HG12  ILE  22          HG12      ILE  22  -5.589  -0.138   1.177
  173   HG13  ILE  22          HG13      ILE  22  -6.076   0.352   2.763
  174   HG21  ILE  22          HG21      ILE  22  -7.041  -1.819  -0.119
  175   HG22  ILE  22          HG22      ILE  22  -8.240  -2.715   0.820
  176   HG23  ILE  22          HG23      ILE  22  -6.522  -2.905   1.169
  177   HD11  ILE  22          HD11      ILE  22  -5.476  -1.956   3.537
  178   HD12  ILE  22          HD12      ILE  22  -4.131  -0.922   3.048
  179   HD13  ILE  22          HD13      ILE  22  -4.728  -2.184   1.952
  180    H    HIS  23           H        HIS  23  -7.947   0.453   3.753
  181    HA   HIS  23           HA       HIS  23  -6.853   3.104   3.549
  182    HB2  HIS  23           HB2      HIS  23  -8.552   4.141   5.037
  183    HB3  HIS  23           HB3      HIS  23  -9.219   3.671   3.492
  184    HD1  HIS  23           HD1      HIS  23  -9.609   3.196   7.126
  185    HD2  HIS  23           HD2      HIS  23 -10.927   1.441   3.621
  186    HE1  HIS  23           HE1      HIS  23 -11.554   1.751   7.794
  187    HE2  HIS  23           HE2      HIS  23 -12.210   0.547   5.684
  188    H    LEU  24           H        LEU  24  -5.119   2.872   4.783
  189    HA   LEU  24           HA       LEU  24  -5.008   0.958   6.939
  190    HB2  LEU  24           HB2      LEU  24  -3.109   2.611   5.449
  191    HB3  LEU  24           HB3      LEU  24  -2.739   2.458   7.129
  192    HG   LEU  24           HG       LEU  24  -2.068   0.334   6.921
  193   HD11  LEU  24          HD11      LEU  24  -4.204  -0.113   4.923
  194   HD12  LEU  24          HD12      LEU  24  -4.122  -0.680   6.594
  195   HD13  LEU  24          HD13      LEU  24  -3.005  -1.321   5.390
  196   HD21  LEU  24          HD21      LEU  24  -1.999   0.890   4.005
  197   HD22  LEU  24          HD22      LEU  24  -0.921  -0.144   4.952
  198   HD23  LEU  24          HD23      LEU  24  -0.886   1.603   5.169
  199    H    TYR  25           H        TYR  25  -4.240   4.397   6.749
  200    HA   TYR  25           HA       TYR  25  -4.902   4.633   9.576
  201    HB2  TYR  25           HB2      TYR  25  -3.217   6.464   7.911
  202    HB3  TYR  25           HB3      TYR  25  -3.441   6.578   9.643
  203    HD1  TYR  25           HD1      TYR  25  -0.721   6.582   9.287
  204    HD2  TYR  25           HD2      TYR  25  -3.271   3.204   8.795
  205    HE1  TYR  25           HE1      TYR  25   1.209   5.075   9.584
  206    HE2  TYR  25           HE2      TYR  25  -1.390   1.704   9.053
  207    HH   TYR  25           HH       TYR  25   1.657   2.782  10.238
  208    H    THR  26           H        THR  26  -4.678   7.552   7.867
  209    HA   THR  26           HA       THR  26  -7.594   7.652   7.563
  210    HB   THR  26           HB       THR  26  -7.036   9.420   8.963
  211    HG1  THR  26           HG1      THR  26  -7.474  10.133   6.336
  212   HG21  THR  26          HG21      THR  26  -5.118  10.838   8.782
  213   HG22  THR  26          HG22      THR  26  -4.703  10.156   7.212
  214   HG23  THR  26          HG23      THR  26  -4.584   9.157   8.663
  215    H    LYS  27           H        LYS  27  -5.387   6.525   5.740
  216    HA   LYS  27           HA       LYS  27  -5.737   8.287   3.398
  217    HB2  LYS  27           HB2      LYS  27  -3.655   6.257   3.186
  218    HB3  LYS  27           HB3      LYS  27  -3.608   7.962   2.778
  219    HG2  LYS  27           HG2      LYS  27  -3.366   6.859   5.538
  220    HG3  LYS  27           HG3      LYS  27  -2.014   7.291   4.511
  221    HD2  LYS  27           HD2      LYS  27  -4.069   9.094   5.729
  222    HD3  LYS  27           HD3      LYS  27  -2.318   9.127   5.936
  223    HE2  LYS  27           HE2      LYS  27  -2.283   9.552   3.379
  224    HE3  LYS  27           HE3      LYS  27  -3.970  10.012   3.610
  225    HZ1  LYS  27           HZ1      LYS  27  -2.612  11.320   5.606
  226    HZ2  LYS  27           HZ2      LYS  27  -3.224  12.007   4.185
  227    HZ3  LYS  27           HZ3      LYS  27  -1.618  11.489   4.247
  228    H    PHE  28           H        PHE  28  -5.008   6.797   1.405
  229    HA   PHE  28           HA       PHE  28  -6.603   4.362   1.368
  230    HB2  PHE  28           HB2      PHE  28  -8.264   6.033   0.876
  231    HB3  PHE  28           HB3      PHE  28  -7.217   6.798  -0.307
  232    HD1  PHE  28           HD1      PHE  28  -7.036   5.985  -2.510
  233    HD2  PHE  28           HD2      PHE  28  -9.338   3.843   0.343
  234    HE1  PHE  28           HE1      PHE  28  -7.989   4.634  -4.319
  235    HE2  PHE  28           HE2      PHE  28 -10.308   2.482  -1.466
  236    HZ   PHE  28           HZ       PHE  28  -9.626   2.872  -3.812
  237    H    ILE  29           H        ILE  29  -5.513   2.889   0.304
  238    HA   ILE  29           HA       ILE  29  -3.976   3.672  -2.093
  239    HB   ILE  29           HB       ILE  29  -3.927   1.037  -0.585
  240   HG12  ILE  29          HG12      ILE  29  -1.394   1.781  -0.440
  241   HG13  ILE  29          HG13      ILE  29  -2.075   3.394  -0.608
  242   HG21  ILE  29          HG21      ILE  29  -2.336   1.922  -2.982
  243   HG22  ILE  29          HG22      ILE  29  -3.670   0.764  -2.998
  244   HG23  ILE  29          HG23      ILE  29  -2.173   0.383  -2.138
  245   HD11  ILE  29          HD11      ILE  29  -3.339   3.148   1.388
  246   HD12  ILE  29          HD12      ILE  29  -1.686   2.631   1.729
  247   HD13  ILE  29          HD13      ILE  29  -2.951   1.431   1.487
  248    H    CYS  30           H        CYS  30  -4.981   3.224  -4.026
  249    HA   CYS  30           HA       CYS  30  -7.564   2.076  -4.042
  250    HB2  CYS  30           HB2      CYS  30  -7.615   2.376  -6.349
  251    HB3  CYS  30           HB3      CYS  30  -6.488   3.611  -5.838
  252    H    LEU  31           H        LEU  31  -8.253   0.195  -4.923
  253    HA   LEU  31           HA       LEU  31  -7.167  -2.011  -3.759
  254    HB2  LEU  31           HB2      LEU  31  -8.971  -3.125  -4.625
  255    HB3  LEU  31           HB3      LEU  31  -9.521  -1.484  -4.597
  256    HG   LEU  31           HG       LEU  31  -8.663  -1.515  -7.104
  257   HD11  LEU  31          HD11      LEU  31  -7.812  -3.793  -7.056
  258   HD12  LEU  31          HD12      LEU  31  -9.167  -3.658  -8.176
  259   HD13  LEU  31          HD13      LEU  31  -9.405  -4.394  -6.592
  260   HD21  LEU  31          HD21      LEU  31 -10.956  -2.058  -7.786
  261   HD22  LEU  31          HD22      LEU  31 -10.913  -0.965  -6.403
  262   HD23  LEU  31          HD23      LEU  31 -11.282  -2.673  -6.166
  263    H    ASP  32           H        ASP  32  -6.198  -0.569  -6.643
  264    HA   ASP  32           HA       ASP  32  -5.291  -2.994  -7.953
  265    HB2  ASP  32           HB2      ASP  32  -6.101  -0.893  -9.152
  266    HB3  ASP  32           HB3      ASP  32  -4.565  -0.201  -8.696
  267    H    CYS  33           H        CYS  33  -3.991  -0.152  -6.488
  268    HA   CYS  33           HA       CYS  33  -1.269  -0.869  -6.534
  269    HB2  CYS  33           HB2      CYS  33  -2.776   1.170  -4.925
  270    HB3  CYS  33           HB3      CYS  33  -1.045   0.958  -4.857
  271    H    GLU  34           H        GLU  34  -3.907  -1.252  -4.357
  272    HA   GLU  34           HA       GLU  34  -2.581  -1.924  -2.050
  273    HB2  GLU  34           HB2      GLU  34  -4.884  -1.505  -1.932
  274    HB3  GLU  34           HB3      GLU  34  -5.263  -2.635  -3.195
  275    HG2  GLU  34           HG2      GLU  34  -4.109  -3.757  -0.723
  276    HG3  GLU  34           HG3      GLU  34  -5.741  -3.109  -0.634
  277    H    ARG  35           H        ARG  35  -3.654  -3.984  -4.669
  278    HA   ARG  35           HA       ARG  35  -2.335  -6.270  -3.589
  279    HB2  ARG  35           HB2      ARG  35  -2.829  -7.395  -5.730
  280    HB3  ARG  35           HB3      ARG  35  -4.252  -6.634  -5.034
  281    HG2  ARG  35           HG2      ARG  35  -3.948  -4.740  -6.553
  282    HG3  ARG  35           HG3      ARG  35  -2.568  -5.550  -7.273
  283    HD2  ARG  35           HD2      ARG  35  -3.974  -7.321  -8.022
  284    HD3  ARG  35           HD3      ARG  35  -5.366  -6.638  -7.196
  285    HE   ARG  35           HE       ARG  35  -4.434  -4.678  -8.899
  286   HH11  ARG  35          HH11      ARG  35  -5.647  -7.942  -9.226
  287   HH12  ARG  35          HH12      ARG  35  -6.365  -7.652 -10.780
  288   HH21  ARG  35          HH21      ARG  35  -5.370  -4.278 -10.933
  289   HH22  ARG  35          HH22      ARG  35  -6.188  -5.574 -11.763
  290    H    LYS  36           H        LYS  36  -1.289  -3.689  -5.561
  291    HA   LYS  36           HA       LYS  36   0.669  -4.946  -7.116
  292    HB2  LYS  36           HB2      LYS  36   0.510  -2.137  -6.081
  293    HB3  LYS  36           HB3      LYS  36   1.659  -2.692  -7.248
  294    HG2  LYS  36           HG2      LYS  36  -0.372  -3.256  -8.686
  295    HG3  LYS  36           HG3      LYS  36  -1.258  -2.317  -7.547
  296    HD2  LYS  36           HD2      LYS  36  -0.723  -0.669  -8.898
  297    HD3  LYS  36           HD3      LYS  36   0.812  -0.690  -8.077
  298    HE2  LYS  36           HE2      LYS  36   1.714  -2.164  -9.793
  299    HE3  LYS  36           HE3      LYS  36   0.160  -2.169 -10.619
  300    HZ1  LYS  36           HZ1      LYS  36   0.402   0.244 -10.938
  301    HZ2  LYS  36           HZ2      LYS  36   1.626  -0.635 -11.698
  302    HZ3  LYS  36           HZ3      LYS  36   1.947   0.172 -10.252
  303    H    VAL  37           H        VAL  37   0.547  -3.404  -4.099
  304    HA   VAL  37           HA       VAL  37   3.163  -2.784  -3.679
  305    HB   VAL  37           HB       VAL  37   2.533  -2.718  -1.256
  306   HG11  VAL  37          HG11      VAL  37   1.594  -0.687  -1.589
  307   HG12  VAL  37          HG12      VAL  37   0.268  -1.364  -2.541
  308   HG13  VAL  37          HG13      VAL  37   1.831  -1.037  -3.309
  309   HG21  VAL  37          HG21      VAL  37  -0.065  -2.927  -1.033
  310   HG22  VAL  37          HG22      VAL  37   0.977  -4.336  -0.854
  311   HG23  VAL  37          HG23      VAL  37   0.120  -4.060  -2.379
  312    H    ILE  38           H        ILE  38   1.451  -5.643  -2.406
  313    HA   ILE  38           HA       ILE  38   3.881  -6.610  -1.225
  314    HB   ILE  38           HB       ILE  38   2.573  -8.769  -0.936
  315   HG12  ILE  38          HG12      ILE  38   0.052  -7.362  -0.966
  316   HG13  ILE  38          HG13      ILE  38   0.730  -7.423  -2.570
  317   HG21  ILE  38          HG21      ILE  38   1.620  -7.919   1.077
  318   HG22  ILE  38          HG22      ILE  38   1.554  -6.284   0.418
  319   HG23  ILE  38          HG23      ILE  38   3.110  -7.037   0.759
  320   HD11  ILE  38          HD11      ILE  38   0.816  -9.806  -2.521
  321   HD12  ILE  38          HD12      ILE  38  -0.795  -9.310  -1.998
  322   HD13  ILE  38          HD13      ILE  38   0.397  -9.830  -0.811
  323    H    SER  39           H        SER  39   2.135  -6.981  -4.161
  324    HA   SER  39           HA       SER  39   3.345  -9.369  -5.001
  325    HB2  SER  39           HB2      SER  39   1.291  -8.367  -6.044
  326    HB3  SER  39           HB3      SER  39   2.309  -7.123  -6.766
  327    HG   SER  39           HG       SER  39   3.496  -9.188  -7.553
  328    H    THR  40           H        THR  40   4.260  -6.069  -4.923
  329    HA   THR  40           HA       THR  40   6.597  -6.253  -6.591
  330    HB   THR  40           HB       THR  40   5.607  -4.115  -4.694
  331    HG1  THR  40           HG1      THR  40   4.231  -4.418  -6.460
  332   HG21  THR  40          HG21      THR  40   7.152  -2.595  -5.725
  333   HG22  THR  40          HG22      THR  40   7.714  -3.847  -6.836
  334   HG23  THR  40          HG23      THR  40   8.057  -3.981  -5.111
  335    H    SER  41           H        SER  41   5.902  -6.175  -3.110
  336    HA   SER  41           HA       SER  41   8.655  -5.843  -2.356
  337    HB2  SER  41           HB2      SER  41   7.717  -6.104  -0.045
  338    HB3  SER  41           HB3      SER  41   6.951  -4.836  -1.001
  339    HG   SER  41           HG       SER  41   5.451  -6.230   0.118
  340    H    THR  42           H        THR  42   6.613  -8.565  -2.911
  341    HA   THR  42           HA       THR  42   7.777 -10.278  -0.965
  342    HB   THR  42           HB       THR  42   6.553 -12.087  -2.272
  343    HG1  THR  42           HG1      THR  42   5.129 -10.028  -3.525
  344   HG21  THR  42          HG21      THR  42   5.622 -11.011  -0.285
  345   HG22  THR  42          HG22      THR  42   4.358 -11.303  -1.481
  346   HG23  THR  42          HG23      THR  42   5.021  -9.678  -1.277
  347    H    SER  43           H        SER  43   9.370  -9.025  -3.370
  348    HA   SER  43           HA       SER  43  10.820 -11.465  -4.093
  349    HB2  SER  43           HB2      SER  43  10.241  -9.810  -5.888
  350    HB3  SER  43           HB3      SER  43  11.258  -8.627  -5.069
  351    HG   SER  43           HG       SER  43  13.025 -10.093  -5.369
  352    H    ASP  44           H        ASP  44  10.749  -9.067  -1.784
  353    HA   ASP  44           HA       ASP  44  13.635  -9.226  -1.230
  354    HB2  ASP  44           HB2      ASP  44  11.539  -7.297  -0.200
  355    HB3  ASP  44           HB3      ASP  44  13.230  -7.292   0.285
  356    HA   PRO  45           HA       PRO  45  12.249 -12.146   1.903
  357    HB2  PRO  45           HB2      PRO  45  15.095 -12.460   2.465
  358    HB3  PRO  45           HB3      PRO  45  13.961 -13.639   1.844
  359    HG2  PRO  45           HG2      PRO  45  15.917 -12.611   0.381
  360    HG3  PRO  45           HG3      PRO  45  14.392 -13.151  -0.311
  361    HD2  PRO  45           HD2      PRO  45  15.339 -10.375   0.246
  362    HD3  PRO  45           HD3      PRO  45  14.353 -10.989  -1.097
  363    H    ASP  46           H        ASP  46  15.245 -10.384   2.753
  364    HA   ASP  46           HA       ASP  46  13.991  -9.717   5.329
  365    HB2  ASP  46           HB2      ASP  46  16.159  -9.862   6.349
  366    HB3  ASP  46           HB3      ASP  46  15.889 -11.338   5.440
  367    H    TYR  47           H        TYR  47  15.732  -7.891   6.306
  368    HA   TYR  47           HA       TYR  47  15.420  -5.690   4.386
  369    HB2  TYR  47           HB2      TYR  47  14.884  -4.255   6.341
  370    HB3  TYR  47           HB3      TYR  47  13.705  -5.530   6.070
  371    HD1  TYR  47           HD1      TYR  47  15.975  -4.039   8.411
  372    HD2  TYR  47           HD2      TYR  47  13.840  -7.610   7.529
  373    HE1  TYR  47           HE1      TYR  47  16.248  -4.771  10.743
  374    HE2  TYR  47           HE2      TYR  47  14.103  -8.349   9.858
  375    HH   TYR  47           HH       TYR  47  15.544  -7.966  11.749
  376    H    ALA  48           H        ALA  48  17.836  -7.363   5.185
  377    HA   ALA  48           HA       ALA  48  19.518  -5.105   6.058
  378    HB1  ALA  48           HB1      ALA  48  20.095  -8.053   6.319
  379    HB2  ALA  48           HB2      ALA  48  19.569  -6.987   7.621
  380    HB3  ALA  48           HB3      ALA  48  21.139  -6.739   6.858
  381    H1   SER   0           H1       SER   0  -1.979  14.726   4.594
  382    H2   SER   0           H2       SER   0  -0.398  14.381   4.112
  383    H3   SER   0           H3       SER   0  -1.668  14.240   3.001
  384    HA   SER   0           HA       SER   0  -2.073  16.583   3.085
  385    HB2  SER   0           HB2      SER   0   0.342  16.711   4.904
  386    HB3  SER   0           HB3      SER   0  -0.623  18.073   4.345
  387    HG   SER   0           HG       SER   0  -1.129  17.284   6.502
  388    H    MET   1           H        MET   1   1.336  15.498   3.370
  389    HA   MET   1           HA       MET   1   1.690  16.078   0.528
  390    HB2  MET   1           HB2      MET   1   3.707  17.396   0.920
  391    HB3  MET   1           HB3      MET   1   2.316  18.154   1.680
  392    HG2  MET   1           HG2      MET   1   3.006  17.267   3.844
  393    HG3  MET   1           HG3      MET   1   4.393  16.488   3.084
  394    HE1  MET   1           HE1      MET   1   4.689  18.366   5.598
  395    HE2  MET   1           HE2      MET   1   6.085  19.339   5.132
  396    HE3  MET   1           HE3      MET   1   6.056  17.611   4.779
  397    H    ASP   2           H        ASP   2   3.466  15.033  -0.417
  398    HA   ASP   2           HA       ASP   2   4.785  12.998   1.252
  399    HB2  ASP   2           HB2      ASP   2   4.612  11.413  -0.636
  400    HB3  ASP   2           HB3      ASP   2   3.026  11.906  -0.055
  401    H    GLU   3           H        GLU   3   6.950  12.664   0.835
  402    HA   GLU   3           HA       GLU   3   8.214  13.946  -1.428
  403    HB2  GLU   3           HB2      GLU   3   7.854  15.754   0.293
  404    HB3  GLU   3           HB3      GLU   3   8.917  14.857   1.366
  405    HG2  GLU   3           HG2      GLU   3  10.741  15.096  -0.245
  406    HG3  GLU   3           HG3      GLU   3   9.671  16.005  -1.312
  407    H    THR   4           H        THR   4  10.550  13.548  -1.479
  408    HA   THR   4           HA       THR   4  11.391  11.228   0.138
  409    HB   THR   4           HB       THR   4  12.114  11.867  -2.728
  410    HG1  THR   4           HG1      THR   4  10.059  10.940  -2.572
  411   HG21  THR   4          HG21      THR   4  14.013  10.893  -1.643
  412   HG22  THR   4          HG22      THR   4  13.249   9.638  -2.621
  413   HG23  THR   4          HG23      THR   4  13.002   9.670  -0.874
  414    H    VAL   5           H        VAL   5  13.150  11.609   1.386
  415    HA   VAL   5           HA       VAL   5  14.857  13.891   0.642
  416    HB   VAL   5           HB       VAL   5  14.584  12.718   3.410
  417   HG11  VAL   5          HG11      VAL   5  16.692  13.867   2.989
  418   HG12  VAL   5          HG12      VAL   5  15.691  14.787   4.110
  419   HG13  VAL   5          HG13      VAL   5  15.816  15.290   2.426
  420   HG21  VAL   5          HG21      VAL   5  13.217  14.667   3.962
  421   HG22  VAL   5          HG22      VAL   5  12.451  13.688   2.712
  422   HG23  VAL   5          HG23      VAL   5  13.270  15.188   2.280
  423    H    LYS   6           H        LYS   6  15.935  12.415  -0.791
  424    HA   LYS   6           HA       LYS   6  17.785  11.282  -1.401
  425    HB2  LYS   6           HB2      LYS   6  18.643  11.647   1.443
  426    HB3  LYS   6           HB3      LYS   6  19.686  11.178   0.120
  427    HG2  LYS   6           HG2      LYS   6  19.328  13.309  -0.934
  428    HG3  LYS   6           HG3      LYS   6  18.199  13.782   0.331
  429    HD2  LYS   6           HD2      LYS   6  20.032  13.544   1.975
  430    HD3  LYS   6           HD3      LYS   6  21.141  13.207   0.651
  431    HE2  LYS   6           HE2      LYS   6  20.647  15.397  -0.298
  432    HE3  LYS   6           HE3      LYS   6  19.541  15.732   1.029
  433    HZ1  LYS   6           HZ1      LYS   6  22.460  15.251   1.276
  434    HZ2  LYS   6           HZ2      LYS   6  21.403  15.546   2.563
  435    HZ3  LYS   6           HZ3      LYS   6  21.686  16.751   1.409
  436    H    LEU   7           H        LEU   7  17.939  10.014   1.882
  437    HA   LEU   7           HA       LEU   7  17.975   7.352   0.753
  438    HB2  LEU   7           HB2      LEU   7  18.754   6.574   2.854
  439    HB3  LEU   7           HB3      LEU   7  19.619   8.041   2.487
  440    HG   LEU   7           HG       LEU   7  17.244   8.019   4.332
  441   HD11  LEU   7          HD11      LEU   7  18.889   6.418   5.184
  442   HD12  LEU   7          HD12      LEU   7  18.818   7.864   6.189
  443   HD13  LEU   7          HD13      LEU   7  20.150   7.645   5.055
  444   HD21  LEU   7          HD21      LEU   7  17.873  10.189   3.546
  445   HD22  LEU   7          HD22      LEU   7  19.570   9.872   3.896
  446   HD23  LEU   7          HD23      LEU   7  18.411  10.026   5.217
  447    H    ASN   8           H        ASN   8  15.916   9.258   2.906
  448    HA   ASN   8           HA       ASN   8  14.150   6.994   3.316
  449    HB2  ASN   8           HB2      ASN   8  12.640   8.757   4.393
  450    HB3  ASN   8           HB3      ASN   8  14.132   8.437   5.225
  451   HD21  ASN   8          HD21      ASN   8  15.629  10.036   5.388
  452   HD22  ASN   8          HD22      ASN   8  15.309  11.654   4.882
  453    H    HIS   9           H        HIS   9  12.163   6.743   2.495
  454    HA   HIS   9           HA       HIS   9  11.109   8.845   0.727
  455    HB2  HIS   9           HB2      HIS   9  10.610   5.851   0.643
  456    HB3  HIS   9           HB3      HIS   9   9.752   7.034  -0.332
  457    HD1  HIS   9           HD1      HIS   9  13.143   5.414   0.021
  458    HD2  HIS   9           HD2      HIS   9  11.057   7.867  -2.606
  459    HE1  HIS   9           HE1      HIS   9  14.552   5.536  -2.055
  460    HE2  HIS   9           HE2      HIS   9  13.369   7.189  -3.537
  461    H    THR  10           H        THR  10   9.205   9.717   1.485
  462    HA   THR  10           HA       THR  10   8.483   8.987   4.157
  463    HB   THR  10           HB       THR  10   6.994  10.887   2.324
  464    HG1  THR  10           HG1      THR  10   9.054  11.673   2.355
  465   HG21  THR  10          HG21      THR  10   5.856  10.283   4.441
  466   HG22  THR  10          HG22      THR  10   6.316  11.984   4.380
  467   HG23  THR  10          HG23      THR  10   7.271  10.848   5.333
  468    H    CYS  11           H        CYS  11   6.871   7.731   4.864
  469    HA   CYS  11           HA       CYS  11   5.460   6.072   3.037
  470    HB2  CYS  11           HB2      CYS  11   6.015   5.279   5.312
  471    HB3  CYS  11           HB3      CYS  11   4.964   6.508   6.001
  472    H    VAL  12           H        VAL  12   3.810   6.673   1.836
  473    HA   VAL  12           HA       VAL  12   2.251   8.970   2.099
  474    HB   VAL  12           HB       VAL  12   0.584   7.798   0.660
  475   HG11  VAL  12          HG11      VAL  12   3.463   7.516  -0.179
  476   HG12  VAL  12          HG12      VAL  12   2.432   8.931  -0.401
  477   HG13  VAL  12          HG13      VAL  12   2.076   7.432  -1.266
  478   HG21  VAL  12          HG21      VAL  12   2.443   5.445   0.973
  479   HG22  VAL  12          HG22      VAL  12   1.088   5.541  -0.152
  480   HG23  VAL  12          HG23      VAL  12   0.794   5.559   1.586
  481    H    ILE  13           H        ILE  13   2.292   6.226   3.999
  482    HA   ILE  13           HA       ILE  13  -0.476   6.447   4.866
  483    HB   ILE  13           HB       ILE  13   1.496   4.432   5.840
  484   HG12  ILE  13          HG12      ILE  13   1.460   4.473   3.334
  485   HG13  ILE  13          HG13      ILE  13   0.938   2.954   4.057
  486   HG21  ILE  13          HG21      ILE  13  -0.662   4.697   6.982
  487   HG22  ILE  13          HG22      ILE  13  -0.440   3.105   6.260
  488   HG23  ILE  13          HG23      ILE  13  -1.478   4.295   5.469
  489   HD11  ILE  13          HD11      ILE  13  -0.396   3.817   2.136
  490   HD12  ILE  13          HD12      ILE  13  -0.976   5.084   3.226
  491   HD13  ILE  13          HD13      ILE  13  -1.290   3.380   3.594
  492    H    CYS  14           H        CYS  14   2.719   6.073   6.322
  493    HA   CYS  14           HA       CYS  14   1.741   6.872   8.909
  494    HB2  CYS  14           HB2      CYS  14   4.479   6.194   7.961
  495    HB3  CYS  14           HB3      CYS  14   4.079   6.481   9.630
  496    H    ASP  15           H        ASP  15   3.155   8.437   6.233
  497    HA   ASP  15           HA       ASP  15   3.906  10.536   5.829
  498    HB2  ASP  15           HB2      ASP  15   1.867  11.057   7.167
  499    HB3  ASP  15           HB3      ASP  15   2.899  11.258   8.569
  500    H    GLN  16           H        GLN  16   5.517   8.587   7.003
  501    HA   GLN  16           HA       GLN  16   7.475  10.164   8.511
  502    HB2  GLN  16           HB2      GLN  16   6.879   7.216   8.743
  503    HB3  GLN  16           HB3      GLN  16   8.159   8.058   9.595
  504    HG2  GLN  16           HG2      GLN  16   5.242   8.613   9.878
  505    HG3  GLN  16           HG3      GLN  16   6.209   7.680  10.999
  506   HE21  GLN  16          HE21      GLN  16   4.673  10.090  11.444
  507   HE22  GLN  16          HE22      GLN  16   5.789  11.252  12.055
  508    H    GLU  17           H        GLU  17   9.547  10.028   7.956
  509    HA   GLU  17           HA       GLU  17  10.279   9.290   5.301
  510    HB2  GLU  17           HB2      GLU  17  11.883  10.305   7.639
  511    HB3  GLU  17           HB3      GLU  17  12.497  10.146   5.999
  512    HG2  GLU  17           HG2      GLU  17  11.180  11.859   5.210
  513    HG3  GLU  17           HG3      GLU  17  10.043  11.717   6.533
  514    H    LYS  18           H        LYS  18  10.223   7.181   4.977
  515    HA   LYS  18           HA       LYS  18  11.901   5.476   6.689
  516    HB2  LYS  18           HB2      LYS  18   9.823   4.374   4.909
  517    HB3  LYS  18           HB3      LYS  18  10.514   3.670   6.335
  518    HG2  LYS  18           HG2      LYS  18   8.423   5.794   6.140
  519    HG3  LYS  18           HG3      LYS  18   8.314   4.206   6.897
  520    HD2  LYS  18           HD2      LYS  18  10.312   6.129   7.929
  521    HD3  LYS  18           HD3      LYS  18   8.632   6.400   8.304
  522    HE2  LYS  18           HE2      LYS  18   9.808   5.172  10.053
  523    HE3  LYS  18           HE3      LYS  18   8.498   4.269   9.338
  524    HZ1  LYS  18           HZ1      LYS  18  10.455   2.896   9.693
  525    HZ2  LYS  18           HZ2      LYS  18  11.362   3.908   8.687
  526    HZ3  LYS  18           HZ3      LYS  18  10.084   3.005   8.049
  527    H    ASN  19           H        ASN  19  13.564   4.408   5.774
  528    HA   ASN  19           HA       ASN  19  13.893   4.782   2.898
  529    HB2  ASN  19           HB2      ASN  19  16.231   4.121   3.253
  530    HB3  ASN  19           HB3      ASN  19  15.776   5.475   4.264
  531   HD21  ASN  19          HD21      ASN  19  17.547   5.037   5.596
  532   HD22  ASN  19          HD22      ASN  19  17.501   3.726   6.766
  533    H    ARG  20           H        ARG  20  12.399   2.620   4.720
  534    HA   ARG  20           HA       ARG  20  13.080   0.399   2.932
  535    HB2  ARG  20           HB2      ARG  20  12.789   0.329   5.921
  536    HB3  ARG  20           HB3      ARG  20  12.681  -1.115   4.959
  537    HG2  ARG  20           HG2      ARG  20  14.904  -0.791   4.140
  538    HG3  ARG  20           HG3      ARG  20  15.038   0.711   5.047
  539    HD2  ARG  20           HD2      ARG  20  14.568  -0.569   7.040
  540    HD3  ARG  20           HD3      ARG  20  14.608  -2.044   6.125
  541    HE   ARG  20           HE       ARG  20  16.984  -0.986   5.517
  542   HH11  ARG  20          HH11      ARG  20  15.432  -1.442   8.628
  543   HH12  ARG  20          HH12      ARG  20  16.927  -1.657   9.479
  544   HH21  ARG  20          HH21      ARG  20  18.947  -1.277   6.637
  545   HH22  ARG  20          HH22      ARG  20  18.921  -1.571   8.348
  546    H    GLY  21           H        GLY  21  11.446  -0.080   1.775
  547    HA2  GLY  21           HA2      GLY  21   9.003  -1.070   2.462
  548    HA3  GLY  21           HA3      GLY  21   8.725   0.660   2.337
  549    H    ILE  22           H        ILE  22   7.383   0.225   0.296
  550    HA   ILE  22           HA       ILE  22   9.206  -0.388  -1.914
  551    HB   ILE  22           HB       ILE  22   7.634  -1.601  -3.026
  552   HG12  ILE  22          HG12      ILE  22   5.502  -0.241  -1.416
  553   HG13  ILE  22          HG13      ILE  22   5.997   0.236  -3.006
  554   HG21  ILE  22          HG21      ILE  22   6.926  -1.944  -0.118
  555   HG22  ILE  22          HG22      ILE  22   8.110  -2.863  -1.054
  556   HG23  ILE  22          HG23      ILE  22   6.388  -3.026  -1.403
  557   HD11  ILE  22          HD11      ILE  22   5.357  -2.066  -3.773
  558   HD12  ILE  22          HD12      ILE  22   4.030  -1.006  -3.288
  559   HD13  ILE  22          HD13      ILE  22   4.606  -2.275  -2.186
  560    H    HIS  23           H        HIS  23   7.863   0.301  -3.995
  561    HA   HIS  23           HA       HIS  23   6.820   2.971  -3.804
  562    HB2  HIS  23           HB2      HIS  23   8.537   3.973  -5.296
  563    HB3  HIS  23           HB3      HIS  23   9.197   3.496  -3.751
  564    HD1  HIS  23           HD1      HIS  23   9.577   3.001  -7.381
  565    HD2  HIS  23           HD2      HIS  23  10.860   1.233  -3.873
  566    HE1  HIS  23           HE1      HIS  23  11.495   1.523  -8.044
  567    HE2  HIS  23           HE2      HIS  23  12.125   0.306  -5.931
  568    H    LEU  24           H        LEU  24   5.082   2.764  -5.037
  569    HA   LEU  24           HA       LEU  24   4.939   0.844  -7.184
  570    HB2  LEU  24           HB2      LEU  24   3.067   2.535  -5.699
  571    HB3  LEU  24           HB3      LEU  24   2.694   2.382  -7.379
  572    HG   LEU  24           HG       LEU  24   1.988   0.273  -7.163
  573   HD11  LEU  24          HD11      LEU  24   4.117  -0.206  -5.165
  574   HD12  LEU  24          HD12      LEU  24   4.024  -0.777  -6.834
  575   HD13  LEU  24          HD13      LEU  24   2.896  -1.394  -5.627
  576   HD21  LEU  24          HD21      LEU  24   1.930   0.838  -4.247
  577   HD22  LEU  24          HD22      LEU  24   0.833  -0.181  -5.190
  578   HD23  LEU  24          HD23      LEU  24   0.826   1.566  -5.412
  579    H    TYR  25           H        TYR  25   4.228   4.294  -7.005
  580    HA   TYR  25           HA       TYR  25   4.893   4.510  -9.835
  581    HB2  TYR  25           HB2      TYR  25   3.241   6.380  -8.175
  582    HB3  TYR  25           HB3      TYR  25   3.466   6.481  -9.910
  583    HD1  TYR  25           HD1      TYR  25   0.747   6.532  -9.551
  584    HD2  TYR  25           HD2      TYR  25   3.235   3.114  -9.043
  585    HE1  TYR  25           HE1      TYR  25  -1.210   5.058  -9.845
  586    HE2  TYR  25           HE2      TYR  25   1.327   1.644  -9.298
  587    HH   TYR  25           HH       TYR  25  -1.703   2.786 -10.489
  588    H    THR  26           H        THR  26   4.719   7.438  -8.133
  589    HA   THR  26           HA       THR  26   7.636   7.490  -7.835
  590    HB   THR  26           HB       THR  26   7.111   9.270  -9.235
  591    HG1  THR  26           HG1      THR  26   7.567   9.966  -6.613
  592   HG21  THR  26          HG21      THR  26   5.213  10.713  -9.062
  593   HG22  THR  26          HG22      THR  26   4.786  10.045  -7.490
  594   HG23  THR  26          HG23      THR  26   4.654   9.040  -8.937
  595    H    LYS  27           H        LYS  27   5.412   6.407  -6.006
  596    HA   LYS  27           HA       LYS  27   5.795   8.171  -3.670
  597    HB2  LYS  27           HB2      LYS  27   3.678   6.179  -3.448
  598    HB3  LYS  27           HB3      LYS  27   3.660   7.886  -3.047
  599    HG2  LYS  27           HG2      LYS  27   3.397   6.778  -5.804
  600    HG3  LYS  27           HG3      LYS  27   2.055   7.235  -4.777
  601    HD2  LYS  27           HD2      LYS  27   4.137   9.001  -6.003
  602    HD3  LYS  27           HD3      LYS  27   2.386   9.064  -6.210
  603    HE2  LYS  27           HE2      LYS  27   2.362   9.496  -3.652
  604    HE3  LYS  27           HE3      LYS  27   4.057   9.926  -3.886
  605    HZ1  LYS  27           HZ1      LYS  27   2.722  11.255  -5.881
  606    HZ2  LYS  27           HZ2      LYS  27   3.343  11.933  -4.460
  607    HZ3  LYS  27           HZ3      LYS  27   1.729  11.441  -4.525
  608    H    PHE  28           H        PHE  28   5.046   6.706  -1.673
  609    HA   PHE  28           HA       PHE  28   6.594   4.239  -1.627
  610    HB2  PHE  28           HB2      PHE  28   8.284   5.882  -1.141
  611    HB3  PHE  28           HB3      PHE  28   7.250   6.669   0.040
  612    HD1  PHE  28           HD1      PHE  28   7.057   5.866   2.245
  613    HD2  PHE  28           HD2      PHE  28   9.319   3.676  -0.600
  614    HE1  PHE  28           HE1      PHE  28   7.989   4.508   4.059
  615    HE2  PHE  28           HE2      PHE  28  10.266   2.305   1.212
  616    HZ   PHE  28           HZ       PHE  28   9.594   2.714   3.558
  617    H    ILE  29           H        ILE  29   5.480   2.788  -0.555
  618    HA   ILE  29           HA       ILE  29   3.957   3.607   1.839
  619    HB   ILE  29           HB       ILE  29   3.861   0.968   0.340
  620   HG12  ILE  29          HG12      ILE  29   1.340   1.757   0.194
  621   HG13  ILE  29          HG13      ILE  29   2.051   3.357   0.357
  622   HG21  ILE  29          HG21      ILE  29   2.287   1.889   2.736
  623   HG22  ILE  29          HG22      ILE  29   3.602   0.708   2.754
  624   HG23  ILE  29          HG23      ILE  29   2.097   0.350   1.896
  625   HD11  ILE  29          HD11      ILE  29   3.309   3.081  -1.639
  626   HD12  ILE  29          HD12      ILE  29   1.647   2.593  -1.977
  627   HD13  ILE  29          HD13      ILE  29   2.891   1.371  -1.732
  628    H    CYS  30           H        CYS  30   4.957   3.147   3.776
  629    HA   CYS  30           HA       CYS  30   7.519   1.954   3.792
  630    HB2  CYS  30           HB2      CYS  30   7.576   2.265   6.097
  631    HB3  CYS  30           HB3      CYS  30   6.470   3.517   5.583
  632    H    LEU  31           H        LEU  31   8.177   0.066   4.672
  633    HA   LEU  31           HA       LEU  31   7.051  -2.125   3.520
  634    HB2  LEU  31           HB2      LEU  31   8.836  -3.268   4.389
  635    HB3  LEU  31           HB3      LEU  31   9.415  -1.638   4.354
  636    HG   LEU  31           HG       LEU  31   8.557  -1.643   6.862
  637   HD11  LEU  31          HD11      LEU  31   7.668  -3.906   6.826
  638   HD12  LEU  31          HD12      LEU  31   9.025  -3.789   7.946
  639   HD13  LEU  31          HD13      LEU  31   9.249  -4.537   6.365
  640   HD21  LEU  31          HD21      LEU  31  10.840  -2.222   7.550
  641   HD22  LEU  31          HD22      LEU  31  10.816  -1.134   6.162
  642   HD23  LEU  31          HD23      LEU  31  11.157  -2.848   5.931
  643    H    ASP  32           H        ASP  32   6.108  -0.659   6.401
  644    HA   ASP  32           HA       ASP  32   5.162  -3.060   7.723
  645    HB2  ASP  32           HB2      ASP  32   6.010  -0.969   8.910
  646    HB3  ASP  32           HB3      ASP  32   4.486  -0.251   8.453
  647    H    CYS  33           H        CYS  33   3.911  -0.203   6.246
  648    HA   CYS  33           HA       CYS  33   1.177  -0.873   6.296
  649    HB2  CYS  33           HB2      CYS  33   2.717   1.135   4.680
  650    HB3  CYS  33           HB3      CYS  33   0.982   0.952   4.613
  651    H    GLU  34           H        GLU  34   3.806  -1.309   4.120
  652    HA   GLU  34           HA       GLU  34   2.465  -1.965   1.817
  653    HB2  GLU  34           HB2      GLU  34   4.776  -1.583   1.694
  654    HB3  GLU  34           HB3      GLU  34   5.136  -2.715   2.961
  655    HG2  GLU  34           HG2      GLU  34   3.960  -3.827   0.495
  656    HG3  GLU  34           HG3      GLU  34   5.604  -3.210   0.402
  657    H    ARG  35           H        ARG  35   3.507  -4.034   4.440
  658    HA   ARG  35           HA       ARG  35   2.150  -6.301   3.371
  659    HB2  ARG  35           HB2      ARG  35   2.626  -7.427   5.516
  660    HB3  ARG  35           HB3      ARG  35   4.062  -6.695   4.812
  661    HG2  ARG  35           HG2      ARG  35   3.791  -4.777   6.323
  662    HG3  ARG  35           HG3      ARG  35   2.411  -5.579   7.048
  663    HD2  ARG  35           HD2      ARG  35   3.778  -7.381   7.813
  664    HD3  ARG  35           HD3      ARG  35   5.165  -6.704   6.975
  665    HE   ARG  35           HE       ARG  35   4.280  -4.729   8.673
  666   HH11  ARG  35          HH11      ARG  35   5.444  -8.004   9.018
  667   HH12  ARG  35          HH12      ARG  35   6.156  -7.723  10.573
  668   HH21  ARG  35          HH21      ARG  35   5.216  -4.335  10.712
  669   HH22  ARG  35          HH22      ARG  35   6.012  -5.642  11.548
  670    H    LYS  36           H        LYS  36   1.147  -3.694   5.334
  671    HA   LYS  36           HA       LYS  36  -0.832  -4.913   6.894
  672    HB2  LYS  36           HB2      LYS  36  -0.623  -2.112   5.849
  673    HB3  LYS  36           HB3      LYS  36  -1.783  -2.641   7.018
  674    HG2  LYS  36           HG2      LYS  36   0.241  -3.238   8.458
  675    HG3  LYS  36           HG3      LYS  36   1.140  -2.317   7.317
  676    HD2  LYS  36           HD2      LYS  36   0.631  -0.654   8.661
  677    HD3  LYS  36           HD3      LYS  36  -0.905  -0.653   7.842
  678    HE2  LYS  36           HE2      LYS  36  -1.828  -2.109   9.566
  679    HE3  LYS  36           HE3      LYS  36  -0.272  -2.135  10.390
  680    HZ1  LYS  36           HZ1      LYS  36  -0.474   0.281  10.703
  681    HZ2  LYS  36           HZ2      LYS  36  -1.716  -0.576  11.465
  682    HZ3  LYS  36           HZ3      LYS  36  -2.020   0.231  10.015
  683    H    VAL  37           H        VAL  37  -0.687  -3.382   3.873
  684    HA   VAL  37           HA       VAL  37  -3.290  -2.721   3.453
  685    HB   VAL  37           HB       VAL  37  -2.663  -2.672   1.026
  686   HG11  VAL  37          HG11      VAL  37  -1.686  -0.657   1.354
  687   HG12  VAL  37          HG12      VAL  37  -0.371  -1.355   2.307
  688   HG13  VAL  37          HG13      VAL  37  -1.928  -0.997   3.075
  689   HG21  VAL  37          HG21      VAL  37  -0.068  -2.928   0.803
  690   HG22  VAL  37          HG22      VAL  37  -1.134  -4.319   0.632
  691   HG23  VAL  37          HG23      VAL  37  -0.271  -4.053   2.154
  692    H    ILE  38           H        ILE  38  -1.630  -5.612   2.188
  693    HA   ILE  38           HA       ILE  38  -4.076  -6.542   1.012
  694    HB   ILE  38           HB       ILE  38  -2.806  -8.725   0.731
  695   HG12  ILE  38          HG12      ILE  38  -0.261  -7.362   0.752
  696   HG13  ILE  38          HG13      ILE  38  -0.939  -7.404   2.357
  697   HG21  ILE  38          HG21      ILE  38  -1.840  -7.897  -1.286
  698   HG22  ILE  38          HG22      ILE  38  -1.748  -6.262  -0.635
  699   HG23  ILE  38          HG23      ILE  38  -3.316  -6.992  -0.972
  700   HD11  ILE  38          HD11      ILE  38  -1.065  -9.785   2.319
  701   HD12  ILE  38          HD12      ILE  38   0.554  -9.320   1.790
  702   HD13  ILE  38          HD13      ILE  38  -0.650  -9.824   0.607
  703    H    SER  39           H        SER  39  -2.336  -6.928   3.951
  704    HA   SER  39           HA       SER  39  -3.588  -9.291   4.799
  705    HB2  SER  39           HB2      SER  39  -1.513  -8.329   5.837
  706    HB3  SER  39           HB3      SER  39  -2.507  -7.062   6.555
  707    HG   SER  39           HG       SER  39  -3.735  -9.111   7.341
  708    H    THR  40           H        THR  40  -4.442  -5.977   4.709
  709    HA   THR  40           HA       THR  40  -6.782  -6.113   6.379
  710    HB   THR  40           HB       THR  40  -5.760  -4.002   4.466
  711    HG1  THR  40           HG1      THR  40  -4.397  -4.347   6.262
  712   HG21  THR  40          HG21      THR  40  -7.276  -2.454   5.495
  713   HG22  THR  40          HG22      THR  40  -7.855  -3.690   6.612
  714   HG23  THR  40          HG23      THR  40  -8.204  -3.826   4.888
  715    H    SER  41           H        SER  41  -6.087  -6.066   2.896
  716    HA   SER  41           HA       SER  41  -8.832  -5.688   2.145
  717    HB2  SER  41           HB2      SER  41  -7.896  -5.977  -0.167
  718    HB3  SER  41           HB3      SER  41  -7.119  -4.714   0.785
  719    HG   SER  41           HG       SER  41  -5.643  -6.158  -0.332
  720    H    THR  42           H        THR  42  -6.839  -8.445   2.705
  721    HA   THR  42           HA       THR  42  -8.039 -10.145   0.767
  722    HB   THR  42           HB       THR  42  -6.848 -11.972   2.076
  723    HG1  THR  42           HG1      THR  42  -5.381  -9.949   3.335
  724   HG21  THR  42          HG21      THR  42  -5.891 -10.915   0.091
  725   HG22  THR  42          HG22      THR  42  -4.634 -11.224   1.290
  726   HG23  THR  42          HG23      THR  42  -5.271  -9.589   1.080
  727    H    SER  43           H        SER  43  -9.605  -8.855   3.169
  728    HA   SER  43           HA       SER  43 -11.097 -11.263   3.904
  729    HB2  SER  43           HB2      SER  43 -10.486  -9.612   5.691
  730    HB3  SER  43           HB3      SER  43 -11.481  -8.414   4.867
  731    HG   SER  43           HG       SER  43 -13.273  -9.858   5.168
  732    H    ASP  44           H        ASP  44 -10.983  -8.882   1.582
  733    HA   ASP  44           HA       ASP  44 -13.871  -8.991   1.030
  734    HB2  ASP  44           HB2      ASP  44 -11.744  -7.102  -0.008
  735    HB3  ASP  44           HB3      ASP  44 -13.435  -7.072  -0.493
  736    HA   PRO  45           HA       PRO  45 -12.537 -11.936  -2.093
  737    HB2  PRO  45           HB2      PRO  45 -15.375 -12.241  -2.617
  738    HB3  PRO  45           HB3      PRO  45 -14.246 -13.413  -2.003
  739    HG2  PRO  45           HG2      PRO  45 -16.240 -12.306  -0.576
  740    HG3  PRO  45           HG3      PRO  45 -14.738 -12.888   0.080
  741    HD2  PRO  45           HD2      PRO  45 -15.585 -10.120  -0.420
  742    HD3  PRO  45           HD3      PRO  45 -14.608 -10.762   0.906
  743    H    ASP  46           H        ASP  46 -15.506 -10.132  -2.946
  744    HA   ASP  46           HA       ASP  46 -14.243  -9.497  -5.524
  745    HB2  ASP  46           HB2      ASP  46 -16.412  -9.615  -6.543
  746    HB3  ASP  46           HB3      ASP  46 -16.169 -11.087  -5.622
  747    H    TYR  47           H        TYR  47 -15.957  -7.644  -6.510
  748    HA   TYR  47           HA       TYR  47 -15.607  -5.441  -4.598
  749    HB2  TYR  47           HB2      TYR  47 -15.042  -4.025  -6.558
  750    HB3  TYR  47           HB3      TYR  47 -13.887  -5.320  -6.280
  751    HD1  TYR  47           HD1      TYR  47 -16.131  -3.799  -8.625
  752    HD2  TYR  47           HD2      TYR  47 -14.058  -7.403  -7.731
  753    HE1  TYR  47           HE1      TYR  47 -16.418  -4.537 -10.953
  754    HE2  TYR  47           HE2      TYR  47 -14.338  -8.146 -10.059
  755    HH   TYR  47           HH       TYR  47 -15.763  -7.741 -11.955
  756    H    ALA  48           H        ALA  48 -18.047  -7.073  -5.385
  757    HA   ALA  48           HA       ALA  48 -19.697  -4.789  -6.257
  758    HB1  ALA  48           HB1      ALA  48 -20.320  -7.730  -6.513
  759    HB2  ALA  48           HB2      ALA  48 -19.779  -6.676  -7.818
  760    HB3  ALA  48           HB3      ALA  48 -21.343  -6.401  -7.055
  Start of MODEL    4
    1    H1   SER   0           H1       SER   0  -0.477  13.847  -7.851
    2    H2   SER   0           H2       SER   0  -0.897  12.870  -6.535
    3    H3   SER   0           H3       SER   0   0.710  13.360  -6.750
    4    HA   SER   0           HA       SER   0  -0.296  14.638  -5.012
    5    HB2  SER   0           HB2      SER   0   0.016  16.928  -6.089
    6    HB3  SER   0           HB3      SER   0   1.371  15.811  -6.252
    7    HG   SER   0           HG       SER   0  -0.330  16.844  -8.177
    8    H    MET   1           H        MET   1  -1.874  16.154  -4.339
    9    HA   MET   1           HA       MET   1  -3.905  17.127  -4.165
   10    HB2  MET   1           HB2      MET   1  -3.545  18.157  -6.323
   11    HB3  MET   1           HB3      MET   1  -4.062  16.692  -7.148
   12    HG2  MET   1           HG2      MET   1  -5.792  18.427  -7.138
   13    HG3  MET   1           HG3      MET   1  -6.307  16.959  -6.309
   14    HE1  MET   1           HE1      MET   1  -7.908  19.603  -5.987
   15    HE2  MET   1           HE2      MET   1  -8.149  19.697  -4.244
   16    HE3  MET   1           HE3      MET   1  -8.305  18.148  -5.074
   17    H    ASP   2           H        ASP   2  -4.973  15.777  -2.884
   18    HA   ASP   2           HA       ASP   2  -6.512  13.627  -4.167
   19    HB2  ASP   2           HB2      ASP   2  -6.617  12.522  -1.997
   20    HB3  ASP   2           HB3      ASP   2  -4.940  12.826  -2.432
   21    H    GLU   3           H        GLU   3  -8.706  13.427  -3.699
   22    HA   GLU   3           HA       GLU   3  -9.939  15.592  -2.172
   23    HB2  GLU   3           HB2      GLU   3  -9.782  16.304  -4.568
   24    HB3  GLU   3           HB3      GLU   3 -10.775  14.918  -4.996
   25    HG2  GLU   3           HG2      GLU   3 -12.640  15.791  -3.794
   26    HG3  GLU   3           HG3      GLU   3 -11.655  17.080  -3.103
   27    H    THR   4           H        THR   4 -10.255  13.805  -0.731
   28    HA   THR   4           HA       THR   4 -12.227  11.816  -1.572
   29    HB   THR   4           HB       THR   4 -10.637  12.017   0.989
   30    HG1  THR   4           HG1      THR   4  -9.137  11.025  -0.121
   31   HG21  THR   4          HG21      THR   4 -12.498   9.901  -0.079
   32   HG22  THR   4          HG22      THR   4 -12.684  10.838   1.403
   33   HG23  THR   4          HG23      THR   4 -11.390   9.647   1.270
   34    H    VAL   5           H        VAL   5 -14.211  12.721  -1.522
   35    HA   VAL   5           HA       VAL   5 -14.966  14.514   0.625
   36    HB   VAL   5           HB       VAL   5 -16.658  13.445  -1.641
   37   HG11  VAL   5          HG11      VAL   5 -17.980  14.241   0.245
   38   HG12  VAL   5          HG12      VAL   5 -18.136  15.325  -1.137
   39   HG13  VAL   5          HG13      VAL   5 -17.105  15.773   0.222
   40   HG21  VAL   5          HG21      VAL   5 -14.751  14.712  -2.483
   41   HG22  VAL   5          HG22      VAL   5 -15.161  16.054  -1.414
   42   HG23  VAL   5          HG23      VAL   5 -16.254  15.602  -2.723
   43    H    LYS   6           H        LYS   6 -16.253  11.459  -0.697
   44    HA   LYS   6           HA       LYS   6 -16.593  10.306   1.873
   45    HB2  LYS   6           HB2      LYS   6 -18.466  11.863   1.988
   46    HB3  LYS   6           HB3      LYS   6 -19.077  11.235   0.476
   47    HG2  LYS   6           HG2      LYS   6 -19.391   9.039   1.522
   48    HG3  LYS   6           HG3      LYS   6 -18.853   9.736   3.044
   49    HD2  LYS   6           HD2      LYS   6 -20.718  11.284   3.037
   50    HD3  LYS   6           HD3      LYS   6 -21.236  10.670   1.471
   51    HE2  LYS   6           HE2      LYS   6 -21.566   8.451   2.478
   52    HE3  LYS   6           HE3      LYS   6 -21.122   9.126   4.039
   53    HZ1  LYS   6           HZ1      LYS   6 -23.446   9.953   2.397
   54    HZ2  LYS   6           HZ2      LYS   6 -23.015  10.623   3.887
   55    HZ3  LYS   6           HZ3      LYS   6 -23.510   9.010   3.799
   56    H    LEU   7           H        LEU   7 -17.740  10.307  -1.479
   57    HA   LEU   7           HA       LEU   7 -18.369   7.523  -1.444
   58    HB2  LEU   7           HB2      LEU   7 -18.123   9.393  -3.748
   59    HB3  LEU   7           HB3      LEU   7 -18.799   7.791  -3.833
   60    HG   LEU   7           HG       LEU   7 -19.932  10.113  -2.273
   61   HD11  LEU   7          HD11      LEU   7 -20.886   8.755  -4.788
   62   HD12  LEU   7          HD12      LEU   7 -20.196  10.373  -4.680
   63   HD13  LEU   7          HD13      LEU   7 -21.743  10.021  -3.911
   64   HD21  LEU   7          HD21      LEU   7 -20.939   7.308  -2.671
   65   HD22  LEU   7          HD22      LEU   7 -21.850   8.618  -1.921
   66   HD23  LEU   7          HD23      LEU   7 -20.377   8.017  -1.159
   67    H    ASN   8           H        ASN   8 -16.197   9.111  -3.772
   68    HA   ASN   8           HA       ASN   8 -14.611   6.650  -3.784
   69    HB2  ASN   8           HB2      ASN   8 -14.039   9.010  -5.563
   70    HB3  ASN   8           HB3      ASN   8 -13.684   7.327  -5.834
   71   HD21  ASN   8          HD21      ASN   8 -15.059   9.263  -7.514
   72   HD22  ASN   8          HD22      ASN   8 -16.590   8.552  -7.870
   73    H    HIS   9           H        HIS   9 -12.629   6.551  -2.892
   74    HA   HIS   9           HA       HIS   9 -11.583   8.947  -1.561
   75    HB2  HIS   9           HB2      HIS   9 -10.502   6.141  -1.302
   76    HB3  HIS   9           HB3      HIS   9 -10.330   7.479  -0.173
   77    HD1  HIS   9           HD1      HIS   9 -12.438   4.590  -0.969
   78    HD2  HIS   9           HD2      HIS   9 -12.757   8.042   1.318
   79    HE1  HIS   9           HE1      HIS   9 -14.401   4.213   0.547
   80    HE2  HIS   9           HE2      HIS   9 -14.475   6.245   2.030
   81    H    THR  10           H        THR  10  -9.694   9.899  -2.254
   82    HA   THR  10           HA       THR  10  -8.757   9.091  -4.842
   83    HB   THR  10           HB       THR  10  -7.437  11.116  -3.041
   84    HG1  THR  10           HG1      THR  10  -9.888  11.196  -4.049
   85   HG21  THR  10          HG21      THR  10  -6.724  12.073  -5.222
   86   HG22  THR  10          HG22      THR  10  -7.463  10.694  -6.032
   87   HG23  THR  10          HG23      THR  10  -6.096  10.450  -4.947
   88    H    CYS  11           H        CYS  11  -7.180   7.777  -5.358
   89    HA   CYS  11           HA       CYS  11  -5.790   6.260  -3.402
   90    HB2  CYS  11           HB2      CYS  11  -6.328   5.593  -5.778
   91    HB3  CYS  11           HB3      CYS  11  -5.058   6.669  -6.280
   92    H    VAL  12           H        VAL  12  -3.928   6.635  -2.370
   93    HA   VAL  12           HA       VAL  12  -2.431   9.012  -2.709
   94    HB   VAL  12           HB       VAL  12  -0.725   7.953  -1.265
   95   HG11  VAL  12          HG11      VAL  12  -2.142   7.621   0.723
   96   HG12  VAL  12          HG12      VAL  12  -3.564   7.625  -0.324
   97   HG13  VAL  12          HG13      VAL  12  -2.561   9.071  -0.192
   98   HG21  VAL  12          HG21      VAL  12  -0.904   5.665  -2.097
   99   HG22  VAL  12          HG22      VAL  12  -2.508   5.525  -1.379
  100   HG23  VAL  12          HG23      VAL  12  -1.093   5.726  -0.345
  101    H    ILE  13           H        ILE  13  -2.493   6.118  -4.489
  102    HA   ILE  13           HA       ILE  13   0.308   6.288  -5.274
  103    HB   ILE  13           HB       ILE  13  -1.676   4.265  -6.223
  104   HG12  ILE  13          HG12      ILE  13  -1.638   4.355  -3.744
  105   HG13  ILE  13          HG13      ILE  13  -1.052   2.846  -4.407
  106   HG21  ILE  13          HG21      ILE  13   1.317   4.170  -5.936
  107   HG22  ILE  13          HG22      ILE  13   0.447   4.455  -7.442
  108   HG23  ILE  13          HG23      ILE  13   0.291   2.906  -6.614
  109   HD11  ILE  13          HD11      ILE  13   0.644   5.086  -3.409
  110   HD12  ILE  13          HD12      ILE  13   1.226   3.555  -4.063
  111   HD13  ILE  13          HD13      ILE  13   0.299   3.583  -2.559
  112    H    CYS  14           H        CYS  14  -2.793   5.827  -7.005
  113    HA   CYS  14           HA       CYS  14  -1.524   6.966  -9.327
  114    HB2  CYS  14           HB2      CYS  14  -3.369   5.980 -10.605
  115    HB3  CYS  14           HB3      CYS  14  -2.483   4.795  -9.677
  116    H    ASP  15           H        ASP  15  -3.157   8.119  -6.861
  117    HA   ASP  15           HA       ASP  15  -4.327   9.993  -6.402
  118    HB2  ASP  15           HB2      ASP  15  -3.039  10.827  -8.980
  119    HB3  ASP  15           HB3      ASP  15  -3.866  11.917  -7.881
  120    H    GLN  16           H        GLN  16  -5.774   8.001  -7.778
  121    HA   GLN  16           HA       GLN  16  -7.721   9.583  -9.271
  122    HB2  GLN  16           HB2      GLN  16  -7.328   6.592  -9.176
  123    HB3  GLN  16           HB3      GLN  16  -8.509   7.442 -10.159
  124    HG2  GLN  16           HG2      GLN  16  -5.543   7.620 -10.391
  125    HG3  GLN  16           HG3      GLN  16  -6.620   6.766 -11.472
  126   HE21  GLN  16          HE21      GLN  16  -4.741   8.850 -12.058
  127   HE22  GLN  16          HE22      GLN  16  -5.645  10.139 -12.758
  128    H    GLU  17           H        GLU  17  -9.829   9.553  -8.654
  129    HA   GLU  17           HA       GLU  17 -10.380   9.056  -5.895
  130    HB2  GLU  17           HB2      GLU  17 -12.102  10.085  -8.144
  131    HB3  GLU  17           HB3      GLU  17 -12.661   9.915  -6.488
  132    HG2  GLU  17           HG2      GLU  17 -11.182  11.547  -5.699
  133    HG3  GLU  17           HG3      GLU  17 -10.247  11.525  -7.190
  134    H    LYS  18           H        LYS  18 -10.538   7.050  -5.375
  135    HA   LYS  18           HA       LYS  18 -12.296   5.266  -6.939
  136    HB2  LYS  18           HB2      LYS  18 -10.114   4.128  -5.261
  137    HB3  LYS  18           HB3      LYS  18 -10.856   3.497  -6.718
  138    HG2  LYS  18           HG2      LYS  18  -8.864   5.736  -6.550
  139    HG3  LYS  18           HG3      LYS  18  -8.567   4.109  -7.143
  140    HD2  LYS  18           HD2      LYS  18 -10.633   5.835  -8.386
  141    HD3  LYS  18           HD3      LYS  18  -8.964   6.018  -8.815
  142    HE2  LYS  18           HE2      LYS  18 -10.029   4.609 -10.421
  143    HE3  LYS  18           HE3      LYS  18  -8.909   3.678  -9.454
  144    HZ1  LYS  18           HZ1      LYS  18 -10.682   2.684  -8.266
  145    HZ2  LYS  18           HZ2      LYS  18 -11.080   2.579  -9.903
  146    HZ3  LYS  18           HZ3      LYS  18 -11.814   3.748  -8.930
  147    H    ASN  19           H        ASN  19 -13.992   4.561  -5.881
  148    HA   ASN  19           HA       ASN  19 -14.308   4.929  -3.066
  149    HB2  ASN  19           HB2      ASN  19 -16.245   5.173  -4.396
  150    HB3  ASN  19           HB3      ASN  19 -15.958   3.651  -5.197
  151   HD21  ASN  19          HD21      ASN  19 -17.939   2.786  -4.765
  152   HD22  ASN  19          HD22      ASN  19 -18.452   2.340  -3.142
  153    H    ARG  20           H        ARG  20 -13.239   2.345  -5.128
  154    HA   ARG  20           HA       ARG  20 -13.360   0.492  -2.854
  155    HB2  ARG  20           HB2      ARG  20 -14.367  -0.083  -5.175
  156    HB3  ARG  20           HB3      ARG  20 -12.703  -0.388  -5.626
  157    HG2  ARG  20           HG2      ARG  20 -12.481  -2.075  -3.991
  158    HG3  ARG  20           HG3      ARG  20 -14.004  -1.633  -3.253
  159    HD2  ARG  20           HD2      ARG  20 -15.255  -2.409  -5.061
  160    HD3  ARG  20           HD3      ARG  20 -13.811  -2.570  -6.031
  161    HE   ARG  20           HE       ARG  20 -13.328  -4.244  -3.963
  162   HH11  ARG  20          HH11      ARG  20 -16.007  -3.925  -6.201
  163   HH12  ARG  20          HH12      ARG  20 -16.489  -5.584  -6.049
  164   HH21  ARG  20          HH21      ARG  20 -13.948  -6.403  -3.770
  165   HH22  ARG  20          HH22      ARG  20 -15.296  -7.006  -4.688
  166    H    GLY  21           H        GLY  21 -11.652  -0.613  -2.152
  167    HA2  GLY  21           HA2      GLY  21  -9.165  -1.085  -2.616
  168    HA3  GLY  21           HA3      GLY  21  -9.042   0.672  -2.621
  169    H    ILE  22           H        ILE  22  -7.613   0.352  -0.601
  170    HA   ILE  22           HA       ILE  22  -9.368  -0.205   1.680
  171    HB   ILE  22           HB       ILE  22  -7.748  -1.395   2.789
  172   HG12  ILE  22          HG12      ILE  22  -5.754  -0.044   1.006
  173   HG13  ILE  22          HG13      ILE  22  -6.050   0.295   2.670
  174   HG21  ILE  22          HG21      ILE  22  -7.421  -1.914  -0.146
  175   HG22  ILE  22          HG22      ILE  22  -8.315  -2.852   1.052
  176   HG23  ILE  22          HG23      ILE  22  -6.548  -2.864   1.055
  177   HD11  ILE  22          HD11      ILE  22  -4.996  -2.307   1.634
  178   HD12  ILE  22          HD12      ILE  22  -5.204  -1.845   3.325
  179   HD13  ILE  22          HD13      ILE  22  -4.017  -1.014   2.323
  180    H    HIS  23           H        HIS  23  -7.981   0.544   3.681
  181    HA   HIS  23           HA       HIS  23  -6.780   3.109   3.384
  182    HB2  HIS  23           HB2      HIS  23  -8.520   4.338   4.712
  183    HB3  HIS  23           HB3      HIS  23  -9.049   3.883   3.112
  184    HD1  HIS  23           HD1      HIS  23  -9.819   3.445   6.706
  185    HD2  HIS  23           HD2      HIS  23 -10.988   1.873   3.064
  186    HE1  HIS  23           HE1      HIS  23 -11.973   2.234   7.167
  187    HE2  HIS  23           HE2      HIS  23 -12.757   1.443   4.907
  188    H    LEU  24           H        LEU  24  -5.204   3.017   4.824
  189    HA   LEU  24           HA       LEU  24  -5.355   1.064   6.930
  190    HB2  LEU  24           HB2      LEU  24  -3.175   2.929   6.021
  191    HB3  LEU  24           HB3      LEU  24  -3.001   1.746   7.266
  192    HG   LEU  24           HG       LEU  24  -3.595   1.109   4.391
  193   HD11  LEU  24          HD11      LEU  24  -1.071   0.782   6.009
  194   HD12  LEU  24          HD12      LEU  24  -1.325   1.921   4.688
  195   HD13  LEU  24          HD13      LEU  24  -1.322   0.189   4.369
  196   HD21  LEU  24          HD21      LEU  24  -3.050  -0.672   6.761
  197   HD22  LEU  24          HD22      LEU  24  -3.154  -1.212   5.084
  198   HD23  LEU  24          HD23      LEU  24  -4.573  -0.531   5.879
  199    H    TYR  25           H        TYR  25  -4.147   4.366   6.854
  200    HA   TYR  25           HA       TYR  25  -5.096   4.734   9.565
  201    HB2  TYR  25           HB2      TYR  25  -3.260   6.442   7.934
  202    HB3  TYR  25           HB3      TYR  25  -3.676   6.743   9.607
  203    HD1  TYR  25           HD1      TYR  25  -3.225   3.273   8.734
  204    HD2  TYR  25           HD2      TYR  25  -1.161   6.779   9.960
  205    HE1  TYR  25           HE1      TYR  25  -1.321   1.896   9.405
  206    HE2  TYR  25           HE2      TYR  25   0.752   5.407  10.658
  207    HH   TYR  25           HH       TYR  25   1.223   3.095  11.318
  208    H    THR  26           H        THR  26  -4.657   7.561   7.731
  209    HA   THR  26           HA       THR  26  -7.555   7.827   7.363
  210    HB   THR  26           HB       THR  26  -6.595   9.571   8.755
  211    HG1  THR  26           HG1      THR  26  -8.216  10.440   7.586
  212   HG21  THR  26          HG21      THR  26  -4.835  10.258   6.406
  213   HG22  THR  26          HG22      THR  26  -4.303   9.463   7.887
  214   HG23  THR  26          HG23      THR  26  -4.916  11.115   7.947
  215    H    LYS  27           H        LYS  27  -4.986   6.788   5.634
  216    HA   LYS  27           HA       LYS  27  -5.807   8.244   3.210
  217    HB2  LYS  27           HB2      LYS  27  -3.643   7.134   2.283
  218    HB3  LYS  27           HB3      LYS  27  -3.547   8.580   3.276
  219    HG2  LYS  27           HG2      LYS  27  -3.355   5.891   4.540
  220    HG3  LYS  27           HG3      LYS  27  -1.954   6.598   3.729
  221    HD2  LYS  27           HD2      LYS  27  -3.535   7.791   5.995
  222    HD3  LYS  27           HD3      LYS  27  -1.901   7.168   6.068
  223    HE2  LYS  27           HE2      LYS  27  -1.563   8.941   4.109
  224    HE3  LYS  27           HE3      LYS  27  -2.919   9.702   4.927
  225    HZ1  LYS  27           HZ1      LYS  27  -0.186   9.291   5.861
  226    HZ2  LYS  27           HZ2      LYS  27  -1.416   9.274   7.001
  227    HZ3  LYS  27           HZ3      LYS  27  -1.188  10.636   6.036
  228    H    PHE  28           H        PHE  28  -5.222   6.859   1.217
  229    HA   PHE  28           HA       PHE  28  -6.578   4.281   1.430
  230    HB2  PHE  28           HB2      PHE  28  -8.387   5.776   1.065
  231    HB3  PHE  28           HB3      PHE  28  -7.466   6.724  -0.092
  232    HD1  PHE  28           HD1      PHE  28  -9.437   3.704   0.439
  233    HD2  PHE  28           HD2      PHE  28  -7.235   5.996  -2.392
  234    HE1  PHE  28           HE1      PHE  28 -10.420   2.391  -1.389
  235    HE2  PHE  28           HE2      PHE  28  -8.210   4.685  -4.218
  236    HZ   PHE  28           HZ       PHE  28  -9.797   2.860  -3.725
  237    H    ILE  29           H        ILE  29  -5.304   2.890   0.396
  238    HA   ILE  29           HA       ILE  29  -4.077   3.709  -2.143
  239    HB   ILE  29           HB       ILE  29  -3.891   1.007  -0.786
  240   HG12  ILE  29          HG12      ILE  29  -1.395   1.854  -0.551
  241   HG13  ILE  29          HG13      ILE  29  -2.150   3.439  -0.569
  242   HG21  ILE  29          HG21      ILE  29  -3.649   1.008  -3.226
  243   HG22  ILE  29          HG22      ILE  29  -2.126   0.591  -2.419
  244   HG23  ILE  29          HG23      ILE  29  -2.353   2.207  -3.084
  245   HD11  ILE  29          HD11      ILE  29  -1.701   2.465   1.699
  246   HD12  ILE  29          HD12      ILE  29  -2.945   1.268   1.347
  247   HD13  ILE  29          HD13      ILE  29  -3.363   2.979   1.411
  248    H    CYS  30           H        CYS  30  -5.186   3.233  -4.016
  249    HA   CYS  30           HA       CYS  30  -7.750   2.013  -3.749
  250    HB2  CYS  30           HB2      CYS  30  -8.146   2.486  -5.967
  251    HB3  CYS  30           HB3      CYS  30  -6.946   3.709  -5.579
  252    H    LEU  31           H        LEU  31  -8.432   0.193  -4.774
  253    HA   LEU  31           HA       LEU  31  -7.238  -2.017  -3.767
  254    HB2  LEU  31           HB2      LEU  31  -9.029  -3.146  -4.618
  255    HB3  LEU  31           HB3      LEU  31  -9.633  -1.527  -4.539
  256    HG   LEU  31           HG       LEU  31  -8.824  -1.472  -7.062
  257   HD11  LEU  31          HD11      LEU  31  -7.890  -3.740  -7.025
  258   HD12  LEU  31          HD12      LEU  31  -9.211  -3.594  -8.183
  259   HD13  LEU  31          HD13      LEU  31  -9.484  -4.385  -6.630
  260   HD21  LEU  31          HD21      LEU  31 -11.068  -1.005  -6.369
  261   HD22  LEU  31          HD22      LEU  31 -11.378  -2.712  -6.060
  262   HD23  LEU  31          HD23      LEU  31 -11.117  -2.147  -7.710
  263    H    ASP  32           H        ASP  32  -6.497  -0.478  -6.700
  264    HA   ASP  32           HA       ASP  32  -5.571  -2.843  -8.074
  265    HB2  ASP  32           HB2      ASP  32  -6.598  -0.770  -9.164
  266    HB3  ASP  32           HB3      ASP  32  -5.049  -0.020  -8.858
  267    H    CYS  33           H        CYS  33  -4.307   0.057  -6.710
  268    HA   CYS  33           HA       CYS  33  -1.573  -0.549  -6.983
  269    HB2  CYS  33           HB2      CYS  33  -2.908   1.523  -5.268
  270    HB3  CYS  33           HB3      CYS  33  -1.201   1.404  -5.594
  271    H    GLU  34           H        GLU  34  -3.986  -0.854  -4.564
  272    HA   GLU  34           HA       GLU  34  -2.445  -1.590  -2.410
  273    HB2  GLU  34           HB2      GLU  34  -4.789  -1.012  -2.240
  274    HB3  GLU  34           HB3      GLU  34  -5.247  -2.438  -3.149
  275    HG2  GLU  34           HG2      GLU  34  -3.823  -2.552  -0.507
  276    HG3  GLU  34           HG3      GLU  34  -5.556  -2.532  -0.671
  277    H    ARG  35           H        ARG  35  -3.640  -3.522  -5.112
  278    HA   ARG  35           HA       ARG  35  -2.394  -5.907  -4.126
  279    HB2  ARG  35           HB2      ARG  35  -3.231  -5.313  -6.966
  280    HB3  ARG  35           HB3      ARG  35  -2.939  -6.900  -6.266
  281    HG2  ARG  35           HG2      ARG  35  -4.851  -6.701  -4.853
  282    HG3  ARG  35           HG3      ARG  35  -5.100  -5.028  -5.354
  283    HD2  ARG  35           HD2      ARG  35  -5.372  -7.506  -7.034
  284    HD3  ARG  35           HD3      ARG  35  -6.638  -6.399  -6.526
  285    HE   ARG  35           HE       ARG  35  -5.112  -4.754  -7.925
  286   HH11  ARG  35          HH11      ARG  35  -6.162  -8.005  -8.650
  287   HH12  ARG  35          HH12      ARG  35  -6.211  -7.755 -10.363
  288   HH21  ARG  35          HH21      ARG  35  -5.196  -4.394 -10.205
  289   HH22  ARG  35          HH22      ARG  35  -5.652  -5.711 -11.245
  290    H    LYS  36           H        LYS  36  -1.419  -3.264  -6.014
  291    HA   LYS  36           HA       LYS  36   0.633  -4.398  -7.538
  292    HB2  LYS  36           HB2      LYS  36   0.325  -1.622  -6.514
  293    HB3  LYS  36           HB3      LYS  36   1.500  -2.102  -7.715
  294    HG2  LYS  36           HG2      LYS  36  -0.477  -2.810  -9.102
  295    HG3  LYS  36           HG3      LYS  36  -1.484  -2.014  -7.964
  296    HD2  LYS  36           HD2      LYS  36  -0.134  -0.026  -8.404
  297    HD3  LYS  36           HD3      LYS  36   0.667  -0.871  -9.699
  298    HE2  LYS  36           HE2      LYS  36  -2.277  -0.255  -9.487
  299    HE3  LYS  36           HE3      LYS  36  -1.121   0.498 -10.579
  300    HZ1  LYS  36           HZ1      LYS  36  -0.875  -1.487 -11.783
  301    HZ2  LYS  36           HZ2      LYS  36  -2.543  -1.302 -11.550
  302    HZ3  LYS  36           HZ3      LYS  36  -1.674  -2.405 -10.610
  303    H    VAL  37           H        VAL  37   0.439  -2.946  -4.422
  304    HA   VAL  37           HA       VAL  37   3.092  -2.736  -3.794
  305    HB   VAL  37           HB       VAL  37   2.426  -2.735  -1.455
  306   HG11  VAL  37          HG11      VAL  37   0.398  -1.220  -3.083
  307   HG12  VAL  37          HG12      VAL  37   2.080  -0.719  -2.906
  308   HG13  VAL  37          HG13      VAL  37   1.029  -0.790  -1.492
  309   HG21  VAL  37          HG21      VAL  37   0.849  -4.340  -1.139
  310   HG22  VAL  37          HG22      VAL  37  -0.111  -3.831  -2.536
  311   HG23  VAL  37          HG23      VAL  37  -0.109  -2.860  -1.057
  312    H    ILE  38           H        ILE  38   0.903  -5.365  -3.161
  313    HA   ILE  38           HA       ILE  38   2.527  -7.053  -1.656
  314    HB   ILE  38           HB       ILE  38   0.494  -8.118  -3.590
  315   HG12  ILE  38          HG12      ILE  38  -0.039  -6.421  -1.177
  316   HG13  ILE  38          HG13      ILE  38  -0.689  -6.255  -2.788
  317   HG21  ILE  38          HG21      ILE  38   1.346  -8.862  -0.810
  318   HG22  ILE  38          HG22      ILE  38   1.580  -9.776  -2.296
  319   HG23  ILE  38          HG23      ILE  38  -0.040  -9.580  -1.628
  320   HD11  ILE  38          HD11      ILE  38  -1.330  -8.689  -1.197
  321   HD12  ILE  38          HD12      ILE  38  -2.247  -7.911  -2.486
  322   HD13  ILE  38          HD13      ILE  38  -2.181  -7.178  -0.881
  323    H    SER  39           H        SER  39   2.151  -6.440  -4.999
  324    HA   SER  39           HA       SER  39   3.537  -8.778  -5.793
  325    HB2  SER  39           HB2      SER  39   1.776  -7.781  -7.217
  326    HB3  SER  39           HB3      SER  39   2.802  -6.369  -7.461
  327    HG   SER  39           HG       SER  39   3.626  -9.001  -8.126
  328    H    THR  40           H        THR  40   4.325  -5.548  -5.025
  329    HA   THR  40           HA       THR  40   6.867  -5.482  -6.393
  330    HB   THR  40           HB       THR  40   5.653  -3.543  -4.421
  331    HG1  THR  40           HG1      THR  40   4.369  -3.792  -6.298
  332   HG21  THR  40          HG21      THR  40   7.860  -3.122  -6.440
  333   HG22  THR  40          HG22      THR  40   8.088  -3.273  -4.698
  334   HG23  THR  40          HG23      THR  40   7.187  -1.905  -5.353
  335    H    SER  41           H        SER  41   5.702  -5.996  -3.108
  336    HA   SER  41           HA       SER  41   8.232  -5.440  -1.877
  337    HB2  SER  41           HB2      SER  41   6.999  -6.279   0.175
  338    HB3  SER  41           HB3      SER  41   6.302  -4.878  -0.641
  339    HG   SER  41           HG       SER  41   4.568  -6.102  -0.531
  340    H    THR  42           H        THR  42   6.879  -8.236  -3.274
  341    HA   THR  42           HA       THR  42   7.971 -10.106  -1.407
  342    HB   THR  42           HB       THR  42   7.242 -11.805  -3.143
  343    HG1  THR  42           HG1      THR  42   7.169  -9.711  -4.702
  344   HG21  THR  42          HG21      THR  42   5.191  -9.813  -2.165
  345   HG22  THR  42          HG22      THR  42   5.872 -11.131  -1.210
  346   HG23  THR  42          HG23      THR  42   4.879 -11.490  -2.621
  347    H    SER  43           H        SER  43   9.964  -8.452  -2.289
  348    HA   SER  43           HA       SER  43  11.911 -10.413  -3.096
  349    HB2  SER  43           HB2      SER  43  11.487  -7.927  -4.786
  350    HB3  SER  43           HB3      SER  43  12.839  -9.046  -4.946
  351    HG   SER  43           HG       SER  43  10.593 -10.465  -5.023
  352    H    ASP  44           H        ASP  44  11.403  -9.036  -0.710
  353    HA   ASP  44           HA       ASP  44  13.831  -7.427  -0.478
  354    HB2  ASP  44           HB2      ASP  44  12.144  -5.740  -0.718
  355    HB3  ASP  44           HB3      ASP  44  11.115  -6.517   0.477
  356    HA   PRO  45           HA       PRO  45  12.470  -8.791   4.000
  357    HB2  PRO  45           HB2      PRO  45  10.770 -11.140   3.441
  358    HB3  PRO  45           HB3      PRO  45  10.550  -9.846   4.623
  359    HG2  PRO  45           HG2      PRO  45   9.038  -9.996   2.422
  360    HG3  PRO  45           HG3      PRO  45   9.553  -8.445   3.084
  361    HD2  PRO  45           HD2      PRO  45  10.599  -9.921   0.748
  362    HD3  PRO  45           HD3      PRO  45  10.346  -8.187   0.953
  363    H    ASP  46           H        ASP  46  13.106 -10.628   5.328
  364    HA   ASP  46           HA       ASP  46  14.517 -12.281   5.922
  365    HB2  ASP  46           HB2      ASP  46  13.978 -13.275   3.125
  366    HB3  ASP  46           HB3      ASP  46  14.980 -14.144   4.277
  367    H    TYR  47           H        TYR  47  15.395  -9.785   4.696
  368    HA   TYR  47           HA       TYR  47  18.183 -10.573   4.345
  369    HB2  TYR  47           HB2      TYR  47  16.588  -8.804   2.548
  370    HB3  TYR  47           HB3      TYR  47  18.311  -8.537   2.737
  371    HD1  TYR  47           HD1      TYR  47  19.903 -10.343   2.072
  372    HD2  TYR  47           HD2      TYR  47  15.753 -10.553   1.178
  373    HE1  TYR  47           HE1      TYR  47  20.364 -12.051   0.367
  374    HE2  TYR  47           HE2      TYR  47  16.200 -12.265  -0.531
  375    HH   TYR  47           HH       TYR  47  19.190 -13.864  -0.791
  376    H    ALA  48           H        ALA  48  19.603  -9.315   5.418
  377    HA   ALA  48           HA       ALA  48  18.547  -7.539   7.395
  378    HB1  ALA  48           HB1      ALA  48  20.851  -7.341   8.153
  379    HB2  ALA  48           HB2      ALA  48  21.413  -8.167   6.698
  380    HB3  ALA  48           HB3      ALA  48  20.425  -9.029   7.877
  381    H1   SER   0           H1       SER   0   0.629  13.859   7.554
  382    H2   SER   0           H2       SER   0   1.035  12.872   6.241
  383    H3   SER   0           H3       SER   0  -0.564  13.388   6.452
  384    HA   SER   0           HA       SER   0   0.467  14.648   4.714
  385    HB2  SER   0           HB2      SER   0   0.193  16.944   5.787
  386    HB3  SER   0           HB3      SER   0  -1.178  15.849   5.948
  387    HG   SER   0           HG       SER   0   0.527  16.857   7.878
  388    H    MET   1           H        MET   1   2.071  16.132   4.036
  389    HA   MET   1           HA       MET   1   4.116  17.066   3.856
  390    HB2  MET   1           HB2      MET   1   3.777  18.113   6.012
  391    HB3  MET   1           HB3      MET   1   4.267  16.643   6.844
  392    HG2  MET   1           HG2      MET   1   6.027  18.343   6.829
  393    HG3  MET   1           HG3      MET   1   6.517  16.867   6.000
  394    HE1  MET   1           HE1      MET   1   8.169  19.487   5.676
  395    HE2  MET   1           HE2      MET   1   8.409  19.565   3.931
  396    HE3  MET   1           HE3      MET   1   8.535  18.018   4.769
  397    H    ASP   2           H        ASP   2   5.164  15.697   2.589
  398    HA   ASP   2           HA       ASP   2   6.662  13.520   3.875
  399    HB2  ASP   2           HB2      ASP   2   6.748  12.411   1.704
  400    HB3  ASP   2           HB3      ASP   2   5.077  12.747   2.135
  401    H    GLU   3           H        GLU   3   8.856  13.285   3.414
  402    HA   GLU   3           HA       GLU   3  10.122  15.418   1.873
  403    HB2  GLU   3           HB2      GLU   3   9.983  16.146   4.264
  404    HB3  GLU   3           HB3      GLU   3  10.951  14.745   4.699
  405    HG2  GLU   3           HG2      GLU   3  12.828  15.576   3.489
  406    HG3  GLU   3           HG3      GLU   3  11.867  16.880   2.792
  407    H    THR   4           H        THR   4  10.411  13.623   0.439
  408    HA   THR   4           HA       THR   4  12.348  11.604   1.288
  409    HB   THR   4           HB       THR   4  10.762  11.823  -1.275
  410    HG1  THR   4           HG1      THR   4   9.244  10.866  -0.157
  411   HG21  THR   4          HG21      THR   4  12.584   9.678  -0.197
  412   HG22  THR   4          HG22      THR   4  12.788  10.607  -1.682
  413   HG23  THR   4          HG23      THR   4  11.475   9.439  -1.547
  414    H    VAL   5           H        VAL   5  14.347  12.473   1.238
  415    HA   VAL   5           HA       VAL   5  15.136  14.244  -0.915
  416    HB   VAL   5           HB       VAL   5  16.809  13.157   1.355
  417   HG11  VAL   5          HG11      VAL   5  18.143  13.924  -0.535
  418   HG12  VAL   5          HG12      VAL   5  18.316  15.013   0.842
  419   HG13  VAL   5          HG13      VAL   5  17.292  15.469  -0.518
  420   HG21  VAL   5          HG21      VAL   5  14.920  14.460   2.189
  421   HG22  VAL   5          HG22      VAL   5  15.355  15.789   1.115
  422   HG23  VAL   5          HG23      VAL   5  16.438  15.326   2.427
  423    H    LYS   6           H        LYS   6  16.368  11.174   0.419
  424    HA   LYS   6           HA       LYS   6  16.688  10.008  -2.147
  425    HB2  LYS   6           HB2      LYS   6  18.587  11.530  -2.271
  426    HB3  LYS   6           HB3      LYS   6  19.188  10.898  -0.757
  427    HG2  LYS   6           HG2      LYS   6  19.466   8.694  -1.796
  428    HG3  LYS   6           HG3      LYS   6  18.936   9.395  -3.320
  429    HD2  LYS   6           HD2      LYS   6  20.829  10.906  -3.320
  430    HD3  LYS   6           HD3      LYS   6  21.339  10.300  -1.749
  431    HE2  LYS   6           HE2      LYS   6  21.623   8.074  -2.749
  432    HE3  LYS   6           HE3      LYS   6  21.194   8.739  -4.320
  433    HZ1  LYS   6           HZ1      LYS   6  23.533   9.534  -2.671
  434    HZ2  LYS   6           HZ2      LYS   6  23.118  10.203  -4.165
  435    HZ3  LYS   6           HZ3      LYS   6  23.580   8.581  -4.067
  436    H    LEU   7           H        LEU   7  17.829   9.998   1.206
  437    HA   LEU   7           HA       LEU   7  18.413   7.204   1.179
  438    HB2  LEU   7           HB2      LEU   7  18.199   9.089   3.474
  439    HB3  LEU   7           HB3      LEU   7  18.849   7.476   3.567
  440    HG   LEU   7           HG       LEU   7  20.020   9.773   1.998
  441   HD11  LEU   7          HD11      LEU   7  20.951   8.410   4.520
  442   HD12  LEU   7          HD12      LEU   7  20.290  10.041   4.405
  443   HD13  LEU   7          HD13      LEU   7  21.831   9.657   3.637
  444   HD21  LEU   7          HD21      LEU   7  20.978   6.951   2.410
  445   HD22  LEU   7          HD22      LEU   7  21.914   8.241   1.656
  446   HD23  LEU   7          HD23      LEU   7  20.432   7.666   0.895
  447    H    ASN   8           H        ASN   8  16.269   8.840   3.498
  448    HA   ASN   8           HA       ASN   8  14.642   6.405   3.519
  449    HB2  ASN   8           HB2      ASN   8  14.111   8.780   5.291
  450    HB3  ASN   8           HB3      ASN   8  13.728   7.104   5.569
  451   HD21  ASN   8          HD21      ASN   8  15.133   9.025   7.239
  452   HD22  ASN   8          HD22      ASN   8  16.652   8.289   7.599
  453    H    HIS   9           H        HIS   9  12.658   6.339   2.627
  454    HA   HIS   9           HA       HIS   9  11.655   8.746   1.286
  455    HB2  HIS   9           HB2      HIS   9  10.526   5.959   1.037
  456    HB3  HIS   9           HB3      HIS   9  10.377   7.294  -0.097
  457    HD1  HIS   9           HD1      HIS   9  12.430   4.367   0.705
  458    HD2  HIS   9           HD2      HIS   9  12.812   7.810  -1.588
  459    HE1  HIS   9           HE1      HIS   9  14.389   3.954  -0.805
  460    HE2  HIS   9           HE2      HIS   9  14.508   5.987  -2.289
  461    H    THR  10           H        THR  10   9.780   9.734   1.975
  462    HA   THR  10           HA       THR  10   8.831   8.952   4.566
  463    HB   THR  10           HB       THR  10   7.544  10.991   2.758
  464    HG1  THR  10           HG1      THR  10   9.996  11.032   3.768
  465   HG21  THR  10          HG21      THR  10   6.847  11.969   4.937
  466   HG22  THR  10          HG22      THR  10   7.563  10.581   5.752
  467   HG23  THR  10          HG23      THR  10   6.190  10.355   4.670
  468    H    CYS  11           H        CYS  11   7.235   7.661   5.085
  469    HA   CYS  11           HA       CYS  11   5.815   6.166   3.135
  470    HB2  CYS  11           HB2      CYS  11   6.341   5.500   5.515
  471    HB3  CYS  11           HB3      CYS  11   5.093   6.601   6.011
  472    H    VAL  12           H        VAL  12   3.961   6.570   2.105
  473    HA   VAL  12           HA       VAL  12   2.506   8.975   2.432
  474    HB   VAL  12           HB       VAL  12   0.781   7.939   0.990
  475   HG11  VAL  12          HG11      VAL  12   2.193   7.574  -0.994
  476   HG12  VAL  12          HG12      VAL  12   3.615   7.558   0.054
  477   HG13  VAL  12          HG13      VAL  12   2.638   9.020  -0.085
  478   HG21  VAL  12          HG21      VAL  12   0.920   5.652   1.832
  479   HG22  VAL  12          HG22      VAL  12   2.522   5.481   1.115
  480   HG23  VAL  12          HG23      VAL  12   1.111   5.704   0.080
  481    H    ILE  13           H        ILE  13   2.517   6.087   4.222
  482    HA   ILE  13           HA       ILE  13  -0.281   6.308   5.006
  483    HB   ILE  13           HB       ILE  13   1.667   4.255   5.964
  484   HG12  ILE  13          HG12      ILE  13   1.634   4.334   3.484
  485   HG13  ILE  13          HG13      ILE  13   1.019   2.838   4.154
  486   HG21  ILE  13          HG21      ILE  13  -1.326   4.211   5.677
  487   HG22  ILE  13          HG22      ILE  13  -0.451   4.484   7.181
  488   HG23  ILE  13          HG23      ILE  13  -0.323   2.931   6.359
  489   HD11  ILE  13          HD11      ILE  13  -0.636   5.105   3.145
  490   HD12  ILE  13          HD12      ILE  13  -1.244   3.587   3.805
  491   HD13  ILE  13          HD13      ILE  13  -0.315   3.592   2.301
  492    H    CYS  14           H        CYS  14   2.809   5.798   6.742
  493    HA   CYS  14           HA       CYS  14   1.561   6.970   9.057
  494    HB2  CYS  14           HB2      CYS  14   3.389   5.956  10.341
  495    HB3  CYS  14           HB3      CYS  14   2.482   4.784   9.417
  496    H    ASP  15           H        ASP  15   3.214   8.088   6.587
  497    HA   ASP  15           HA       ASP  15   4.412   9.941   6.127
  498    HB2  ASP  15           HB2      ASP  15   3.150  10.805   8.681
  499    HB3  ASP  15           HB3      ASP  15   3.979  11.894   7.589
  500    H    GLN  16           H        GLN  16   5.842   7.910   7.507
  501    HA   GLN  16           HA       GLN  16   7.804   9.479   8.995
  502    HB2  GLN  16           HB2      GLN  16   7.360   6.494   8.911
  503    HB3  GLN  16           HB3      GLN  16   8.555   7.324   9.894
  504    HG2  GLN  16           HG2      GLN  16   5.594   7.556  10.120
  505    HG3  GLN  16           HG3      GLN  16   6.654   6.687  11.206
  506   HE21  GLN  16          HE21      GLN  16   4.813   8.805  11.785
  507   HE22  GLN  16          HE22      GLN  16   5.743  10.080  12.479
  508    H    GLU  17           H        GLU  17   9.916   9.402   8.385
  509    HA   GLU  17           HA       GLU  17  10.455   8.891   5.622
  510    HB2  GLU  17           HB2      GLU  17  12.194   9.900   7.867
  511    HB3  GLU  17           HB3      GLU  17  12.750   9.713   6.211
  512    HG2  GLU  17           HG2      GLU  17  11.300  11.367   5.415
  513    HG3  GLU  17           HG3      GLU  17  10.364  11.367   6.907
  514    H    LYS  18           H        LYS  18  10.574   6.883   5.109
  515    HA   LYS  18           HA       LYS  18  12.303   5.075   6.679
  516    HB2  LYS  18           HB2      LYS  18  10.101   3.968   5.005
  517    HB3  LYS  18           HB3      LYS  18  10.833   3.331   6.464
  518    HG2  LYS  18           HG2      LYS  18   8.878   5.603   6.290
  519    HG3  LYS  18           HG3      LYS  18   8.556   3.981   6.888
  520    HD2  LYS  18           HD2      LYS  18  10.651   5.676   8.125
  521    HD3  LYS  18           HD3      LYS  18   8.986   5.891   8.553
  522    HE2  LYS  18           HE2      LYS  18  10.029   4.468  10.165
  523    HE3  LYS  18           HE3      LYS  18   8.890   3.556   9.204
  524    HZ1  LYS  18           HZ1      LYS  18  10.638   2.528   8.013
  525    HZ2  LYS  18           HZ2      LYS  18  11.040   2.418   9.650
  526    HZ3  LYS  18           HZ3      LYS  18  11.794   3.570   8.672
  527    H    ASN  19           H        ASN  19  13.985   4.335   5.625
  528    HA   ASN  19           HA       ASN  19  14.311   4.687   2.808
  529    HB2  ASN  19           HB2      ASN  19  16.250   4.904   4.140
  530    HB3  ASN  19           HB3      ASN  19  15.937   3.391   4.947
  531   HD21  ASN  19          HD21      ASN  19  17.901   2.487   4.518
  532   HD22  ASN  19          HD22      ASN  19  18.412   2.033   2.899
  533    H    ARG  20           H        ARG  20  13.191   2.133   4.876
  534    HA   ARG  20           HA       ARG  20  13.288   0.266   2.612
  535    HB2  ARG  20           HB2      ARG  20  14.281  -0.319   4.940
  536    HB3  ARG  20           HB3      ARG  20  12.609  -0.590   5.387
  537    HG2  ARG  20           HG2      ARG  20  12.358  -2.281   3.763
  538    HG3  ARG  20           HG3      ARG  20  13.886  -1.867   3.023
  539    HD2  ARG  20           HD2      ARG  20  15.129  -2.654   4.832
  540    HD3  ARG  20           HD3      ARG  20  13.683  -2.794   5.802
  541    HE   ARG  20           HE       ARG  20  13.178  -4.462   3.734
  542   HH11  ARG  20          HH11      ARG  20  15.857  -4.180   5.980
  543   HH12  ARG  20          HH12      ARG  20  16.306  -5.852   5.836
  544   HH21  ARG  20          HH21      ARG  20  13.758  -6.631   3.555
  545   HH22  ARG  20          HH22      ARG  20  15.096  -7.254   4.478
  546    H    GLY  21           H        GLY  21  11.560  -0.812   1.911
  547    HA2  GLY  21           HA2      GLY  21   9.063  -1.237   2.379
  548    HA3  GLY  21           HA3      GLY  21   8.974   0.520   2.380
  549    H    ILE  22           H        ILE  22   7.538   0.219   0.359
  550    HA   ILE  22           HA       ILE  22   9.284  -0.374  -1.920
  551    HB   ILE  22           HB       ILE  22   7.645  -1.543  -3.024
  552   HG12  ILE  22          HG12      ILE  22   5.673  -0.152  -1.247
  553   HG13  ILE  22          HG13      ILE  22   5.975   0.175  -2.912
  554   HG21  ILE  22          HG21      ILE  22   7.307  -2.047  -0.089
  555   HG22  ILE  22          HG22      ILE  22   8.185  -3.004  -1.283
  556   HG23  ILE  22          HG23      ILE  22   6.417  -2.984  -1.286
  557   HD11  ILE  22          HD11      ILE  22   4.877  -2.403  -1.868
  558   HD12  ILE  22          HD12      ILE  22   5.093  -1.950  -3.560
  559   HD13  ILE  22          HD13      ILE  22   3.920  -1.096  -2.560
  560    H    HIS  23           H        HIS  23   7.910   0.389  -3.923
  561    HA   HIS  23           HA       HIS  23   6.752   2.974  -3.639
  562    HB2  HIS  23           HB2      HIS  23   8.510   4.165  -4.970
  563    HB3  HIS  23           HB3      HIS  23   9.033   3.709  -3.367
  564    HD1  HIS  23           HD1      HIS  23   9.799   3.247  -6.964
  565    HD2  HIS  23           HD2      HIS  23  10.940   1.666  -3.314
  566    HE1  HIS  23           HE1      HIS  23  11.931   2.001  -7.417
  567    HE2  HIS  23           HE2      HIS  23  12.694   1.191  -5.158
  568    H    LEU  24           H        LEU  24   5.177   2.905  -5.078
  569    HA   LEU  24           HA       LEU  24   5.292   0.940  -7.174
  570    HB2  LEU  24           HB2      LEU  24   3.147   2.845  -6.272
  571    HB3  LEU  24           HB3      LEU  24   2.952   1.664  -7.512
  572    HG   LEU  24           HG       LEU  24   3.534   1.024  -4.636
  573   HD11  LEU  24          HD11      LEU  24   1.005   0.737  -6.254
  574   HD12  LEU  24          HD12      LEU  24   1.279   1.876  -4.939
  575   HD13  LEU  24          HD13      LEU  24   1.244   0.147  -4.611
  576   HD21  LEU  24          HD21      LEU  24   2.960  -0.756  -6.999
  577   HD22  LEU  24          HD22      LEU  24   3.054  -1.291  -5.322
  578   HD23  LEU  24          HD23      LEU  24   4.485  -0.637  -6.119
  579    H    TYR  25           H        TYR  25   4.149   4.264  -7.108
  580    HA   TYR  25           HA       TYR  25   5.104   4.604  -9.822
  581    HB2  TYR  25           HB2      TYR  25   3.293   6.349  -8.201
  582    HB3  TYR  25           HB3      TYR  25   3.715   6.635  -9.876
  583    HD1  TYR  25           HD1      TYR  25   3.205   3.177  -8.989
  584    HD2  TYR  25           HD2      TYR  25   1.198   6.711 -10.227
  585    HE1  TYR  25           HE1      TYR  25   1.277   1.832  -9.653
  586    HE2  TYR  25           HE2      TYR  25  -0.736   5.370 -10.920
  587    HH   TYR  25           HH       TYR  25  -1.257   3.077 -11.565
  588    H    THR  26           H        THR  26   4.708   7.446  -8.002
  589    HA   THR  26           HA       THR  26   7.609   7.663  -7.630
  590    HB   THR  26           HB       THR  26   6.682   9.417  -9.033
  591    HG1  THR  26           HG1      THR  26   8.314  10.263  -7.862
  592   HG21  THR  26          HG21      THR  26   4.933  10.141  -6.686
  593   HG22  THR  26          HG22      THR  26   4.388   9.351  -8.164
  594   HG23  THR  26          HG23      THR  26   5.028  10.992  -8.229
  595    H    LYS  27           H        LYS  27   5.024   6.672  -5.899
  596    HA   LYS  27           HA       LYS  27   5.870   8.125  -3.482
  597    HB2  LYS  27           HB2      LYS  27   3.687   7.059  -2.551
  598    HB3  LYS  27           HB3      LYS  27   3.616   8.503  -3.550
  599    HG2  LYS  27           HG2      LYS  27   3.379   5.810  -4.802
  600    HG3  LYS  27           HG3      LYS  27   1.988   6.544  -3.995
  601    HD2  LYS  27           HD2      LYS  27   3.591   7.700  -6.265
  602    HD3  LYS  27           HD3      LYS  27   1.947   7.102  -6.339
  603    HE2  LYS  27           HE2      LYS  27   1.637   8.890  -4.387
  604    HE3  LYS  27           HE3      LYS  27   3.005   9.626  -5.206
  605    HZ1  LYS  27           HZ1      LYS  27   0.267   9.247  -6.149
  606    HZ2  LYS  27           HZ2      LYS  27   1.503   9.224  -7.283
  607    HZ3  LYS  27           HZ3      LYS  27   1.280  10.582  -6.310
  608    H    PHE  28           H        PHE  28   5.259   6.759  -1.486
  609    HA   PHE  28           HA       PHE  28   6.572   4.157  -1.688
  610    HB2  PHE  28           HB2      PHE  28   8.406   5.623  -1.328
  611    HB3  PHE  28           HB3      PHE  28   7.501   6.590  -0.172
  612    HD1  PHE  28           HD1      PHE  28   9.419   3.535  -0.694
  613    HD2  PHE  28           HD2      PHE  28   7.255   5.873   2.128
  614    HE1  PHE  28           HE1      PHE  28  10.378   2.211   1.140
  615    HE2  PHE  28           HE2      PHE  28   8.207   4.554   3.958
  616    HZ   PHE  28           HZ       PHE  28   9.763   2.701   3.475
  617    H    ILE  29           H        ILE  29   5.274   2.791  -0.649
  618    HA   ILE  29           HA       ILE  29   4.060   3.641   1.885
  619    HB   ILE  29           HB       ILE  29   3.825   0.935   0.541
  620   HG12  ILE  29          HG12      ILE  29   1.345   1.828   0.301
  621   HG13  ILE  29          HG13      ILE  29   2.131   3.398   0.313
  622   HG21  ILE  29          HG21      ILE  29   3.582   0.952   2.980
  623   HG22  ILE  29          HG22      ILE  29   2.053   0.558   2.173
  624   HG23  ILE  29          HG23      ILE  29   2.308   2.172   2.833
  625   HD11  ILE  29          HD11      ILE  29   1.662   2.424  -1.951
  626   HD12  ILE  29          HD12      ILE  29   2.887   1.206  -1.595
  627   HD13  ILE  29          HD13      ILE  29   3.334   2.910  -1.665
  628    H    CYS  30           H        CYS  30   5.158   3.153   3.763
  629    HA   CYS  30           HA       CYS  30   7.703   1.891   3.503
  630    HB2  CYS  30           HB2      CYS  30   8.102   2.363   5.722
  631    HB3  CYS  30           HB3      CYS  30   6.924   3.603   5.326
  632    H    LEU  31           H        LEU  31   8.352   0.062   4.538
  633    HA   LEU  31           HA       LEU  31   7.122  -2.133   3.535
  634    HB2  LEU  31           HB2      LEU  31   8.895  -3.291   4.389
  635    HB3  LEU  31           HB3      LEU  31   9.527  -1.680   4.307
  636    HG   LEU  31           HG       LEU  31   8.716  -1.603   6.826
  637   HD11  LEU  31          HD11      LEU  31   7.743  -3.855   6.798
  638   HD12  LEU  31          HD12      LEU  31   9.067  -3.729   7.956
  639   HD13  LEU  31          HD13      LEU  31   9.325  -4.529   6.406
  640   HD21  LEU  31          HD21      LEU  31  10.965  -1.178   6.130
  641   HD22  LEU  31          HD22      LEU  31  11.247  -2.892   5.831
  642   HD23  LEU  31          HD23      LEU  31  10.994  -2.314   7.478
  643    H    ASP  32           H        ASP  32   6.408  -0.567   6.461
  644    HA   ASP  32           HA       ASP  32   5.441  -2.912   7.845
  645    HB2  ASP  32           HB2      ASP  32   6.500  -0.850   8.927
  646    HB3  ASP  32           HB3      ASP  32   4.968  -0.076   8.611
  647    H    CYS  33           H        CYS  33   4.227   0.004   6.469
  648    HA   CYS  33           HA       CYS  33   1.481  -0.554   6.743
  649    HB2  CYS  33           HB2      CYS  33   2.850   1.490   5.019
  650    HB3  CYS  33           HB3      CYS  33   1.141   1.400   5.347
  651    H    GLU  34           H        GLU  34   3.889  -0.908   4.327
  652    HA   GLU  34           HA       GLU  34   2.335  -1.627   2.174
  653    HB2  GLU  34           HB2      GLU  34   4.689  -1.090   2.004
  654    HB3  GLU  34           HB3      GLU  34   5.121  -2.522   2.918
  655    HG2  GLU  34           HG2      GLU  34   3.699  -2.616   0.272
  656    HG3  GLU  34           HG3      GLU  34   5.431  -2.629   0.439
  657    H    ARG  35           H        ARG  35   3.497  -3.568   4.884
  658    HA   ARG  35           HA       ARG  35   2.215  -5.937   3.905
  659    HB2  ARG  35           HB2      ARG  35   3.053  -5.350   6.746
  660    HB3  ARG  35           HB3      ARG  35   2.734  -6.933   6.049
  661    HG2  ARG  35           HG2      ARG  35   4.650  -6.768   4.637
  662    HG3  ARG  35           HG3      ARG  35   4.924  -5.099   5.136
  663    HD2  ARG  35           HD2      ARG  35   5.165  -7.579   6.818
  664    HD3  ARG  35           HD3      ARG  35   6.442  -6.486   6.306
  665    HE   ARG  35           HE       ARG  35   4.944  -4.819   7.703
  666   HH11  ARG  35          HH11      ARG  35   5.935  -8.086   8.444
  667   HH12  ARG  35          HH12      ARG  35   6.004  -7.820  10.157
  668   HH21  ARG  35          HH21      ARG  35   5.038  -4.450   9.981
  669   HH22  ARG  35          HH22      ARG  35   5.483  -5.768  11.029
  670    H    LYS  36           H        LYS  36   1.262  -3.272   5.789
  671    HA   LYS  36           HA       LYS  36  -0.791  -4.376   7.315
  672    HB2  LYS  36           HB2      LYS  36  -0.414  -1.590   6.264
  673    HB3  LYS  36           HB3      LYS  36  -1.595  -2.050   7.436
  674    HG2  LYS  36           HG2      LYS  36   0.341  -2.791   8.865
  675    HG3  LYS  36           HG3      LYS  36   1.371  -2.014   7.734
  676    HD2  LYS  36           HD2      LYS  36   0.057  -0.002   8.160
  677    HD3  LYS  36           HD3      LYS  36  -0.770  -0.828   9.452
  678    HE2  LYS  36           HE2      LYS  36   2.186  -0.272   9.241
  679    HE3  LYS  36           HE3      LYS  36   1.047   0.508  10.333
  680    HZ1  LYS  36           HZ1      LYS  36   0.771  -1.472  11.551
  681    HZ2  LYS  36           HZ2      LYS  36   2.443  -1.310  11.314
  682    HZ3  LYS  36           HZ3      LYS  36   1.555  -2.408  10.381
  683    H    VAL  37           H        VAL  37  -0.582  -2.909   4.221
  684    HA   VAL  37           HA       VAL  37  -3.220  -2.672   3.564
  685    HB   VAL  37           HB       VAL  37  -2.551  -2.693   1.224
  686   HG11  VAL  37          HG11      VAL  37  -0.499  -1.205   2.846
  687   HG12  VAL  37          HG12      VAL  37  -2.173  -0.676   2.667
  688   HG13  VAL  37          HG13      VAL  37  -1.123  -0.771   1.253
  689   HG21  VAL  37          HG21      VAL  37  -1.005  -4.326   0.917
  690   HG22  VAL  37          HG22      VAL  37  -0.036  -3.830   2.311
  691   HG23  VAL  37          HG23      VAL  37  -0.018  -2.864   0.828
  692    H    ILE  38           H        ILE  38  -1.079  -5.343   2.940
  693    HA   ILE  38           HA       ILE  38  -2.730  -7.004   1.437
  694    HB   ILE  38           HB       ILE  38  -0.716  -8.099   3.377
  695   HG12  ILE  38          HG12      ILE  38  -0.153  -6.422   0.954
  696   HG13  ILE  38          HG13      ILE  38   0.503  -6.263   2.570
  697   HG21  ILE  38          HG21      ILE  38  -1.579  -8.840   0.600
  698   HG22  ILE  38          HG22      ILE  38  -1.832  -9.743   2.091
  699   HG23  ILE  38          HG23      ILE  38  -0.208  -9.581   1.422
  700   HD11  ILE  38          HD11      ILE  38   1.099  -8.714   0.985
  701   HD12  ILE  38          HD12      ILE  38   2.031  -7.945   2.271
  702   HD13  ILE  38          HD13      ILE  38   1.978  -7.219   0.665
  703    H    SER  39           H        SER  39  -2.340  -6.394   4.781
  704    HA   SER  39           HA       SER  39  -3.771  -8.699   5.584
  705    HB2  SER  39           HB2      SER  39  -1.994  -7.728   7.003
  706    HB3  SER  39           HB3      SER  39  -2.989  -6.292   7.236
  707    HG   SER  39           HG       SER  39  -3.848  -8.905   7.937
  708    H    THR  40           H        THR  40  -4.500  -5.459   4.804
  709    HA   THR  40           HA       THR  40  -7.042  -5.340   6.169
  710    HB   THR  40           HB       THR  40  -5.795  -3.431   4.189
  711    HG1  THR  40           HG1      THR  40  -4.512  -3.696   6.067
  712   HG21  THR  40          HG21      THR  40  -7.994  -2.970   6.206
  713   HG22  THR  40          HG22      THR  40  -8.223  -3.121   4.465
  714   HG23  THR  40          HG23      THR  40  -7.302  -1.766   5.115
  715    H    SER  41           H        SER  41  -5.887  -5.891   2.886
  716    HA   SER  41           HA       SER  41  -8.407  -5.295   1.651
  717    HB2  SER  41           HB2      SER  41  -7.190  -6.159  -0.398
  718    HB3  SER  41           HB3      SER  41  -6.463  -4.772   0.415
  719    HG   SER  41           HG       SER  41  -4.753  -6.026   0.312
  720    H    THR  42           H        THR  42  -7.100  -8.108   3.061
  721    HA   THR  42           HA       THR  42  -8.224  -9.967   1.198
  722    HB   THR  42           HB       THR  42  -7.528 -11.672   2.942
  723    HG1  THR  42           HG1      THR  42  -7.423  -9.570   4.493
  724   HG21  THR  42          HG21      THR  42  -5.443  -9.716   1.960
  725   HG22  THR  42          HG22      THR  42  -6.148 -11.025   1.008
  726   HG23  THR  42          HG23      THR  42  -5.160 -11.396   2.421
  727    H    SER  43           H        SER  43 -10.191  -8.275   2.079
  728    HA   SER  43           HA       SER  43 -12.170 -10.199   2.888
  729    HB2  SER  43           HB2      SER  43 -11.702  -7.718   4.572
  730    HB3  SER  43           HB3      SER  43 -13.074  -8.812   4.734
  731    HG   SER  43           HG       SER  43 -10.862 -10.273   4.805
  732    H    ASP  44           H        ASP  44 -11.639  -8.843   0.499
  733    HA   ASP  44           HA       ASP  44 -14.037  -7.192   0.259
  734    HB2  ASP  44           HB2      ASP  44 -12.320  -5.538   0.492
  735    HB3  ASP  44           HB3      ASP  44 -11.304  -6.338  -0.696
  736    HA   PRO  45           HA       PRO  45 -12.698  -8.596  -4.210
  737    HB2  PRO  45           HB2      PRO  45 -11.035 -10.970  -3.644
  738    HB3  PRO  45           HB3      PRO  45 -10.799  -9.684  -4.832
  739    HG2  PRO  45           HG2      PRO  45  -9.285  -9.848  -2.633
  740    HG3  PRO  45           HG3      PRO  45  -9.778  -8.292  -3.301
  741    HD2  PRO  45           HD2      PRO  45 -10.844  -9.743  -0.959
  742    HD3  PRO  45           HD3      PRO  45 -10.565  -8.017  -1.168
  743    H    ASP  46           H        ASP  46 -13.367 -10.424  -5.535
  744    HA   ASP  46           HA       ASP  46 -14.802 -12.056  -6.125
  745    HB2  ASP  46           HB2      ASP  46 -14.282 -13.046  -3.322
  746    HB3  ASP  46           HB3      ASP  46 -15.299 -13.904  -4.471
  747    H    TYR  47           H        TYR  47 -15.639  -9.540  -4.908
  748    HA   TYR  47           HA       TYR  47 -18.441 -10.280  -4.552
  749    HB2  TYR  47           HB2      TYR  47 -16.815  -8.531  -2.761
  750    HB3  TYR  47           HB3      TYR  47 -18.532  -8.232  -2.950
  751    HD1  TYR  47           HD1      TYR  47 -20.158 -10.009  -2.279
  752    HD2  TYR  47           HD2      TYR  47 -16.010 -10.288  -1.383
  753    HE1  TYR  47           HE1      TYR  47 -20.647 -11.703  -0.567
  754    HE2  TYR  47           HE2      TYR  47 -16.489 -11.983   0.330
  755    HH   TYR  47           HH       TYR  47 -19.500 -13.531   0.600
  756    H    ALA  48           H        ALA  48 -19.841  -8.996  -5.627
  757    HA   ALA  48           HA       ALA  48 -18.754  -7.255  -7.615
  758    HB1  ALA  48           HB1      ALA  48 -21.055  -7.020  -8.371
  759    HB2  ALA  48           HB2      ALA  48 -21.626  -7.828  -6.913
  760    HB3  ALA  48           HB3      ALA  48 -20.654  -8.714  -8.088
  Start of MODEL    5
    1    H1   SER   0           H1       SER   0  -0.228  13.740  -5.006
    2    H2   SER   0           H2       SER   0   1.326  14.321  -5.360
    3    H3   SER   0           H3       SER   0  -0.032  15.248  -5.751
    4    HA   SER   0           HA       SER   0   0.840  14.545  -3.016
    5    HB2  SER   0           HB2      SER   0   0.870  17.238  -4.400
    6    HB3  SER   0           HB3      SER   0   1.533  16.847  -2.814
    7    HG   SER   0           HG       SER   0   3.000  16.936  -4.757
    8    H    MET   1           H        MET   1  -0.208  16.745  -1.772
    9    HA   MET   1           HA       MET   1  -2.073  17.700  -0.922
   10    HB2  MET   1           HB2      MET   1  -3.237  16.971  -3.603
   11    HB3  MET   1           HB3      MET   1  -4.137  17.838  -2.367
   12    HG2  MET   1           HG2      MET   1  -1.579  18.767  -3.654
   13    HG3  MET   1           HG3      MET   1  -3.200  19.340  -4.046
   14    HE1  MET   1           HE1      MET   1  -0.836  21.320  -3.313
   15    HE2  MET   1           HE2      MET   1  -1.670  22.434  -2.229
   16    HE3  MET   1           HE3      MET   1  -2.479  21.844  -3.680
   17    H    ASP   2           H        ASP   2  -4.236  17.219  -0.098
   18    HA   ASP   2           HA       ASP   2  -4.764  14.329   0.118
   19    HB2  ASP   2           HB2      ASP   2  -3.632  15.199   2.158
   20    HB3  ASP   2           HB3      ASP   2  -4.931  16.369   2.355
   21    H    GLU   3           H        GLU   3  -6.043  17.570   0.734
   22    HA   GLU   3           HA       GLU   3  -7.961  18.601   0.162
   23    HB2  GLU   3           HB2      GLU   3  -8.223  16.284  -1.750
   24    HB3  GLU   3           HB3      GLU   3  -9.262  17.701  -1.760
   25    HG2  GLU   3           HG2      GLU   3  -7.226  19.099  -2.107
   26    HG3  GLU   3           HG3      GLU   3  -6.306  17.606  -2.293
   27    H    THR   4           H        THR   4 -10.488  17.800  -0.448
   28    HA   THR   4           HA       THR   4 -11.447  17.171   2.140
   29    HB   THR   4           HB       THR   4 -13.699  17.129   0.920
   30    HG1  THR   4           HG1      THR   4 -13.542  18.097  -1.220
   31   HG21  THR   4          HG21      THR   4 -13.693  19.567   0.605
   32   HG22  THR   4          HG22      THR   4 -11.931  19.565   0.677
   33   HG23  THR   4          HG23      THR   4 -12.871  19.101   2.094
   34    H    VAL   5           H        VAL   5 -12.021  15.484  -0.945
   35    HA   VAL   5           HA       VAL   5 -12.336  13.303  -1.478
   36    HB   VAL   5           HB       VAL   5 -10.971  12.753   1.162
   37   HG11  VAL   5          HG11      VAL   5 -12.196  10.805   0.530
   38   HG12  VAL   5          HG12      VAL   5 -10.502  10.525   0.125
   39   HG13  VAL   5          HG13      VAL   5 -11.655  10.946  -1.142
   40   HG21  VAL   5          HG21      VAL   5  -9.564  14.003  -0.382
   41   HG22  VAL   5          HG22      VAL   5  -9.893  12.829  -1.655
   42   HG23  VAL   5          HG23      VAL   5  -8.985  12.345  -0.223
   43    H    LYS   6           H        LYS   6 -14.475  12.971  -1.541
   44    HA   LYS   6           HA       LYS   6 -15.884  12.568   0.996
   45    HB2  LYS   6           HB2      LYS   6 -16.994  13.303  -1.690
   46    HB3  LYS   6           HB3      LYS   6 -17.949  13.067  -0.240
   47    HG2  LYS   6           HG2      LYS   6 -15.843  15.181  -0.647
   48    HG3  LYS   6           HG3      LYS   6 -17.591  15.429  -0.694
   49    HD2  LYS   6           HD2      LYS   6 -17.737  14.711   1.647
   50    HD3  LYS   6           HD3      LYS   6 -15.992  14.491   1.689
   51    HE2  LYS   6           HE2      LYS   6 -16.569  16.601   2.693
   52    HE3  LYS   6           HE3      LYS   6 -15.719  16.874   1.180
   53    HZ1  LYS   6           HZ1      LYS   6 -18.662  17.005   1.519
   54    HZ2  LYS   6           HZ2      LYS   6 -17.806  17.343   0.098
   55    HZ3  LYS   6           HZ3      LYS   6 -17.633  18.343   1.450
   56    H    LEU   7           H        LEU   7 -16.945  11.499  -2.194
   57    HA   LEU   7           HA       LEU   7 -17.688   8.972  -1.060
   58    HB2  LEU   7           HB2      LEU   7 -18.724   8.472  -3.160
   59    HB3  LEU   7           HB3      LEU   7 -19.107  10.115  -2.726
   60    HG   LEU   7           HG       LEU   7 -16.935   9.432  -4.699
   61   HD11  LEU   7          HD11      LEU   7 -19.025   8.474  -5.501
   62   HD12  LEU   7          HD12      LEU   7 -18.564   9.878  -6.462
   63   HD13  LEU   7          HD13      LEU   7 -19.840  10.018  -5.253
   64   HD21  LEU   7          HD21      LEU   7 -17.442  11.743  -5.471
   65   HD22  LEU   7          HD22      LEU   7 -16.779  11.652  -3.841
   66   HD23  LEU   7          HD23      LEU   7 -18.505  11.916  -4.074
   67    H    ASN   8           H        ASN   8 -15.544   9.854  -3.775
   68    HA   ASN   8           HA       ASN   8 -14.289   7.227  -3.602
   69    HB2  ASN   8           HB2      ASN   8 -13.616   9.476  -5.505
   70    HB3  ASN   8           HB3      ASN   8 -13.134   7.801  -5.643
   71   HD21  ASN   8          HD21      ASN   8 -14.537   9.446  -7.546
   72   HD22  ASN   8          HD22      ASN   8 -16.032   8.646  -7.858
   73    H    HIS   9           H        HIS   9 -12.288   6.906  -2.749
   74    HA   HIS   9           HA       HIS   9 -11.047   9.213  -1.450
   75    HB2  HIS   9           HB2      HIS   9 -10.375   6.284  -1.174
   76    HB3  HIS   9           HB3      HIS   9  -9.710   7.590  -0.213
   77    HD1  HIS   9           HD1      HIS   9 -10.779   7.872   1.988
   78    HD2  HIS   9           HD2      HIS   9 -13.363   6.143  -0.768
   79    HE1  HIS   9           HE1      HIS   9 -12.873   7.334   3.270
   80    HE2  HIS   9           HE2      HIS   9 -14.464   6.394   1.557
   81    H    THR  10           H        THR  10  -9.062   9.962  -2.035
   82    HA   THR  10           HA       THR  10  -8.190   9.235  -4.664
   83    HB   THR  10           HB       THR  10  -6.823  11.078  -2.683
   84    HG1  THR  10           HG1      THR  10  -8.014  12.718  -3.771
   85   HG21  THR  10          HG21      THR  10  -5.384  10.432  -4.565
   86   HG22  THR  10          HG22      THR  10  -5.859  12.124  -4.697
   87   HG23  THR  10          HG23      THR  10  -6.643  10.909  -5.703
   88    H    CYS  11           H        CYS  11  -6.729   7.822  -5.223
   89    HA   CYS  11           HA       CYS  11  -5.406   6.178  -3.319
   90    HB2  CYS  11           HB2      CYS  11  -5.970   5.362  -5.566
   91    HB3  CYS  11           HB3      CYS  11  -4.900   6.551  -6.283
   92    H    VAL  12           H        VAL  12  -3.700   6.701  -2.161
   93    HA   VAL  12           HA       VAL  12  -2.108   8.968  -2.471
   94    HB   VAL  12           HB       VAL  12  -0.432   7.739  -1.034
   95   HG11  VAL  12          HG11      VAL  12  -2.202   9.096  -0.046
   96   HG12  VAL  12          HG12      VAL  12  -1.858   7.675   0.945
   97   HG13  VAL  12          HG13      VAL  12  -3.291   7.710  -0.084
   98   HG21  VAL  12          HG21      VAL  12  -1.089   5.585  -0.097
   99   HG22  VAL  12          HG22      VAL  12  -0.896   5.479  -1.846
  100   HG23  VAL  12          HG23      VAL  12  -2.510   5.554  -1.140
  101    H    ILE  13           H        ILE  13  -2.165   6.144  -4.294
  102    HA   ILE  13           HA       ILE  13   0.613   6.285  -5.167
  103    HB   ILE  13           HB       ILE  13  -1.375   4.311  -6.155
  104   HG12  ILE  13          HG12      ILE  13  -1.516   4.344  -3.688
  105   HG13  ILE  13          HG13      ILE  13  -0.867   2.847  -4.331
  106   HG21  ILE  13          HG21      ILE  13   1.581   4.159  -5.652
  107   HG22  ILE  13          HG22      ILE  13   0.818   4.434  -7.220
  108   HG23  ILE  13          HG23      ILE  13   0.577   2.900  -6.378
  109   HD11  ILE  13          HD11      ILE  13   0.753   5.084  -3.192
  110   HD12  ILE  13          HD12      ILE  13   1.360   3.541  -3.794
  111   HD13  ILE  13          HD13      ILE  13   0.327   3.585  -2.364
  112    H    CYS  14           H        CYS  14  -2.612   6.092  -6.583
  113    HA   CYS  14           HA       CYS  14  -1.635   6.798  -9.199
  114    HB2  CYS  14           HB2      CYS  14  -4.413   6.356  -8.186
  115    HB3  CYS  14           HB3      CYS  14  -4.023   6.617  -9.860
  116    H    ASP  15           H        ASP  15  -2.799   8.472  -6.477
  117    HA   ASP  15           HA       ASP  15  -3.640  10.522  -6.047
  118    HB2  ASP  15           HB2      ASP  15  -2.099  11.094  -8.514
  119    HB3  ASP  15           HB3      ASP  15  -2.944  12.365  -7.666
  120    H    GLN  16           H        GLN  16  -5.360   8.747  -7.215
  121    HA   GLN  16           HA       GLN  16  -7.132  10.461  -8.800
  122    HB2  GLN  16           HB2      GLN  16  -6.702   7.487  -9.148
  123    HB3  GLN  16           HB3      GLN  16  -7.862   8.459 -10.028
  124    HG2  GLN  16           HG2      GLN  16  -4.895   8.758 -10.146
  125    HG3  GLN  16           HG3      GLN  16  -5.889   7.971 -11.353
  126   HE21  GLN  16          HE21      GLN  16  -4.112  10.203 -11.658
  127   HE22  GLN  16          HE22      GLN  16  -5.073  11.505 -12.255
  128    H    GLU  17           H        GLU  17  -9.305  10.282  -8.275
  129    HA   GLU  17           HA       GLU  17  -9.839   9.400  -5.611
  130    HB2  GLU  17           HB2      GLU  17 -11.580  10.776  -7.648
  131    HB3  GLU  17           HB3      GLU  17 -12.077  10.403  -6.008
  132    HG2  GLU  17           HG2      GLU  17 -10.409  11.809  -5.085
  133    HG3  GLU  17           HG3      GLU  17  -9.689  12.055  -6.667
  134    H    LYS  18           H        LYS  18 -10.136   7.444  -5.280
  135    HA   LYS  18           HA       LYS  18 -11.849   5.794  -7.022
  136    HB2  LYS  18           HB2      LYS  18  -9.782   4.471  -5.419
  137    HB3  LYS  18           HB3      LYS  18 -10.408   4.046  -6.981
  138    HG2  LYS  18           HG2      LYS  18  -8.441   6.236  -6.434
  139    HG3  LYS  18           HG3      LYS  18  -8.062   4.646  -7.091
  140    HD2  LYS  18           HD2      LYS  18 -10.082   6.316  -8.470
  141    HD3  LYS  18           HD3      LYS  18  -8.398   6.729  -8.640
  142    HE2  LYS  18           HE2      LYS  18  -9.136   5.327 -10.464
  143    HE3  LYS  18           HE3      LYS  18  -7.953   4.516  -9.465
  144    HZ1  LYS  18           HZ1      LYS  18 -10.873   4.084  -9.265
  145    HZ2  LYS  18           HZ2      LYS  18  -9.671   3.218  -8.447
  146    HZ3  LYS  18           HZ3      LYS  18  -9.818   3.082 -10.125
  147    H    ASN  19           H        ASN  19 -13.536   4.839  -5.999
  148    HA   ASN  19           HA       ASN  19 -13.765   5.234  -3.156
  149    HB2  ASN  19           HB2      ASN  19 -15.746   5.686  -4.309
  150    HB3  ASN  19           HB3      ASN  19 -15.629   4.206  -5.237
  151   HD21  ASN  19          HD21      ASN  19 -16.437   2.333  -4.433
  152   HD22  ASN  19          HD22      ASN  19 -17.332   2.245  -2.922
  153    H    ARG  20           H        ARG  20 -12.853   2.654  -5.264
  154    HA   ARG  20           HA       ARG  20 -13.152   0.766  -3.040
  155    HB2  ARG  20           HB2      ARG  20 -13.018   0.266  -5.999
  156    HB3  ARG  20           HB3      ARG  20 -12.743  -1.001  -4.832
  157    HG2  ARG  20           HG2      ARG  20 -14.963  -0.530  -3.883
  158    HG3  ARG  20           HG3      ARG  20 -15.213   0.632  -5.179
  159    HD2  ARG  20           HD2      ARG  20 -14.964  -1.014  -6.833
  160    HD3  ARG  20           HD3      ARG  20 -14.457  -2.160  -5.628
  161    HE   ARG  20           HE       ARG  20 -17.185  -1.066  -5.778
  162   HH11  ARG  20          HH11      ARG  20 -15.030  -3.782  -5.202
  163   HH12  ARG  20          HH12      ARG  20 -16.330  -4.873  -4.833
  164   HH21  ARG  20          HH21      ARG  20 -18.868  -2.527  -5.293
  165   HH22  ARG  20          HH22      ARG  20 -18.484  -4.170  -4.867
  166    H    GLY  21           H        GLY  21 -11.551  -0.121  -2.081
  167    HA2  GLY  21           HA2      GLY  21  -9.063  -0.882  -2.741
  168    HA3  GLY  21           HA3      GLY  21  -8.863   0.854  -2.546
  169    H    ILE  22           H        ILE  22  -7.478   0.321  -0.574
  170    HA   ILE  22           HA       ILE  22  -9.246  -0.362   1.670
  171    HB   ILE  22           HB       ILE  22  -7.585  -1.514   2.768
  172   HG12  ILE  22          HG12      ILE  22  -5.585  -0.104   1.042
  173   HG13  ILE  22          HG13      ILE  22  -5.987   0.326   2.668
  174   HG21  ILE  22          HG21      ILE  22  -6.423  -2.996   1.150
  175   HG22  ILE  22          HG22      ILE  22  -6.971  -1.937  -0.150
  176   HG23  ILE  22          HG23      ILE  22  -8.149  -2.813   0.827
  177   HD11  ILE  22          HD11      ILE  22  -3.980  -0.836   2.836
  178   HD12  ILE  22          HD12      ILE  22  -4.521  -2.081   1.697
  179   HD13  ILE  22          HD13      ILE  22  -5.224  -1.996   3.313
  180    H    HIS  23           H        HIS  23  -7.872   0.360   3.719
  181    HA   HIS  23           HA       HIS  23  -6.849   3.015   3.516
  182    HB2  HIS  23           HB2      HIS  23  -8.627   4.064   4.921
  183    HB3  HIS  23           HB3      HIS  23  -9.190   3.598   3.335
  184    HD1  HIS  23           HD1      HIS  23  -9.752   3.017   6.951
  185    HD2  HIS  23           HD2      HIS  23 -10.977   1.454   3.321
  186    HE1  HIS  23           HE1      HIS  23 -11.775   1.620   7.478
  187    HE2  HIS  23           HE2      HIS  23 -12.401   0.546   5.287
  188    H    LEU  24           H        LEU  24  -5.190   2.840   4.811
  189    HA   LEU  24           HA       LEU  24  -5.227   1.011   7.038
  190    HB2  LEU  24           HB2      LEU  24  -3.203   2.294   5.442
  191    HB3  LEU  24           HB3      LEU  24  -2.871   2.547   7.124
  192    HG   LEU  24           HG       LEU  24  -1.673   0.627   6.412
  193   HD11  LEU  24          HD11      LEU  24  -4.100  -0.257   7.950
  194   HD12  LEU  24          HD12      LEU  24  -2.618   0.402   8.634
  195   HD13  LEU  24          HD13      LEU  24  -2.590  -1.149   7.800
  196   HD21  LEU  24          HD21      LEU  24  -2.681  -1.281   5.463
  197   HD22  LEU  24          HD22      LEU  24  -2.954   0.142   4.457
  198   HD23  LEU  24          HD23      LEU  24  -4.254  -0.487   5.470
  199    H    TYR  25           H        TYR  25  -3.977   4.303   6.900
  200    HA   TYR  25           HA       TYR  25  -4.861   4.660   9.643
  201    HB2  TYR  25           HB2      TYR  25  -3.006   6.446   8.120
  202    HB3  TYR  25           HB3      TYR  25  -3.267   6.435   9.848
  203    HD1  TYR  25           HD1      TYR  25  -3.139   3.087   8.749
  204    HD2  TYR  25           HD2      TYR  25  -0.608   6.426   9.539
  205    HE1  TYR  25           HE1      TYR  25  -1.237   1.579   8.919
  206    HE2  TYR  25           HE2      TYR  25   1.334   4.917   9.742
  207    HH   TYR  25           HH       TYR  25   1.732   2.542  10.299
  208    H    THR  26           H        THR  26  -4.295   7.410   7.609
  209    HA   THR  26           HA       THR  26  -7.181   7.965   7.636
  210    HB   THR  26           HB       THR  26  -6.672  10.296   7.543
  211    HG1  THR  26           HG1      THR  26  -4.941  10.885   6.481
  212   HG21  THR  26          HG21      THR  26  -6.341   9.225   9.746
  213   HG22  THR  26          HG22      THR  26  -5.302  10.632   9.523
  214   HG23  THR  26          HG23      THR  26  -4.635   9.005   9.356
  215    H    LYS  27           H        LYS  27  -5.162   6.501   5.662
  216    HA   LYS  27           HA       LYS  27  -5.587   8.229   3.319
  217    HB2  LYS  27           HB2      LYS  27  -3.654   6.045   3.026
  218    HB3  LYS  27           HB3      LYS  27  -3.554   7.709   2.498
  219    HG2  LYS  27           HG2      LYS  27  -2.945   6.620   5.212
  220    HG3  LYS  27           HG3      LYS  27  -1.815   7.249   4.024
  221    HD2  LYS  27           HD2      LYS  27  -3.945   8.866   5.395
  222    HD3  LYS  27           HD3      LYS  27  -2.240   8.833   5.851
  223    HE2  LYS  27           HE2      LYS  27  -2.496   9.323   3.038
  224    HE3  LYS  27           HE3      LYS  27  -3.463  10.491   3.941
  225    HZ1  LYS  27           HZ1      LYS  27  -1.446  10.949   5.290
  226    HZ2  LYS  27           HZ2      LYS  27  -1.254  11.341   3.658
  227    HZ3  LYS  27           HZ3      LYS  27  -0.557   9.929   4.272
  228    H    PHE  28           H        PHE  28  -5.087   6.743   1.322
  229    HA   PHE  28           HA       PHE  28  -6.705   4.332   1.363
  230    HB2  PHE  28           HB2      PHE  28  -8.395   5.938   0.889
  231    HB3  PHE  28           HB3      PHE  28  -7.354   6.808  -0.231
  232    HD1  PHE  28           HD1      PHE  28  -9.396   3.782   0.231
  233    HD2  PHE  28           HD2      PHE  28  -7.109   6.116  -2.485
  234    HE1  PHE  28           HE1      PHE  28 -10.305   2.486  -1.649
  235    HE2  PHE  28           HE2      PHE  28  -8.008   4.828  -4.371
  236    HZ   PHE  28           HZ       PHE  28  -9.606   3.000  -3.966
  237    H    ILE  29           H        ILE  29  -5.447   2.885   0.409
  238    HA   ILE  29           HA       ILE  29  -4.002   3.618  -2.039
  239    HB   ILE  29           HB       ILE  29  -4.078   0.928  -0.637
  240   HG12  ILE  29          HG12      ILE  29  -1.564   1.597  -0.263
  241   HG13  ILE  29          HG13      ILE  29  -2.180   3.239  -0.419
  242   HG21  ILE  29          HG21      ILE  29  -3.686   0.818  -3.058
  243   HG22  ILE  29          HG22      ILE  29  -2.258   0.322  -2.138
  244   HG23  ILE  29          HG23      ILE  29  -2.315   1.923  -2.876
  245   HD11  ILE  29          HD11      ILE  29  -3.231   1.223   1.547
  246   HD12  ILE  29          HD12      ILE  29  -3.629   2.939   1.455
  247   HD13  ILE  29          HD13      ILE  29  -2.001   2.432   1.915
  248    H    CYS  30           H        CYS  30  -4.981   3.209  -3.987
  249    HA   CYS  30           HA       CYS  30  -7.612   2.154  -3.995
  250    HB2  CYS  30           HB2      CYS  30  -7.689   2.536  -6.280
  251    HB3  CYS  30           HB3      CYS  30  -6.495   3.700  -5.765
  252    H    LEU  31           H        LEU  31  -8.342   0.289  -4.876
  253    HA   LEU  31           HA       LEU  31  -7.331  -1.896  -3.640
  254    HB2  LEU  31           HB2      LEU  31  -9.109  -3.043  -4.585
  255    HB3  LEU  31           HB3      LEU  31  -9.654  -1.400  -4.546
  256    HG   LEU  31           HG       LEU  31  -8.716  -1.393  -7.029
  257   HD11  LEU  31          HD11      LEU  31  -9.525  -4.271  -6.616
  258   HD12  LEU  31          HD12      LEU  31  -7.893  -3.698  -6.958
  259   HD13  LEU  31          HD13      LEU  31  -9.166  -3.500  -8.162
  260   HD21  LEU  31          HD21      LEU  31 -10.996  -1.925  -7.784
  261   HD22  LEU  31          HD22      LEU  31 -10.975  -0.828  -6.403
  262   HD23  LEU  31          HD23      LEU  31 -11.368  -2.531  -6.171
  263    H    ASP  32           H        ASP  32  -6.434  -0.616  -6.646
  264    HA   ASP  32           HA       ASP  32  -5.531  -3.117  -7.782
  265    HB2  ASP  32           HB2      ASP  32  -6.416  -0.920  -8.978
  266    HB3  ASP  32           HB3      ASP  32  -4.714  -0.518  -8.907
  267    H    CYS  33           H        CYS  33  -4.260  -0.207  -6.348
  268    HA   CYS  33           HA       CYS  33  -1.531  -0.946  -6.645
  269    HB2  CYS  33           HB2      CYS  33  -2.794   1.180  -4.938
  270    HB3  CYS  33           HB3      CYS  33  -1.090   0.857  -4.984
  271    H    GLU  34           H        GLU  34  -3.994  -1.241  -4.283
  272    HA   GLU  34           HA       GLU  34  -2.594  -2.120  -2.097
  273    HB2  GLU  34           HB2      GLU  34  -4.919  -1.666  -1.937
  274    HB3  GLU  34           HB3      GLU  34  -5.300  -2.811  -3.187
  275    HG2  GLU  34           HG2      GLU  34  -4.048  -3.869  -0.762
  276    HG3  GLU  34           HG3      GLU  34  -5.697  -3.309  -0.638
  277    H    ARG  35           H        ARG  35  -3.821  -3.971  -4.814
  278    HA   ARG  35           HA       ARG  35  -2.399  -6.278  -3.952
  279    HB2  ARG  35           HB2      ARG  35  -3.037  -7.279  -6.179
  280    HB3  ARG  35           HB3      ARG  35  -4.302  -6.938  -5.013
  281    HG2  ARG  35           HG2      ARG  35  -4.314  -4.659  -6.409
  282    HG3  ARG  35           HG3      ARG  35  -3.789  -5.791  -7.632
  283    HD2  ARG  35           HD2      ARG  35  -6.227  -5.567  -7.586
  284    HD3  ARG  35           HD3      ARG  35  -5.700  -7.187  -7.153
  285    HE   ARG  35           HE       ARG  35  -6.049  -5.454  -4.890
  286   HH11  ARG  35          HH11      ARG  35  -7.727  -7.651  -7.049
  287   HH12  ARG  35          HH12      ARG  35  -8.960  -8.030  -5.888
  288   HH21  ARG  35          HH21      ARG  35  -7.625  -5.946  -3.377
  289   HH22  ARG  35          HH22      ARG  35  -8.911  -7.053  -3.795
  290    H    LYS  36           H        LYS  36  -1.518  -3.645  -5.942
  291    HA   LYS  36           HA       LYS  36   0.454  -4.867  -7.522
  292    HB2  LYS  36           HB2      LYS  36   0.124  -2.077  -6.457
  293    HB3  LYS  36           HB3      LYS  36   1.410  -2.549  -7.521
  294    HG2  LYS  36           HG2      LYS  36  -0.356  -3.209  -9.191
  295    HG3  LYS  36           HG3      LYS  36  -1.483  -2.411  -8.128
  296    HD2  LYS  36           HD2      LYS  36  -0.348  -0.368  -8.268
  297    HD3  LYS  36           HD3      LYS  36   0.906  -1.143  -9.191
  298    HE2  LYS  36           HE2      LYS  36  -0.434   0.047 -10.707
  299    HE3  LYS  36           HE3      LYS  36  -0.771  -1.654 -10.950
  300    HZ1  LYS  36           HZ1      LYS  36  -2.438   0.149  -9.294
  301    HZ2  LYS  36           HZ2      LYS  36  -2.808  -1.437  -9.777
  302    HZ3  LYS  36           HZ3      LYS  36  -2.748  -0.191 -10.919
  303    H    VAL  37           H        VAL  37   0.386  -3.274  -4.440
  304    HA   VAL  37           HA       VAL  37   3.035  -3.171  -3.844
  305    HB   VAL  37           HB       VAL  37   2.440  -3.110  -1.494
  306   HG11  VAL  37          HG11      VAL  37   1.918  -1.167  -3.117
  307   HG12  VAL  37          HG12      VAL  37   1.219  -1.124  -1.501
  308   HG13  VAL  37          HG13      VAL  37   0.229  -1.635  -2.874
  309   HG21  VAL  37          HG21      VAL  37  -0.105  -4.272  -2.440
  310   HG22  VAL  37          HG22      VAL  37  -0.099  -3.216  -1.025
  311   HG23  VAL  37          HG23      VAL  37   0.887  -4.681  -1.034
  312    H    ILE  38           H        ILE  38   0.789  -5.724  -3.125
  313    HA   ILE  38           HA       ILE  38   2.443  -7.512  -1.762
  314    HB   ILE  38           HB       ILE  38   0.249  -8.427  -3.599
  315   HG12  ILE  38          HG12      ILE  38  -0.044  -6.874  -1.054
  316   HG13  ILE  38          HG13      ILE  38  -0.772  -6.545  -2.607
  317   HG21  ILE  38          HG21      ILE  38   1.223  -9.333  -0.907
  318   HG22  ILE  38          HG22      ILE  38   1.407 -10.167  -2.447
  319   HG23  ILE  38          HG23      ILE  38  -0.191  -9.994  -1.722
  320   HD11  ILE  38          HD11      ILE  38  -2.257  -7.490  -0.755
  321   HD12  ILE  38          HD12      ILE  38  -1.461  -9.027  -1.097
  322   HD13  ILE  38          HD13      ILE  38  -2.368  -8.205  -2.363
  323    H    SER  39           H        SER  39   1.824  -6.795  -5.053
  324    HA   SER  39           HA       SER  39   3.112  -9.126  -6.026
  325    HB2  SER  39           HB2      SER  39   1.255  -7.992  -7.259
  326    HB3  SER  39           HB3      SER  39   2.354  -6.654  -7.591
  327    HG   SER  39           HG       SER  39   2.284  -8.119  -9.332
  328    H    THR  40           H        THR  40   4.071  -6.027  -5.055
  329    HA   THR  40           HA       THR  40   6.517  -5.916  -6.586
  330    HB   THR  40           HB       THR  40   5.597  -4.160  -4.303
  331    HG1  THR  40           HG1      THR  40   4.228  -4.302  -6.292
  332   HG21  THR  40          HG21      THR  40   7.621  -3.643  -6.484
  333   HG22  THR  40          HG22      THR  40   8.006  -4.010  -4.802
  334   HG23  THR  40          HG23      THR  40   7.149  -2.521  -5.207
  335    H    SER  41           H        SER  41   5.609  -6.436  -3.184
  336    HA   SER  41           HA       SER  41   8.382  -6.353  -2.362
  337    HB2  SER  41           HB2      SER  41   7.327  -6.598  -0.078
  338    HB3  SER  41           HB3      SER  41   6.829  -5.179  -1.003
  339    HG   SER  41           HG       SER  41   5.074  -6.386  -0.003
  340    H    THR  42           H        THR  42   6.054  -8.862  -2.997
  341    HA   THR  42           HA       THR  42   6.898 -10.590  -0.908
  342    HB   THR  42           HB       THR  42   5.535 -12.323  -2.127
  343    HG1  THR  42           HG1      THR  42   4.461 -10.289  -3.716
  344   HG21  THR  42          HG21      THR  42   4.575 -10.953  -0.357
  345   HG22  THR  42          HG22      THR  42   3.394 -11.191  -1.644
  346   HG23  THR  42          HG23      THR  42   4.254  -9.654  -1.508
  347    H    SER  43           H        SER  43   8.064 -10.089  -4.125
  348    HA   SER  43           HA       SER  43   9.867 -12.380  -3.718
  349    HB2  SER  43           HB2      SER  43   8.281 -12.452  -5.737
  350    HB3  SER  43           HB3      SER  43   9.263 -11.153  -6.410
  351    HG   SER  43           HG       SER  43  10.367 -13.604  -5.513
  352    H    ASP  44           H        ASP  44  10.070  -9.620  -2.725
  353    HA   ASP  44           HA       ASP  44  12.639  -8.936  -3.995
  354    HB2  ASP  44           HB2      ASP  44  10.882  -7.227  -4.439
  355    HB3  ASP  44           HB3      ASP  44  10.719  -6.990  -2.703
  356    HA   PRO  45           HA       PRO  45  13.465  -9.914   0.389
  357    HB2  PRO  45           HB2      PRO  45  15.586 -11.497  -0.028
  358    HB3  PRO  45           HB3      PRO  45  13.949 -12.079  -0.296
  359    HG2  PRO  45           HG2      PRO  45  15.998 -11.170  -2.240
  360    HG3  PRO  45           HG3      PRO  45  14.861 -12.510  -2.331
  361    HD2  PRO  45           HD2      PRO  45  14.509 -10.035  -3.536
  362    HD3  PRO  45           HD3      PRO  45  13.210 -11.193  -3.197
  363    H    ASP  46           H        ASP  46  15.400  -9.555   1.699
  364    HA   ASP  46           HA       ASP  46  17.383  -7.762   0.497
  365    HB2  ASP  46           HB2      ASP  46  15.764  -6.291   1.568
  366    HB3  ASP  46           HB3      ASP  46  15.861  -7.224   3.058
  367    H    TYR  47           H        TYR  47  16.494  -9.289   3.584
  368    HA   TYR  47           HA       TYR  47  19.274  -9.780   4.190
  369    HB2  TYR  47           HB2      TYR  47  16.742 -10.350   5.690
  370    HB3  TYR  47           HB3      TYR  47  18.330 -10.805   6.285
  371    HD1  TYR  47           HD1      TYR  47  15.917  -8.148   5.954
  372    HD2  TYR  47           HD2      TYR  47  20.009  -8.994   6.756
  373    HE1  TYR  47           HE1      TYR  47  16.178  -5.918   6.957
  374    HE2  TYR  47           HE2      TYR  47  20.281  -6.766   7.757
  375    HH   TYR  47           HH       TYR  47  19.224  -4.567   7.675
  376    H    ALA  48           H        ALA  48  19.783 -11.206   2.484
  377    HA   ALA  48           HA       ALA  48  18.409 -13.717   2.223
  378    HB1  ALA  48           HB1      ALA  48  20.114 -14.248   0.568
  379    HB2  ALA  48           HB2      ALA  48  21.045 -12.831   1.050
  380    HB3  ALA  48           HB3      ALA  48  19.466 -12.632   0.291
  381    H1   SER   0           H1       SER   0   0.391  13.756   4.722
  382    H2   SER   0           H2       SER   0  -1.152  14.363   5.071
  383    H3   SER   0           H3       SER   0   0.217  15.267   5.463
  384    HA   SER   0           HA       SER   0  -0.662  14.573   2.726
  385    HB2  SER   0           HB2      SER   0  -0.650  17.271   4.099
  386    HB3  SER   0           HB3      SER   0  -1.319  16.884   2.515
  387    HG   SER   0           HG       SER   0  -2.791  17.006   4.449
  388    H    MET   1           H        MET   1   0.419  16.743   1.472
  389    HA   MET   1           HA       MET   1   2.298  17.669   0.619
  390    HB2  MET   1           HB2      MET   1   3.454  16.924   3.301
  391    HB3  MET   1           HB3      MET   1   4.367  17.774   2.062
  392    HG2  MET   1           HG2      MET   1   1.826  18.749   3.347
  393    HG3  MET   1           HG3      MET   1   3.456  19.295   3.737
  394    HE1  MET   1           HE1      MET   1   1.131  21.317   2.993
  395    HE2  MET   1           HE2      MET   1   1.984  22.407   1.903
  396    HE3  MET   1           HE3      MET   1   2.784  21.809   3.356
  397    H    ASP   2           H        ASP   2   4.458  17.151  -0.202
  398    HA   ASP   2           HA       ASP   2   4.933  14.250  -0.411
  399    HB2  ASP   2           HB2      ASP   2   3.813  15.131  -2.451
  400    HB3  ASP   2           HB3      ASP   2   5.132  16.277  -2.655
  401    H    GLU   3           H        GLU   3   6.270  17.463  -1.035
  402    HA   GLU   3           HA       GLU   3   8.202  18.467  -0.466
  403    HB2  GLU   3           HB2      GLU   3   8.431  16.151   1.453
  404    HB3  GLU   3           HB3      GLU   3   9.493  17.553   1.459
  405    HG2  GLU   3           HG2      GLU   3   7.483  18.984   1.808
  406    HG3  GLU   3           HG3      GLU   3   6.534  17.509   1.987
  407    H    THR   4           H        THR   4  10.719  17.617   0.146
  408    HA   THR   4           HA       THR   4  11.662  16.962  -2.442
  409    HB   THR   4           HB       THR   4  13.912  16.886  -1.226
  410    HG1  THR   4           HG1      THR   4  13.771  17.867   0.912
  411   HG21  THR   4          HG21      THR   4  13.947  19.325  -0.920
  412   HG22  THR   4          HG22      THR   4  12.185  19.352  -0.990
  413   HG23  THR   4          HG23      THR   4  13.115  18.868  -2.406
  414    H    VAL   5           H        VAL   5  12.207  15.274   0.652
  415    HA   VAL   5           HA       VAL   5  12.487  13.090   1.187
  416    HB   VAL   5           HB       VAL   5  11.109  12.555  -1.450
  417   HG11  VAL   5          HG11      VAL   5  12.300  10.591  -0.804
  418   HG12  VAL   5          HG12      VAL   5  10.602  10.341  -0.401
  419   HG13  VAL   5          HG13      VAL   5  11.761  10.749   0.865
  420   HG21  VAL   5          HG21      VAL   5   9.726  13.838   0.089
  421   HG22  VAL   5          HG22      VAL   5  10.032  12.662   1.367
  422   HG23  VAL   5          HG23      VAL   5   9.117  12.190  -0.063
  423    H    LYS   6           H        LYS   6  14.620  12.724   1.249
  424    HA   LYS   6           HA       LYS   6  16.017  12.285  -1.293
  425    HB2  LYS   6           HB2      LYS   6  17.145  13.016   1.403
  426    HB3  LYS   6           HB3      LYS   6  18.087  12.764  -0.050
  427    HG2  LYS   6           HG2      LYS   6  16.033  14.897   0.350
  428    HG3  LYS   6           HG3      LYS   6  17.776  15.121   0.396
  429    HD2  LYS   6           HD2      LYS   6  17.909  14.394  -1.944
  430    HD3  LYS   6           HD3      LYS   6  16.159  14.208  -1.984
  431    HE2  LYS   6           HE2      LYS   6  16.775  16.305  -2.993
  432    HE3  LYS   6           HE3      LYS   6  15.935  16.598  -1.478
  433    HZ1  LYS   6           HZ1      LYS   6  18.881  16.663  -1.819
  434    HZ2  LYS   6           HZ2      LYS   6  18.031  17.025  -0.404
  435    HZ3  LYS   6           HZ3      LYS   6  17.881  18.025  -1.755
  436    H    LEU   7           H        LEU   7  17.065  11.212   1.908
  437    HA   LEU   7           HA       LEU   7  17.760   8.667   0.787
  438    HB2  LEU   7           HB2      LEU   7  18.787   8.157   2.886
  439    HB3  LEU   7           HB3      LEU   7  19.198   9.792   2.447
  440    HG   LEU   7           HG       LEU   7  17.014   9.153   4.420
  441   HD11  LEU   7          HD11      LEU   7  19.088   8.163   5.224
  442   HD12  LEU   7          HD12      LEU   7  18.649   9.575   6.182
  443   HD13  LEU   7          HD13      LEU   7  19.925   9.692   4.973
  444   HD21  LEU   7          HD21      LEU   7  17.561  11.458   5.185
  445   HD22  LEU   7          HD22      LEU   7  16.898  11.372   3.554
  446   HD23  LEU   7          HD23      LEU   7  18.628  11.608   3.788
  447    H    ASN   8           H        ASN   8  15.629   9.593   3.498
  448    HA   ASN   8           HA       ASN   8  14.347   6.967   3.345
  449    HB2  ASN   8           HB2      ASN   8  13.702   9.258   5.222
  450    HB3  ASN   8           HB3      ASN   8  13.189   7.590   5.376
  451   HD21  ASN   8          HD21      ASN   8  14.617   9.224   7.267
  452   HD22  ASN   8          HD22      ASN   8  16.097   8.396   7.588
  453    H    HIS   9           H        HIS   9  12.323   6.696   2.483
  454    HA   HIS   9           HA       HIS   9  11.129   9.025   1.176
  455    HB2  HIS   9           HB2      HIS   9  10.400   6.109   0.905
  456    HB3  HIS   9           HB3      HIS   9   9.760   7.425  -0.059
  457    HD1  HIS   9           HD1      HIS   9  10.826   7.669  -2.269
  458    HD2  HIS   9           HD2      HIS   9  13.389   5.920   0.502
  459    HE1  HIS   9           HE1      HIS   9  12.915   7.101  -3.543
  460    HE2  HIS   9           HE2      HIS   9  14.484   6.119  -1.833
  461    H    THR  10           H        THR  10   9.155   9.813   1.759
  462    HA   THR  10           HA       THR  10   8.270   9.108   4.389
  463    HB   THR  10           HB       THR  10   6.934  10.970   2.405
  464    HG1  THR  10           HG1      THR  10   8.155  12.590   3.471
  465   HG21  THR  10          HG21      THR  10   5.484  10.354   4.288
  466   HG22  THR  10          HG22      THR  10   5.990  12.037   4.418
  467   HG23  THR  10          HG23      THR  10   6.751  10.810   5.425
  468    H    CYS  11           H        CYS  11   6.782   7.724   4.954
  469    HA   CYS  11           HA       CYS  11   5.432   6.096   3.057
  470    HB2  CYS  11           HB2      CYS  11   5.983   5.278   5.305
  471    HB3  CYS  11           HB3      CYS  11   4.935   6.489   6.020
  472    H    VAL  12           H        VAL  12   3.738   6.647   1.895
  473    HA   VAL  12           HA       VAL  12   2.184   8.941   2.198
  474    HB   VAL  12           HB       VAL  12   0.487   7.736   0.767
  475   HG11  VAL  12          HG11      VAL  12   2.280   9.059  -0.227
  476   HG12  VAL  12          HG12      VAL  12   1.912   7.641  -1.212
  477   HG13  VAL  12          HG13      VAL  12   3.345   7.654  -0.183
  478   HG21  VAL  12          HG21      VAL  12   1.104   5.569  -0.164
  479   HG22  VAL  12          HG22      VAL  12   0.910   5.473   1.586
  480   HG23  VAL  12          HG23      VAL  12   2.525   5.518   0.879
  481    H    ILE  13           H        ILE  13   2.192   6.121   4.031
  482    HA   ILE  13           HA       ILE  13  -0.583   6.314   4.903
  483    HB   ILE  13           HB       ILE  13   1.370   4.310   5.899
  484   HG12  ILE  13          HG12      ILE  13   1.511   4.335   3.430
  485   HG13  ILE  13          HG13      ILE  13   0.838   2.850   4.079
  486   HG21  ILE  13          HG21      ILE  13  -1.589   4.207   5.397
  487   HG22  ILE  13          HG22      ILE  13  -0.820   4.474   6.964
  488   HG23  ILE  13          HG23      ILE  13  -0.607   2.933   6.126
  489   HD11  ILE  13          HD11      ILE  13  -0.745   5.110   2.934
  490   HD12  ILE  13          HD12      ILE  13  -1.379   3.580   3.540
  491   HD13  ILE  13          HD13      ILE  13  -0.345   3.600   2.112
  492    H    CYS  14           H        CYS  14   2.638   6.072   6.320
  493    HA   CYS  14           HA       CYS  14   1.674   6.804   8.933
  494    HB2  CYS  14           HB2      CYS  14   4.442   6.302   7.922
  495    HB3  CYS  14           HB3      CYS  14   4.058   6.585   9.595
  496    H    ASP  15           H        ASP  15   2.869   8.451   6.206
  497    HA   ASP  15           HA       ASP  15   3.743  10.484   5.770
  498    HB2  ASP  15           HB2      ASP  15   2.212  11.091   8.235
  499    HB3  ASP  15           HB3      ASP  15   3.084  12.345   7.388
  500    H    GLN  16           H        GLN  16   5.431   8.682   6.941
  501    HA   GLN  16           HA       GLN  16   7.233  10.366   8.521
  502    HB2  GLN  16           HB2      GLN  16   6.753   7.401   8.879
  503    HB3  GLN  16           HB3      GLN  16   7.931   8.356   9.755
  504    HG2  GLN  16           HG2      GLN  16   4.970   8.705   9.873
  505    HG3  GLN  16           HG3      GLN  16   5.951   7.905  11.082
  506   HE21  GLN  16          HE21      GLN  16   4.214  10.167  11.383
  507   HE22  GLN  16          HE22      GLN  16   5.195  11.456  11.971
  508    H    GLU  17           H        GLU  17   9.401  10.152   7.994
  509    HA   GLU  17           HA       GLU  17   9.923   9.250   5.336
  510    HB2  GLU  17           HB2      GLU  17  11.684  10.605   7.371
  511    HB3  GLU  17           HB3      GLU  17  12.184  10.210   5.732
  512    HG2  GLU  17           HG2      GLU  17  10.540  11.645   4.798
  513    HG3  GLU  17           HG3      GLU  17   9.817  11.917   6.378
  514    H    LYS  18           H        LYS  18  10.185   7.288   5.010
  515    HA   LYS  18           HA       LYS  18  11.873   5.613   6.758
  516    HB2  LYS  18           HB2      LYS  18   9.782   4.322   5.160
  517    HB3  LYS  18           HB3      LYS  18  10.401   3.889   6.721
  518    HG2  LYS  18           HG2      LYS  18   8.471   6.114   6.170
  519    HG3  LYS  18           HG3      LYS  18   8.064   4.531   6.831
  520    HD2  LYS  18           HD2      LYS  18  10.112   6.170   8.206
  521    HD3  LYS  18           HD3      LYS  18   8.436   6.613   8.373
  522    HE2  LYS  18           HE2      LYS  18   9.149   5.204  10.204
  523    HE3  LYS  18           HE3      LYS  18   7.952   4.413   9.206
  524    HZ1  LYS  18           HZ1      LYS  18  10.858   3.924   9.005
  525    HZ2  LYS  18           HZ2      LYS  18   9.640   3.077   8.196
  526    HZ3  LYS  18           HZ3      LYS  18   9.789   2.948   9.873
  527    H    ASN  19           H        ASN  19  13.542   4.625   5.734
  528    HA   ASN  19           HA       ASN  19  13.764   5.008   2.883
  529    HB2  ASN  19           HB2      ASN  19  15.754   5.443   4.022
  530    HB3  ASN  19           HB3      ASN  19  15.613   3.990   4.973
  531   HD21  ASN  19          HD21      ASN  19  16.390   2.069   4.189
  532   HD22  ASN  19          HD22      ASN  19  17.292   1.951   2.684
  533    H    ARG  20           H        ARG  20  12.817   2.456   5.006
  534    HA   ARG  20           HA       ARG  20  13.099   0.536   2.813
  535    HB2  ARG  20           HB2      ARG  20  12.959   0.155   5.772
  536    HB3  ARG  20           HB3      ARG  20  12.641  -1.177   4.690
  537    HG2  ARG  20           HG2      ARG  20  14.837  -0.774   3.648
  538    HG3  ARG  20           HG3      ARG  20  15.161   0.384   4.928
  539    HD2  ARG  20           HD2      ARG  20  14.792  -1.300   6.533
  540    HD3  ARG  20           HD3      ARG  20  14.349  -2.463   5.326
  541    HE   ARG  20           HE       ARG  20  17.067  -1.336   5.560
  542   HH11  ARG  20          HH11      ARG  20  14.887  -4.027   4.970
  543   HH12  ARG  20          HH12      ARG  20  16.171  -5.135   4.599
  544   HH21  ARG  20          HH21      ARG  20  18.742  -2.830   5.061
  545   HH22  ARG  20          HH22      ARG  20  18.331  -4.466   4.631
  546    H    GLY  21           H        GLY  21  11.470  -0.317   1.835
  547    HA2  GLY  21           HA2      GLY  21   8.967  -1.030   2.499
  548    HA3  GLY  21           HA3      GLY  21   8.799   0.709   2.298
  549    H    ILE  22           H        ILE  22   7.400   0.196   0.330
  550    HA   ILE  22           HA       ILE  22   9.156  -0.525  -1.912
  551    HB   ILE  22           HB       ILE  22   7.476  -1.653  -3.006
  552   HG12  ILE  22          HG12      ILE  22   5.500  -0.204  -1.284
  553   HG13  ILE  22          HG13      ILE  22   5.909   0.215  -2.911
  554   HG21  ILE  22          HG21      ILE  22   6.287  -3.109  -1.383
  555   HG22  ILE  22          HG22      ILE  22   6.853  -2.055  -0.087
  556   HG23  ILE  22          HG23      ILE  22   8.016  -2.956  -1.061
  557   HD11  ILE  22          HD11      ILE  22   3.883  -0.914  -3.073
  558   HD12  ILE  22          HD12      ILE  22   4.403  -2.165  -1.930
  559   HD13  ILE  22          HD13      ILE  22   5.107  -2.097  -3.549
  560    H    HIS  23           H        HIS  23   7.793   0.211  -3.963
  561    HA   HIS  23           HA       HIS  23   6.818   2.884  -3.771
  562    HB2  HIS  23           HB2      HIS  23   8.614   3.900  -5.176
  563    HB3  HIS  23           HB3      HIS  23   9.169   3.428  -3.589
  564    HD1  HIS  23           HD1      HIS  23   9.720   2.827  -7.206
  565    HD2  HIS  23           HD2      HIS  23  10.917   1.256  -3.570
  566    HE1  HIS  23           HE1      HIS  23  11.722   1.398  -7.724
  567    HE2  HIS  23           HE2      HIS  23  12.322   0.311  -5.529
  568    H    LEU  24           H        LEU  24   5.154   2.734  -5.065
  569    HA   LEU  24           HA       LEU  24   5.159   0.899  -7.285
  570    HB2  LEU  24           HB2      LEU  24   3.159   2.223  -5.693
  571    HB3  LEU  24           HB3      LEU  24   2.830   2.473  -7.376
  572    HG   LEU  24           HG       LEU  24   1.601   0.574  -6.650
  573   HD11  LEU  24          HD11      LEU  24   4.008  -0.354  -8.189
  574   HD12  LEU  24          HD12      LEU  24   2.538   0.329  -8.874
  575   HD13  LEU  24          HD13      LEU  24   2.484  -1.218  -8.035
  576   HD21  LEU  24          HD21      LEU  24   2.596  -1.350  -5.695
  577   HD22  LEU  24          HD22      LEU  24   2.883   0.075  -4.696
  578   HD23  LEU  24          HD23      LEU  24   4.173  -0.568  -5.712
  579    H    TYR  25           H        TYR  25   3.970   4.214  -7.155
  580    HA   TYR  25           HA       TYR  25   4.855   4.546  -9.902
  581    HB2  TYR  25           HB2      TYR  25   3.032   6.367  -8.382
  582    HB3  TYR  25           HB3      TYR  25   3.292   6.346 -10.111
  583    HD1  TYR  25           HD1      TYR  25   3.107   3.004  -9.000
  584    HD2  TYR  25           HD2      TYR  25   0.635   6.383  -9.805
  585    HE1  TYR  25           HE1      TYR  25   1.180   1.528  -9.161
  586    HE2  TYR  25           HE2      TYR  25  -1.335   4.907 -10.000
  587    HH   TYR  25           HH       TYR  25  -1.777   2.541 -10.545
  588    H    THR  26           H        THR  26   4.337   7.312  -7.878
  589    HA   THR  26           HA       THR  26   7.231   7.814  -7.905
  590    HB   THR  26           HB       THR  26   6.768  10.155  -7.823
  591    HG1  THR  26           HG1      THR  26   5.059  10.770  -6.743
  592   HG21  THR  26          HG21      THR  26   6.419   9.080 -10.021
  593   HG22  THR  26          HG22      THR  26   5.402  10.508  -9.805
  594   HG23  THR  26          HG23      THR  26   4.707   8.895  -9.630
  595    H    LYS  27           H        LYS  27   5.190   6.391  -5.928
  596    HA   LYS  27           HA       LYS  27   5.646   8.120  -3.593
  597    HB2  LYS  27           HB2      LYS  27   3.676   5.972  -3.291
  598    HB3  LYS  27           HB3      LYS  27   3.606   7.639  -2.768
  599    HG2  LYS  27           HG2      LYS  27   2.975   6.553  -5.477
  600    HG3  LYS  27           HG3      LYS  27   1.858   7.206  -4.289
  601    HD2  LYS  27           HD2      LYS  27   4.016   8.782  -5.669
  602    HD3  LYS  27           HD3      LYS  27   2.310   8.775  -6.122
  603    HE2  LYS  27           HE2      LYS  27   2.575   9.270  -3.311
  604    HE3  LYS  27           HE3      LYS  27   3.562  10.418  -4.217
  605    HZ1  LYS  27           HZ1      LYS  27   1.549  10.910  -5.565
  606    HZ2  LYS  27           HZ2      LYS  27   1.369  11.309  -3.935
  607    HZ3  LYS  27           HZ3      LYS  27   0.646   9.909  -4.545
  608    H    PHE  28           H        PHE  28   5.117   6.646  -1.589
  609    HA   PHE  28           HA       PHE  28   6.697   4.212  -1.620
  610    HB2  PHE  28           HB2      PHE  28   8.416   5.791  -1.152
  611    HB3  PHE  28           HB3      PHE  28   7.391   6.682  -0.035
  612    HD1  PHE  28           HD1      PHE  28   9.379   3.619  -0.486
  613    HD2  PHE  28           HD2      PHE  28   7.133   6.002   2.222
  614    HE1  PHE  28           HE1      PHE  28  10.266   2.314   1.398
  615    HE2  PHE  28           HE2      PHE  28   8.011   4.706   4.111
  616    HZ   PHE  28           HZ       PHE  28   9.575   2.849   3.712
  617    H    ILE  29           H        ILE  29   5.415   2.791  -0.660
  618    HA   ILE  29           HA       ILE  29   3.983   3.558   1.785
  619    HB   ILE  29           HB       ILE  29   4.011   0.864   0.391
  620   HG12  ILE  29          HG12      ILE  29   1.509   1.574   0.015
  621   HG13  ILE  29          HG13      ILE  29   2.155   3.205   0.166
  622   HG21  ILE  29          HG21      ILE  29   3.618   0.766   2.814
  623   HG22  ILE  29          HG22      ILE  29   2.183   0.292   1.896
  624   HG23  ILE  29          HG23      ILE  29   2.266   1.893   2.628
  625   HD11  ILE  29          HD11      ILE  29   3.171   1.164  -1.791
  626   HD12  ILE  29          HD12      ILE  29   3.598   2.873  -1.707
  627   HD13  ILE  29          HD13      ILE  29   1.963   2.393  -2.163
  628    H    CYS  30           H        CYS  30   4.956   3.141   3.733
  629    HA   CYS  30           HA       CYS  30   7.568   2.038   3.742
  630    HB2  CYS  30           HB2      CYS  30   7.657   2.428   6.024
  631    HB3  CYS  30           HB3      CYS  30   6.479   3.611   5.509
  632    H    LEU  31           H        LEU  31   8.262   0.167   4.634
  633    HA   LEU  31           HA       LEU  31   7.213  -2.000   3.405
  634    HB2  LEU  31           HB2      LEU  31   8.937  -3.178   4.365
  635    HB3  LEU  31           HB3      LEU  31   9.542  -1.558   4.302
  636    HG   LEU  31           HG       LEU  31   8.608  -1.516   6.795
  637   HD11  LEU  31          HD11      LEU  31   9.368  -4.408   6.387
  638   HD12  LEU  31          HD12      LEU  31   7.746  -3.808   6.729
  639   HD13  LEU  31          HD13      LEU  31   9.023  -3.628   7.931
  640   HD21  LEU  31          HD21      LEU  31  10.879  -2.086   7.545
  641   HD22  LEU  31          HD22      LEU  31  10.877  -0.995   6.159
  642   HD23  LEU  31          HD23      LEU  31  11.237  -2.706   5.933
  643    H    ASP  32           H        ASP  32   6.337  -0.702   6.409
  644    HA   ASP  32           HA       ASP  32   5.399  -3.187   7.550
  645    HB2  ASP  32           HB2      ASP  32   6.321  -1.007   8.741
  646    HB3  ASP  32           HB3      ASP  32   4.628  -0.572   8.666
  647    H    CYS  33           H        CYS  33   4.174  -0.292   6.115
  648    HA   CYS  33           HA       CYS  33   1.430  -0.952   6.405
  649    HB2  CYS  33           HB2      CYS  33   2.736   1.148   4.696
  650    HB3  CYS  33           HB3      CYS  33   1.027   0.857   4.742
  651    H    GLU  34           H        GLU  34   3.891  -1.293   4.046
  652    HA   GLU  34           HA       GLU  34   2.475  -2.156   1.863
  653    HB2  GLU  34           HB2      GLU  34   4.806  -1.739   1.700
  654    HB3  GLU  34           HB3      GLU  34   5.170  -2.887   2.954
  655    HG2  GLU  34           HG2      GLU  34   3.898  -3.934   0.534
  656    HG3  GLU  34           HG3      GLU  34   5.553  -3.397   0.404
  657    H    ARG  35           H        ARG  35   3.672  -4.020   4.586
  658    HA   ARG  35           HA       ARG  35   2.208  -6.302   3.732
  659    HB2  ARG  35           HB2      ARG  35   2.829  -7.311   5.960
  660    HB3  ARG  35           HB3      ARG  35   4.102  -6.992   4.794
  661    HG2  ARG  35           HG2      ARG  35   4.148  -4.710   6.186
  662    HG3  ARG  35           HG3      ARG  35   3.603  -5.832   7.412
  663    HD2  ARG  35           HD2      ARG  35   6.046  -5.645   7.363
  664    HD3  ARG  35           HD3      ARG  35   5.493  -7.258   6.938
  665    HE   ARG  35           HE       ARG  35   5.868  -5.543   4.665
  666   HH11  ARG  35          HH11      ARG  35   7.514  -7.756   6.836
  667   HH12  ARG  35          HH12      ARG  35   8.735  -8.163   5.676
  668   HH21  ARG  35          HH21      ARG  35   7.436  -6.073   3.155
  669   HH22  ARG  35          HH22      ARG  35   8.705  -7.191   3.576
  670    H    LYS  36           H        LYS  36   1.377  -3.646   5.712
  671    HA   LYS  36           HA       LYS  36  -0.612  -4.821   7.300
  672    HB2  LYS  36           HB2      LYS  36  -0.253  -2.048   6.207
  673    HB3  LYS  36           HB3      LYS  36  -1.530  -2.496   7.294
  674    HG2  LYS  36           HG2      LYS  36   0.266  -3.134   8.916
  675    HG3  LYS  36           HG3      LYS  36   1.396  -2.384   7.847
  676    HD2  LYS  36           HD2      LYS  36   0.229  -0.374   8.033
  677    HD3  LYS  36           HD3      LYS  36  -1.036  -1.092   8.982
  678    HE2  LYS  36           HE2      LYS  36   0.362   0.087  10.464
  679    HE3  LYS  36           HE3      LYS  36   0.667  -1.621  10.712
  680    HZ1  LYS  36           HZ1      LYS  36   2.361   0.140   9.041
  681    HZ2  LYS  36           HZ2      LYS  36   2.702  -1.450   9.534
  682    HZ3  LYS  36           HZ3      LYS  36   2.669  -0.196  10.667
  683    H    VAL  37           H        VAL  37  -0.523  -3.247   4.209
  684    HA   VAL  37           HA       VAL  37  -3.170  -3.101   3.614
  685    HB   VAL  37           HB       VAL  37  -2.575  -3.058   1.265
  686   HG11  VAL  37          HG11      VAL  37  -2.019  -1.120   2.882
  687   HG12  VAL  37          HG12      VAL  37  -1.318  -1.093   1.265
  688   HG13  VAL  37          HG13      VAL  37  -0.338  -1.619   2.640
  689   HG21  VAL  37          HG21      VAL  37  -0.051  -4.262   2.213
  690   HG22  VAL  37          HG22      VAL  37  -0.039  -3.213   0.794
  691   HG23  VAL  37          HG23      VAL  37  -1.051  -4.658   0.808
  692    H    ILE  38           H        ILE  38  -0.970  -5.698   2.902
  693    HA   ILE  38           HA       ILE  38  -2.658  -7.459   1.546
  694    HB   ILE  38           HB       ILE  38  -0.480  -8.407   3.388
  695   HG12  ILE  38          HG12      ILE  38  -0.159  -6.866   0.836
  696   HG13  ILE  38          HG13      ILE  38   0.575  -6.547   2.390
  697   HG21  ILE  38          HG21      ILE  38  -1.468  -9.304   0.697
  698   HG22  ILE  38          HG22      ILE  38  -1.667 -10.129   2.239
  699   HG23  ILE  38          HG23      ILE  38  -0.067  -9.986   1.514
  700   HD11  ILE  38          HD11      ILE  38   2.044  -7.525   0.540
  701   HD12  ILE  38          HD12      ILE  38   1.221  -9.046   0.888
  702   HD13  ILE  38          HD13      ILE  38   2.141  -8.236   2.151
  703    H    SER  39           H        SER  39  -2.020  -6.745   4.835
  704    HA   SER  39           HA       SER  39  -3.357  -9.044   5.817
  705    HB2  SER  39           HB2      SER  39  -1.479  -7.943   7.046
  706    HB3  SER  39           HB3      SER  39  -2.549  -6.581   7.371
  707    HG   SER  39           HG       SER  39  -2.483  -8.068   9.113
  708    H    THR  40           H        THR  40  -4.257  -5.930   4.836
  709    HA   THR  40           HA       THR  40  -6.698  -5.774   6.367
  710    HB   THR  40           HB       THR  40  -5.749  -4.042   4.078
  711    HG1  THR  40           HG1      THR  40  -4.385  -4.202   6.071
  712   HG21  THR  40          HG21      THR  40  -7.766  -3.485   6.255
  713   HG22  THR  40          HG22      THR  40  -8.156  -3.851   4.575
  714   HG23  THR  40          HG23      THR  40  -7.275  -2.376   4.976
  715    H    SER  41           H        SER  41  -5.801  -6.320   2.965
  716    HA   SER  41           HA       SER  41  -8.574  -6.191   2.145
  717    HB2  SER  41           HB2      SER  41  -7.519  -6.464  -0.140
  718    HB3  SER  41           HB3      SER  41  -7.007  -5.047   0.781
  719    HG   SER  41           HG       SER  41  -5.270  -6.307  -0.218
  720    H    THR  42           H        THR  42  -6.289  -8.739   2.780
  721    HA   THR  42           HA       THR  42  -7.164 -10.463   0.700
  722    HB   THR  42           HB       THR  42  -5.832 -12.214   1.932
  723    HG1  THR  42           HG1      THR  42  -4.716 -10.197   3.511
  724   HG21  THR  42          HG21      THR  42  -4.851 -10.869   0.155
  725   HG22  THR  42          HG22      THR  42  -3.672 -11.121   1.442
  726   HG23  THR  42          HG23      THR  42  -4.505  -9.571   1.301
  727    H    SER  43           H        SER  43  -8.315  -9.936   3.923
  728    HA   SER  43           HA       SER  43 -10.165 -12.192   3.520
  729    HB2  SER  43           HB2      SER  43  -8.583 -12.293   5.539
  730    HB3  SER  43           HB3      SER  43  -9.533 -10.967   6.206
  731    HG   SER  43           HG       SER  43 -10.685 -13.407   5.335
  732    H    ASP  44           H        ASP  44 -10.316  -9.432   2.515
  733    HA   ASP  44           HA       ASP  44 -12.872  -8.701   3.784
  734    HB2  ASP  44           HB2      ASP  44 -11.084  -7.018   4.225
  735    HB3  ASP  44           HB3      ASP  44 -10.924  -6.786   2.487
  736    HA   PRO  45           HA       PRO  45 -13.718  -9.686  -0.593
  737    HB2  PRO  45           HB2      PRO  45 -15.878 -11.208  -0.163
  738    HB3  PRO  45           HB3      PRO  45 -14.281 -11.822   0.119
  739    HG2  PRO  45           HG2      PRO  45 -16.233 -10.906   2.016
  740    HG3  PRO  45           HG3      PRO  45 -15.134 -12.249   2.159
  741    HD2  PRO  45           HD2      PRO  45 -14.773  -9.760   3.325
  742    HD3  PRO  45           HD3      PRO  45 -13.497 -10.937   2.995
  743    H    ASP  46           H        ASP  46 -15.635  -9.272  -1.917
  744    HA   ASP  46           HA       ASP  46 -17.596  -7.456  -0.706
  745    HB2  ASP  46           HB2      ASP  46 -15.959  -6.013  -1.783
  746    HB3  ASP  46           HB3      ASP  46 -16.067  -6.951  -3.269
  747    H    TYR  47           H        TYR  47 -16.739  -9.003  -3.791
  748    HA   TYR  47           HA       TYR  47 -19.529  -9.452  -4.393
  749    HB2  TYR  47           HB2      TYR  47 -17.002 -10.068  -5.886
  750    HB3  TYR  47           HB3      TYR  47 -18.595 -10.498  -6.480
  751    HD1  TYR  47           HD1      TYR  47 -16.140  -7.883  -6.162
  752    HD2  TYR  47           HD2      TYR  47 -20.245  -8.661  -6.956
  753    HE1  TYR  47           HE1      TYR  47 -16.362  -5.655  -7.178
  754    HE2  TYR  47           HE2      TYR  47 -20.479  -6.436  -7.970
  755    HH   TYR  47           HH       TYR  47 -19.391  -4.262  -7.907
  756    H    ALA  48           H        ALA  48 -20.059 -10.866  -2.685
  757    HA   ALA  48           HA       ALA  48 -18.725 -13.395  -2.408
  758    HB1  ALA  48           HB1      ALA  48 -20.442 -13.893  -0.755
  759    HB2  ALA  48           HB2      ALA  48 -21.347 -12.460  -1.243
  760    HB3  ALA  48           HB3      ALA  48 -19.766 -12.288  -0.484
  Start of MODEL    6
    1    H1   SER   0           H1       SER   0  -2.249  22.344   8.276
    2    H2   SER   0           H2       SER   0  -0.818  22.001   7.445
    3    H3   SER   0           H3       SER   0  -0.913  23.365   8.441
    4    HA   SER   0           HA       SER   0   0.337  21.646   9.513
    5    HB2  SER   0           HB2      SER   0  -1.123  21.443  11.583
    6    HB3  SER   0           HB3      SER   0  -0.858  23.083  10.996
    7    HG   SER   0           HG       SER   0  -3.039  22.792  11.457
    8    H    MET   1           H        MET   1  -3.065  20.531   9.525
    9    HA   MET   1           HA       MET   1  -2.130  17.884   8.692
   10    HB2  MET   1           HB2      MET   1  -2.268  17.963  11.198
   11    HB3  MET   1           HB3      MET   1  -3.989  18.285  11.045
   12    HG2  MET   1           HG2      MET   1  -4.273  16.135   9.895
   13    HG3  MET   1           HG3      MET   1  -2.554  15.812  10.095
   14    HE1  MET   1           HE1      MET   1  -1.386  15.374  12.414
   15    HE2  MET   1           HE2      MET   1  -2.213  15.452  13.969
   16    HE3  MET   1           HE3      MET   1  -1.976  16.921  13.023
   17    H    ASP   2           H        ASP   2  -3.299  19.528   6.952
   18    HA   ASP   2           HA       ASP   2  -6.135  18.868   6.836
   19    HB2  ASP   2           HB2      ASP   2  -5.448  21.111   6.094
   20    HB3  ASP   2           HB3      ASP   2  -4.407  20.391   4.868
   21    H    GLU   3           H        GLU   3  -6.618  16.879   6.214
   22    HA   GLU   3           HA       GLU   3  -5.609  15.762   3.781
   23    HB2  GLU   3           HB2      GLU   3  -3.703  15.369   5.294
   24    HB3  GLU   3           HB3      GLU   3  -4.768  14.528   6.409
   25    HG2  GLU   3           HG2      GLU   3  -5.175  12.812   4.722
   26    HG3  GLU   3           HG3      GLU   3  -4.096  13.658   3.611
   27    H    THR   4           H        THR   4  -7.684  15.321   3.154
   28    HA   THR   4           HA       THR   4  -9.071  13.222   4.648
   29    HB   THR   4           HB       THR   4 -10.497  15.701   3.669
   30    HG1  THR   4           HG1      THR   4  -9.149  16.016   5.575
   31   HG21  THR   4          HG21      THR   4 -11.891  13.710   3.628
   32   HG22  THR   4          HG22      THR   4 -12.391  14.765   4.950
   33   HG23  THR   4          HG23      THR   4 -11.427  13.325   5.284
   34    H    VAL   5           H        VAL   5  -9.664  11.637   3.325
   35    HA   VAL   5           HA       VAL   5 -10.063  12.266   0.486
   36    HB   VAL   5           HB       VAL   5  -9.763   9.753   0.146
   37   HG11  VAL   5          HG11      VAL   5  -8.086  11.375  -0.525
   38   HG12  VAL   5          HG12      VAL   5  -7.312   9.942   0.149
   39   HG13  VAL   5          HG13      VAL   5  -7.438  11.412   1.114
   40   HG21  VAL   5          HG21      VAL   5  -8.438   8.598   1.850
   41   HG22  VAL   5          HG22      VAL   5 -10.020   9.075   2.469
   42   HG23  VAL   5          HG23      VAL   5  -8.587  10.002   2.907
   43    H    LYS   6           H        LYS   6 -12.155  12.639   0.184
   44    HA   LYS   6           HA       LYS   6 -14.118  11.035   1.668
   45    HB2  LYS   6           HB2      LYS   6 -15.672  12.928   1.106
   46    HB3  LYS   6           HB3      LYS   6 -14.340  13.354   2.163
   47    HG2  LYS   6           HG2      LYS   6 -13.152  14.185   0.124
   48    HG3  LYS   6           HG3      LYS   6 -14.656  13.970  -0.759
   49    HD2  LYS   6           HD2      LYS   6 -14.227  15.741   1.644
   50    HD3  LYS   6           HD3      LYS   6 -14.417  16.272  -0.021
   51    HE2  LYS   6           HE2      LYS   6 -16.672  15.372  -0.074
   52    HE3  LYS   6           HE3      LYS   6 -16.480  14.796   1.576
   53    HZ1  LYS   6           HZ1      LYS   6 -17.695  16.866   1.527
   54    HZ2  LYS   6           HZ2      LYS   6 -16.425  17.631   0.718
   55    HZ3  LYS   6           HZ3      LYS   6 -16.209  17.087   2.304
   56    H    LEU   7           H        LEU   7 -16.273  10.803   0.485
   57    HA   LEU   7           HA       LEU   7 -17.214   9.307  -0.949
   58    HB2  LEU   7           HB2      LEU   7 -17.478  10.210  -3.269
   59    HB3  LEU   7           HB3      LEU   7 -17.967  11.285  -1.980
   60    HG   LEU   7           HG       LEU   7 -15.208  11.718  -2.890
   61   HD11  LEU   7          HD11      LEU   7 -15.879  12.844  -4.964
   62   HD12  LEU   7          HD12      LEU   7 -17.520  12.233  -4.761
   63   HD13  LEU   7          HD13      LEU   7 -16.188  11.110  -5.034
   64   HD21  LEU   7          HD21      LEU   7 -15.911  14.033  -2.783
   65   HD22  LEU   7          HD22      LEU   7 -16.438  13.182  -1.330
   66   HD23  LEU   7          HD23      LEU   7 -17.596  13.541  -2.611
   67    H    ASN   8           H        ASN   8 -15.519   9.918  -3.816
   68    HA   ASN   8           HA       ASN   8 -14.246   7.354  -3.798
   69    HB2  ASN   8           HB2      ASN   8 -13.886   9.706  -5.673
   70    HB3  ASN   8           HB3      ASN   8 -13.145   8.135  -5.898
   71   HD21  ASN   8          HD21      ASN   8 -14.112   7.864  -7.847
   72   HD22  ASN   8          HD22      ASN   8 -15.796   7.509  -8.006
   73    H    HIS   9           H        HIS   9 -12.767   7.132  -2.283
   74    HA   HIS   9           HA       HIS   9 -11.124   9.153  -1.250
   75    HB2  HIS   9           HB2      HIS   9 -10.530   6.191  -1.205
   76    HB3  HIS   9           HB3      HIS   9 -10.009   7.404  -0.041
   77    HD1  HIS   9           HD1      HIS   9 -11.862   8.305   1.629
   78    HD2  HIS   9           HD2      HIS   9 -13.049   5.139  -0.793
   79    HE1  HIS   9           HE1      HIS   9 -13.958   7.396   2.677
   80    HE2  HIS   9           HE2      HIS   9 -14.729   5.570   1.125
   81    H    THR  10           H        THR  10  -9.377  10.083  -2.109
   82    HA   THR  10           HA       THR  10  -8.394   9.279  -4.635
   83    HB   THR  10           HB       THR  10  -7.091  11.159  -2.645
   84    HG1  THR  10           HG1      THR  10  -8.287  12.657  -4.283
   85   HG21  THR  10          HG21      THR  10  -5.635  10.504  -4.507
   86   HG22  THR  10          HG22      THR  10  -6.099  12.201  -4.619
   87   HG23  THR  10          HG23      THR  10  -6.878  11.004  -5.653
   88    H    CYS  11           H        CYS  11  -6.860   7.897  -5.176
   89    HA   CYS  11           HA       CYS  11  -5.568   6.259  -3.248
   90    HB2  CYS  11           HB2      CYS  11  -6.045   5.422  -5.501
   91    HB3  CYS  11           HB3      CYS  11  -5.001   6.647  -6.204
   92    H    VAL  12           H        VAL  12  -3.945   6.821  -2.007
   93    HA   VAL  12           HA       VAL  12  -2.351   9.093  -2.206
   94    HB   VAL  12           HB       VAL  12  -0.749   7.927  -0.711
   95   HG11  VAL  12          HG11      VAL  12  -2.644   9.011   0.307
   96   HG12  VAL  12          HG12      VAL  12  -2.300   7.500   1.156
   97   HG13  VAL  12          HG13      VAL  12  -3.649   7.589   0.020
   98   HG21  VAL  12          HG21      VAL  12  -2.544   5.543  -1.131
   99   HG22  VAL  12          HG22      VAL  12  -1.243   5.650   0.056
  100   HG23  VAL  12          HG23      VAL  12  -0.872   5.700  -1.668
  101    H    ILE  13           H        ILE  13  -2.314   6.279  -4.059
  102    HA   ILE  13           HA       ILE  13   0.465   6.507  -4.813
  103    HB   ILE  13           HB       ILE  13  -1.492   4.535  -5.903
  104   HG12  ILE  13          HG12      ILE  13  -1.461   4.447  -3.400
  105   HG13  ILE  13          HG13      ILE  13  -0.914   2.975  -4.187
  106   HG21  ILE  13          HG21      ILE  13   0.513   3.186  -6.249
  107   HG22  ILE  13          HG22      ILE  13   1.493   4.505  -5.601
  108   HG23  ILE  13          HG23      ILE  13   0.586   4.731  -7.098
  109   HD11  ILE  13          HD11      ILE  13   1.330   3.504  -3.745
  110   HD12  ILE  13          HD12      ILE  13   0.405   3.670  -2.247
  111   HD13  ILE  13          HD13      ILE  13   0.894   5.106  -3.154
  112    H    CYS  14           H        CYS  14  -2.656   6.254  -6.445
  113    HA   CYS  14           HA       CYS  14  -1.521   6.960  -8.989
  114    HB2  CYS  14           HB2      CYS  14  -4.341   6.517  -8.143
  115    HB3  CYS  14           HB3      CYS  14  -3.868   6.777  -9.792
  116    H    ASP  15           H        ASP  15  -3.017   8.645  -6.406
  117    HA   ASP  15           HA       ASP  15  -3.787  10.752  -6.084
  118    HB2  ASP  15           HB2      ASP  15  -1.680  11.213  -7.566
  119    HB3  ASP  15           HB3      ASP  15  -2.888  11.643  -8.761
  120    H    GLN  16           H        GLN  16  -5.389   8.741  -7.248
  121    HA   GLN  16           HA       GLN  16  -7.273  10.289  -8.874
  122    HB2  GLN  16           HB2      GLN  16  -6.677   7.332  -9.013
  123    HB3  GLN  16           HB3      GLN  16  -7.934   8.150  -9.923
  124    HG2  GLN  16           HG2      GLN  16  -5.001   8.654 -10.142
  125    HG3  GLN  16           HG3      GLN  16  -5.980   7.749 -11.285
  126   HE21  GLN  16          HE21      GLN  16  -4.362  10.178 -11.617
  127   HE22  GLN  16          HE22      GLN  16  -5.436  11.374 -12.252
  128    H    GLU  17           H        GLU  17  -9.404  10.108  -8.375
  129    HA   GLU  17           HA       GLU  17 -10.039   9.476  -5.656
  130    HB2  GLU  17           HB2      GLU  17 -11.688  10.601  -7.916
  131    HB3  GLU  17           HB3      GLU  17 -12.259  10.415  -6.261
  132    HG2  GLU  17           HG2      GLU  17 -10.744  11.992  -5.436
  133    HG3  GLU  17           HG3      GLU  17  -9.793  11.966  -6.917
  134    H    LYS  18           H        LYS  18 -10.177   7.434  -5.260
  135    HA   LYS  18           HA       LYS  18 -11.933   5.729  -6.907
  136    HB2  LYS  18           HB2      LYS  18  -9.813   4.501  -5.294
  137    HB3  LYS  18           HB3      LYS  18 -10.503   3.970  -6.793
  138    HG2  LYS  18           HG2      LYS  18  -8.493   6.160  -6.435
  139    HG3  LYS  18           HG3      LYS  18  -8.201   4.557  -7.104
  140    HD2  LYS  18           HD2      LYS  18 -10.233   6.327  -8.356
  141    HD3  LYS  18           HD3      LYS  18  -8.540   6.603  -8.661
  142    HE2  LYS  18           HE2      LYS  18  -9.513   5.257 -10.404
  143    HE3  LYS  18           HE3      LYS  18  -8.335   4.355  -9.482
  144    HZ1  LYS  18           HZ1      LYS  18 -10.108   3.239  -8.314
  145    HZ2  LYS  18           HZ2      LYS  18 -10.318   3.050  -9.979
  146    HZ3  LYS  18           HZ3      LYS  18 -11.266   4.162  -9.130
  147    H    ASN  19           H        ASN  19 -13.593   4.741  -5.840
  148    HA   ASN  19           HA       ASN  19 -13.638   5.057  -2.948
  149    HB2  ASN  19           HB2      ASN  19 -15.630   5.610  -4.413
  150    HB3  ASN  19           HB3      ASN  19 -15.813   3.878  -4.613
  151   HD21  ASN  19          HD21      ASN  19 -17.803   3.827  -3.609
  152   HD22  ASN  19          HD22      ASN  19 -17.972   4.047  -1.873
  153    H    ARG  20           H        ARG  20 -12.374   2.861  -4.979
  154    HA   ARG  20           HA       ARG  20 -13.031   0.603  -3.214
  155    HB2  ARG  20           HB2      ARG  20 -12.553   0.540  -6.192
  156    HB3  ARG  20           HB3      ARG  20 -12.648  -0.881  -5.183
  157    HG2  ARG  20           HG2      ARG  20 -14.919  -0.359  -4.619
  158    HG3  ARG  20           HG3      ARG  20 -14.815   1.145  -5.522
  159    HD2  ARG  20           HD2      ARG  20 -14.352  -0.056  -7.540
  160    HD3  ARG  20           HD3      ARG  20 -14.402  -1.537  -6.633
  161    HE   ARG  20           HE       ARG  20 -16.834  -0.248  -6.241
  162   HH11  ARG  20          HH11      ARG  20 -15.061  -1.766  -8.847
  163   HH12  ARG  20          HH12      ARG  20 -16.486  -2.206  -9.733
  164   HH21  ARG  20          HH21      ARG  20 -18.712  -0.827  -7.402
  165   HH22  ARG  20          HH22      ARG  20 -18.565  -1.670  -8.908
  166    H    GLY  21           H        GLY  21 -11.450  -0.077  -2.071
  167    HA2  GLY  21           HA2      GLY  21  -8.986  -0.992  -2.715
  168    HA3  GLY  21           HA3      GLY  21  -8.710   0.729  -2.502
  169    H    ILE  22           H        ILE  22  -7.400   0.174  -0.499
  170    HA   ILE  22           HA       ILE  22  -9.206  -0.556   1.699
  171    HB   ILE  22           HB       ILE  22  -7.586  -1.771   2.755
  172   HG12  ILE  22          HG12      ILE  22  -5.499  -0.320   1.161
  173   HG13  ILE  22          HG13      ILE  22  -5.994   0.115   2.764
  174   HG21  ILE  22          HG21      ILE  22  -6.375  -3.147   1.086
  175   HG22  ILE  22          HG22      ILE  22  -6.877  -2.008  -0.166
  176   HG23  ILE  22          HG23      ILE  22  -8.088  -2.940   0.717
  177   HD11  ILE  22          HD11      ILE  22  -4.004  -1.082   3.004
  178   HD12  ILE  22          HD12      ILE  22  -4.552  -2.337   1.885
  179   HD13  ILE  22          HD13      ILE  22  -5.301  -2.183   3.474
  180    H    HIS  23           H        HIS  23  -7.796   0.069   3.812
  181    HA   HIS  23           HA       HIS  23  -7.154   2.910   3.668
  182    HB2  HIS  23           HB2      HIS  23  -9.341   1.794   5.439
  183    HB3  HIS  23           HB3      HIS  23  -8.749   3.439   5.475
  184    HD1  HIS  23           HD1      HIS  23  -9.532   5.036   3.610
  185    HD2  HIS  23           HD2      HIS  23 -11.028   1.180   3.365
  186    HE1  HIS  23           HE1      HIS  23 -11.394   5.146   1.923
  187    HE2  HIS  23           HE2      HIS  23 -12.270   2.787   1.761
  188    H    LEU  24           H        LEU  24  -5.071   2.645   4.527
  189    HA   LEU  24           HA       LEU  24  -4.883   1.548   7.217
  190    HB2  LEU  24           HB2      LEU  24  -2.879   2.715   5.293
  191    HB3  LEU  24           HB3      LEU  24  -2.520   2.498   6.948
  192    HG   LEU  24           HG       LEU  24  -1.823   0.434   6.580
  193   HD11  LEU  24          HD11      LEU  24  -4.070  -0.392   6.834
  194   HD12  LEU  24          HD12      LEU  24  -3.121  -1.325   5.675
  195   HD13  LEU  24          HD13      LEU  24  -4.338  -0.177   5.101
  196   HD21  LEU  24          HD21      LEU  24  -1.061   1.477   4.554
  197   HD22  LEU  24          HD22      LEU  24  -2.531   0.950   3.732
  198   HD23  LEU  24          HD23      LEU  24  -1.380  -0.242   4.343
  199    H    TYR  25           H        TYR  25  -4.829   2.967   8.972
  200    HA   TYR  25           HA       TYR  25  -4.771   4.936  10.130
  201    HB2  TYR  25           HB2      TYR  25  -3.421   6.134   7.735
  202    HB3  TYR  25           HB3      TYR  25  -3.338   6.720   9.378
  203    HD1  TYR  25           HD1      TYR  25  -3.029   3.167   8.548
  204    HD2  TYR  25           HD2      TYR  25  -0.824   6.702   9.441
  205    HE1  TYR  25           HE1      TYR  25  -1.047   1.823   8.840
  206    HE2  TYR  25           HE2      TYR  25   1.207   5.341   9.767
  207    HH   TYR  25           HH       TYR  25   1.665   2.954  10.442
  208    H    THR  26           H        THR  26  -4.800   7.363   7.979
  209    HA   THR  26           HA       THR  26  -7.726   7.335   7.757
  210    HB   THR  26           HB       THR  26  -7.146   9.188   9.056
  211    HG1  THR  26           HG1      THR  26  -7.630   9.843   6.366
  212   HG21  THR  26          HG21      THR  26  -4.727   9.048   8.622
  213   HG22  THR  26          HG22      THR  26  -5.332  10.709   8.607
  214   HG23  THR  26          HG23      THR  26  -4.975   9.889   7.087
  215    H    LYS  27           H        LYS  27  -5.543   6.153   5.913
  216    HA   LYS  27           HA       LYS  27  -5.797   7.975   3.614
  217    HB2  LYS  27           HB2      LYS  27  -3.879   5.757   3.457
  218    HB3  LYS  27           HB3      LYS  27  -3.734   7.410   2.896
  219    HG2  LYS  27           HG2      LYS  27  -3.447   6.462   5.706
  220    HG3  LYS  27           HG3      LYS  27  -2.153   6.930   4.634
  221    HD2  LYS  27           HD2      LYS  27  -4.363   8.764   5.483
  222    HD3  LYS  27           HD3      LYS  27  -2.786   8.691   6.268
  223    HE2  LYS  27           HE2      LYS  27  -2.636   8.969   3.367
  224    HE3  LYS  27           HE3      LYS  27  -3.453  10.317   4.155
  225    HZ1  LYS  27           HZ1      LYS  27  -0.659   9.522   4.253
  226    HZ2  LYS  27           HZ2      LYS  27  -1.319   9.969   5.743
  227    HZ3  LYS  27           HZ3      LYS  27  -1.359  11.055   4.448
  228    H    PHE  28           H        PHE  28  -5.160   6.564   1.591
  229    HA   PHE  28           HA       PHE  28  -6.813   4.195   1.396
  230    HB2  PHE  28           HB2      PHE  28  -8.450   5.891   0.947
  231    HB3  PHE  28           HB3      PHE  28  -7.368   6.722  -0.162
  232    HD1  PHE  28           HD1      PHE  28  -7.167   6.068  -2.410
  233    HD2  PHE  28           HD2      PHE  28  -9.416   3.695   0.296
  234    HE1  PHE  28           HE1      PHE  28  -8.035   4.765  -4.299
  235    HE2  PHE  28           HE2      PHE  28 -10.301   2.383  -1.587
  236    HZ   PHE  28           HZ       PHE  28  -9.600   2.910  -3.904
  237    H    ILE  29           H        ILE  29  -5.470   2.782   0.455
  238    HA   ILE  29           HA       ILE  29  -3.991   3.615  -1.953
  239    HB   ILE  29           HB       ILE  29  -4.003   0.911  -0.575
  240   HG12  ILE  29          HG12      ILE  29  -1.528   1.584  -0.175
  241   HG13  ILE  29          HG13      ILE  29  -2.094   3.229  -0.432
  242   HG21  ILE  29          HG21      ILE  29  -2.192   0.335  -2.088
  243   HG22  ILE  29          HG22      ILE  29  -2.264   1.940  -2.814
  244   HG23  ILE  29          HG23      ILE  29  -3.623   0.822  -3.007
  245   HD11  ILE  29          HD11      ILE  29  -1.955   2.587   1.937
  246   HD12  ILE  29          HD12      ILE  29  -3.184   1.353   1.645
  247   HD13  ILE  29          HD13      ILE  29  -3.582   3.058   1.438
  248    H    CYS  30           H        CYS  30  -4.967   3.229  -3.919
  249    HA   CYS  30           HA       CYS  30  -7.547   2.067  -3.972
  250    HB2  CYS  30           HB2      CYS  30  -7.625   2.488  -6.247
  251    HB3  CYS  30           HB3      CYS  30  -6.490   3.695  -5.697
  252    H    LEU  31           H        LEU  31  -8.213   0.223  -4.932
  253    HA   LEU  31           HA       LEU  31  -7.131  -2.002  -3.787
  254    HB2  LEU  31           HB2      LEU  31  -8.922  -3.103  -4.711
  255    HB3  LEU  31           HB3      LEU  31  -9.477  -1.466  -4.643
  256    HG   LEU  31           HG       LEU  31  -8.583  -1.419  -7.139
  257   HD11  LEU  31          HD11      LEU  31  -7.733  -3.713  -7.110
  258   HD12  LEU  31          HD12      LEU  31  -9.029  -3.520  -8.289
  259   HD13  LEU  31          HD13      LEU  31  -9.351  -4.311  -6.747
  260   HD21  LEU  31          HD21      LEU  31 -10.847  -0.899  -6.458
  261   HD22  LEU  31          HD22      LEU  31 -11.211  -2.616  -6.276
  262   HD23  LEU  31          HD23      LEU  31 -10.863  -1.952  -7.872
  263    H    ASP  32           H        ASP  32  -6.199  -0.513  -6.645
  264    HA   ASP  32           HA       ASP  32  -5.296  -2.872  -8.051
  265    HB2  ASP  32           HB2      ASP  32  -6.226  -0.792  -9.126
  266    HB3  ASP  32           HB3      ASP  32  -4.748  -0.008  -8.653
  267    H    CYS  33           H        CYS  33  -4.009  -0.065  -6.512
  268    HA   CYS  33           HA       CYS  33  -1.274  -0.756  -6.589
  269    HB2  CYS  33           HB2      CYS  33  -2.750   1.237  -4.882
  270    HB3  CYS  33           HB3      CYS  33  -1.024   1.009  -4.865
  271    H    GLU  34           H        GLU  34  -3.915  -1.258  -4.416
  272    HA   GLU  34           HA       GLU  34  -2.522  -2.145  -2.214
  273    HB2  GLU  34           HB2      GLU  34  -4.911  -1.704  -2.147
  274    HB3  GLU  34           HB3      GLU  34  -5.213  -3.008  -3.257
  275    HG2  GLU  34           HG2      GLU  34  -3.863  -3.685  -0.745
  276    HG3  GLU  34           HG3      GLU  34  -5.560  -3.265  -0.667
  277    H    ARG  35           H        ARG  35  -3.660  -3.920  -5.026
  278    HA   ARG  35           HA       ARG  35  -2.306  -6.286  -4.144
  279    HB2  ARG  35           HB2      ARG  35  -2.948  -7.349  -6.205
  280    HB3  ARG  35           HB3      ARG  35  -4.321  -6.455  -5.577
  281    HG2  ARG  35           HG2      ARG  35  -3.814  -4.640  -7.178
  282    HG3  ARG  35           HG3      ARG  35  -2.537  -5.645  -7.845
  283    HD2  ARG  35           HD2      ARG  35  -5.439  -6.300  -7.762
  284    HD3  ARG  35           HD3      ARG  35  -4.523  -5.843  -9.186
  285    HE   ARG  35           HE       ARG  35  -3.206  -8.024  -8.285
  286   HH11  ARG  35          HH11      ARG  35  -6.567  -7.396  -9.021
  287   HH12  ARG  35          HH12      ARG  35  -6.914  -9.038  -9.452
  288   HH21  ARG  35          HH21      ARG  35  -3.658 -10.199  -8.856
  289   HH22  ARG  35          HH22      ARG  35  -5.259 -10.632  -9.359
  290    H    LYS  36           H        LYS  36  -1.367  -3.544  -5.961
  291    HA   LYS  36           HA       LYS  36   0.679  -4.577  -7.545
  292    HB2  LYS  36           HB2      LYS  36   0.299  -1.907  -6.219
  293    HB3  LYS  36           HB3      LYS  36   1.609  -2.247  -7.306
  294    HG2  LYS  36           HG2      LYS  36  -0.183  -2.768  -9.012
  295    HG3  LYS  36           HG3      LYS  36  -1.309  -2.093  -7.905
  296    HD2  LYS  36           HD2      LYS  36  -0.348  -0.056  -8.087
  297    HD3  LYS  36           HD3      LYS  36   1.131  -0.639  -8.797
  298    HE2  LYS  36           HE2      LYS  36  -1.578  -0.755 -10.104
  299    HE3  LYS  36           HE3      LYS  36  -0.411   0.532 -10.367
  300    HZ1  LYS  36           HZ1      LYS  36   0.032  -2.340 -10.958
  301    HZ2  LYS  36           HZ2      LYS  36   1.149  -1.100 -11.223
  302    HZ3  LYS  36           HZ3      LYS  36  -0.295  -1.140 -12.102
  303    H    VAL  37           H        VAL  37   0.461  -3.338  -4.327
  304    HA   VAL  37           HA       VAL  37   3.119  -3.185  -3.698
  305    HB   VAL  37           HB       VAL  37   2.454  -3.215  -1.363
  306   HG11  VAL  37          HG11      VAL  37   0.328  -1.670  -2.808
  307   HG12  VAL  37          HG12      VAL  37   2.027  -1.214  -2.943
  308   HG13  VAL  37          HG13      VAL  37   1.237  -1.208  -1.365
  309   HG21  VAL  37          HG21      VAL  37  -0.055  -4.322  -2.466
  310   HG22  VAL  37          HG22      VAL  37  -0.117  -3.308  -1.023
  311   HG23  VAL  37          HG23      VAL  37   0.855  -4.780  -1.021
  312    H    ILE  38           H        ILE  38   0.886  -5.788  -3.121
  313    HA   ILE  38           HA       ILE  38   2.503  -7.539  -1.682
  314    HB   ILE  38           HB       ILE  38   0.407  -8.521  -3.596
  315   HG12  ILE  38          HG12      ILE  38  -0.071  -6.897  -1.109
  316   HG13  ILE  38          HG13      ILE  38  -0.734  -6.658  -2.708
  317   HG21  ILE  38          HG21      ILE  38   1.562 -10.194  -2.330
  318   HG22  ILE  38          HG22      ILE  38  -0.097 -10.069  -1.743
  319   HG23  ILE  38          HG23      ILE  38   1.220  -9.342  -0.826
  320   HD11  ILE  38          HD11      ILE  38  -2.307  -8.315  -2.452
  321   HD12  ILE  38          HD12      ILE  38  -2.221  -7.625  -0.825
  322   HD13  ILE  38          HD13      ILE  38  -1.388  -9.135  -1.193
  323    H    SER  39           H        SER  39   2.130  -6.811  -5.028
  324    HA   SER  39           HA       SER  39   3.488  -9.131  -5.873
  325    HB2  SER  39           HB2      SER  39   2.590  -6.733  -7.461
  326    HB3  SER  39           HB3      SER  39   2.993  -8.315  -8.086
  327    HG   SER  39           HG       SER  39   0.767  -7.570  -6.518
  328    H    THR  40           H        THR  40   4.159  -5.787  -5.306
  329    HA   THR  40           HA       THR  40   6.615  -5.702  -6.810
  330    HB   THR  40           HB       THR  40   5.394  -3.712  -4.893
  331    HG1  THR  40           HG1      THR  40   4.189  -4.232  -6.861
  332   HG21  THR  40          HG21      THR  40   6.860  -2.062  -5.908
  333   HG22  THR  40          HG22      THR  40   7.571  -3.301  -6.942
  334   HG23  THR  40          HG23      THR  40   7.811  -3.365  -5.196
  335    H    SER  41           H        SER  41   5.677  -5.899  -3.402
  336    HA   SER  41           HA       SER  41   8.230  -5.410  -2.321
  337    HB2  SER  41           HB2      SER  41   6.107  -5.166  -1.090
  338    HB3  SER  41           HB3      SER  41   6.000  -6.910  -1.082
  339    HG   SER  41           HG       SER  41   6.966  -5.806   0.828
  340    H    THR  42           H        THR  42   6.704  -8.276  -3.504
  341    HA   THR  42           HA       THR  42   8.360 -10.079  -2.007
  342    HB   THR  42           HB       THR  42   7.165 -11.804  -3.455
  343    HG1  THR  42           HG1      THR  42   5.141 -10.128  -4.111
  344   HG21  THR  42          HG21      THR  42   6.451 -11.210  -1.185
  345   HG22  THR  42          HG22      THR  42   5.061 -11.516  -2.226
  346   HG23  THR  42          HG23      THR  42   5.518  -9.857  -1.830
  347    H    SER  43           H        SER  43   9.934  -8.377  -3.551
  348    HA   SER  43           HA       SER  43  11.579 -10.252  -4.907
  349    HB2  SER  43           HB2      SER  43  11.508  -8.952  -7.122
  350    HB3  SER  43           HB3      SER  43  10.158 -10.034  -6.784
  351    HG   SER  43           HG       SER  43  10.057  -7.303  -6.064
  352    H    ASP  44           H        ASP  44  13.171  -9.522  -3.549
  353    HA   ASP  44           HA       ASP  44  14.356  -6.970  -4.329
  354    HB2  ASP  44           HB2      ASP  44  14.762  -6.244  -2.075
  355    HB3  ASP  44           HB3      ASP  44  13.044  -6.598  -2.207
  356    HA   PRO  45           HA       PRO  45  17.960  -9.493  -4.604
  357    HB2  PRO  45           HB2      PRO  45  19.562  -7.178  -3.743
  358    HB3  PRO  45           HB3      PRO  45  19.615  -8.081  -5.257
  359    HG2  PRO  45           HG2      PRO  45  18.588  -5.582  -5.068
  360    HG3  PRO  45           HG3      PRO  45  18.013  -6.771  -6.236
  361    HD2  PRO  45           HD2      PRO  45  16.763  -5.833  -3.743
  362    HD3  PRO  45           HD3      PRO  45  16.009  -6.395  -5.238
  363    H    ASP  46           H        ASP  46  19.051  -7.204  -2.161
  364    HA   ASP  46           HA       ASP  46  18.513  -8.581   0.174
  365    HB2  ASP  46           HB2      ASP  46  19.945 -10.388  -0.773
  366    HB3  ASP  46           HB3      ASP  46  21.281  -9.245  -0.866
  367    H    TYR  47           H        TYR  47  21.253  -7.014  -1.440
  368    HA   TYR  47           HA       TYR  47  21.485  -5.147   0.794
  369    HB2  TYR  47           HB2      TYR  47  23.311  -5.679  -1.531
  370    HB3  TYR  47           HB3      TYR  47  23.606  -4.459  -0.304
  371    HD1  TYR  47           HD1      TYR  47  24.007  -5.185   2.059
  372    HD2  TYR  47           HD2      TYR  47  23.871  -7.951  -1.169
  373    HE1  TYR  47           HE1      TYR  47  25.158  -6.854   3.447
  374    HE2  TYR  47           HE2      TYR  47  25.018  -9.630   0.212
  375    HH   TYR  47           HH       TYR  47  25.376  -9.327   3.554
  376    H    ALA  48           H        ALA  48  20.610  -3.225   0.645
  377    HA   ALA  48           HA       ALA  48  19.731  -1.289  -0.135
  378    HB1  ALA  48           HB1      ALA  48  21.923  -0.969  -1.156
  379    HB2  ALA  48           HB2      ALA  48  20.647  -0.317  -2.184
  380    HB3  ALA  48           HB3      ALA  48  21.399  -1.861  -2.582
  381    H1   SER   0           H1       SER   0   2.551  22.273  -8.590
  382    H2   SER   0           H2       SER   0   1.119  21.958  -7.751
  383    H3   SER   0           H3       SER   0   1.231  23.315  -8.755
  384    HA   SER   0           HA       SER   0  -0.047  21.610  -9.820
  385    HB2  SER   0           HB2      SER   0   1.407  21.374 -11.889
  386    HB3  SER   0           HB3      SER   0   1.173  23.022 -11.307
  387    HG   SER   0           HG       SER   0   3.351  22.684 -11.769
  388    H    MET   1           H        MET   1   3.335  20.439  -9.831
  389    HA   MET   1           HA       MET   1   2.354  17.813  -8.987
  390    HB2  MET   1           HB2      MET   1   2.483  17.882 -11.495
  391    HB3  MET   1           HB3      MET   1   4.209  18.170 -11.348
  392    HG2  MET   1           HG2      MET   1   4.457  16.021 -10.192
  393    HG3  MET   1           HG3      MET   1   2.732  15.728 -10.389
  394    HE1  MET   1           HE1      MET   1   1.553  15.300 -12.701
  395    HE2  MET   1           HE2      MET   1   2.378  15.359 -14.257
  396    HE3  MET   1           HE3      MET   1   2.165  16.834 -13.315
  397    H    ASP   2           H        ASP   2   3.561  19.444  -7.261
  398    HA   ASP   2           HA       ASP   2   6.380  18.726  -7.143
  399    HB2  ASP   2           HB2      ASP   2   5.740  20.983  -6.405
  400    HB3  ASP   2           HB3      ASP   2   4.682  20.287  -5.180
  401    H    GLU   3           H        GLU   3   6.823  16.728  -6.521
  402    HA   GLU   3           HA       GLU   3   5.799  15.640  -4.078
  403    HB2  GLU   3           HB2      GLU   3   3.883  15.277  -5.584
  404    HB3  GLU   3           HB3      GLU   3   4.927  14.413  -6.701
  405    HG2  GLU   3           HG2      GLU   3   5.309  12.696  -5.011
  406    HG3  GLU   3           HG3      GLU   3   4.251  13.564  -3.898
  407    H    THR   4           H        THR   4   7.867  15.169  -3.455
  408    HA   THR   4           HA       THR   4   9.214  13.035  -4.943
  409    HB   THR   4           HB       THR   4  10.687  15.492  -3.976
  410    HG1  THR   4           HG1      THR   4   9.337  15.831  -5.876
  411   HG21  THR   4          HG21      THR   4  12.043  13.475  -3.933
  412   HG22  THR   4          HG22      THR   4  12.561  14.516  -5.259
  413   HG23  THR   4          HG23      THR   4  11.568  13.095  -5.588
  414    H    VAL   5           H        VAL   5   9.775  11.445  -3.611
  415    HA   VAL   5           HA       VAL   5  10.197  12.073  -0.778
  416    HB   VAL   5           HB       VAL   5   9.851   9.569  -0.430
  417   HG11  VAL   5          HG11      VAL   5   8.204  11.224   0.238
  418   HG12  VAL   5          HG12      VAL   5   7.402   9.802  -0.429
  419   HG13  VAL   5          HG13      VAL   5   7.553  11.266  -1.400
  420   HG21  VAL   5          HG21      VAL   5   8.501   8.431  -2.130
  421   HG22  VAL   5          HG22      VAL   5  10.090   8.877  -2.752
  422   HG23  VAL   5          HG23      VAL   5   8.673   9.829  -3.191
  423    H    LYS   6           H        LYS   6  12.296  12.410  -0.480
  424    HA   LYS   6           HA       LYS   6  14.226  10.765  -1.960
  425    HB2  LYS   6           HB2      LYS   6  15.817  12.631  -1.413
  426    HB3  LYS   6           HB3      LYS   6  14.489  13.076  -2.469
  427    HG2  LYS   6           HG2      LYS   6  13.321  13.937  -0.432
  428    HG3  LYS   6           HG3      LYS   6  14.823  13.700   0.449
  429    HD2  LYS   6           HD2      LYS   6  14.422  15.468  -1.963
  430    HD3  LYS   6           HD3      LYS   6  14.623  16.003  -0.300
  431    HE2  LYS   6           HE2      LYS   6  16.861  15.065  -0.246
  432    HE3  LYS   6           HE3      LYS   6  16.656  14.482  -1.892
  433    HZ1  LYS   6           HZ1      LYS   6  17.906  16.529  -1.861
  434    HZ2  LYS   6           HZ2      LYS   6  16.654  17.322  -1.049
  435    HZ3  LYS   6           HZ3      LYS   6  16.421  16.773  -2.632
  436    H    LEU   7           H        LEU   7  16.379  10.497  -0.788
  437    HA   LEU   7           HA       LEU   7  17.295   8.989   0.650
  438    HB2  LEU   7           HB2      LEU   7  17.579   9.895   2.968
  439    HB3  LEU   7           HB3      LEU   7  18.085  10.956   1.673
  440    HG   LEU   7           HG       LEU   7  15.336  11.444   2.586
  441   HD11  LEU   7          HD11      LEU   7  16.030  12.565   4.657
  442   HD12  LEU   7          HD12      LEU   7  17.659  11.924   4.452
  443   HD13  LEU   7          HD13      LEU   7  16.309  10.825   4.732
  444   HD21  LEU   7          HD21      LEU   7  16.084  13.744   2.471
  445   HD22  LEU   7          HD22      LEU   7  16.592  12.879   1.021
  446   HD23  LEU   7          HD23      LEU   7  17.759  13.220   2.298
  447    H    ASN   8           H        ASN   8  15.618   9.642   3.520
  448    HA   ASN   8           HA       ASN   8  14.296   7.104   3.512
  449    HB2  ASN   8           HB2      ASN   8  13.983   9.467   5.380
  450    HB3  ASN   8           HB3      ASN   8  13.214   7.910   5.610
  451   HD21  ASN   8          HD21      ASN   8  14.186   7.632   7.561
  452   HD22  ASN   8          HD22      ASN   8  15.863   7.238   7.714
  453    H    HIS   9           H        HIS   9  12.810   6.901   2.001
  454    HA   HIS   9           HA       HIS   9  11.200   8.948   0.962
  455    HB2  HIS   9           HB2      HIS   9  10.553   5.996   0.931
  456    HB3  HIS   9           HB3      HIS   9  10.055   7.213  -0.237
  457    HD1  HIS   9           HD1      HIS   9  11.919   8.070  -1.916
  458    HD2  HIS   9           HD2      HIS   9  13.052   4.891   0.516
  459    HE1  HIS   9           HE1      HIS   9  13.996   7.121  -2.960
  460    HE2  HIS   9           HE2      HIS   9  14.726   5.273  -1.415
  461    H    THR  10           H        THR  10   9.473   9.911   1.822
  462    HA   THR  10           HA       THR  10   8.484   9.136   4.353
  463    HB   THR  10           HB       THR  10   7.211  11.036   2.359
  464    HG1  THR  10           HG1      THR  10   8.433  12.523   3.977
  465   HG21  THR  10          HG21      THR  10   5.747  10.412   4.225
  466   HG22  THR  10          HG22      THR  10   6.243  12.100   4.333
  467   HG23  THR  10          HG23      THR  10   7.001  10.891   5.370
  468    H    CYS  11           H        CYS  11   6.924   7.786   4.904
  469    HA   CYS  11           HA       CYS  11   5.600   6.161   2.986
  470    HB2  CYS  11           HB2      CYS  11   6.065   5.323   5.243
  471    HB3  CYS  11           HB3      CYS  11   5.047   6.571   5.942
  472    H    VAL  12           H        VAL  12   3.987   6.756   1.741
  473    HA   VAL  12           HA       VAL  12   2.435   9.054   1.937
  474    HB   VAL  12           HB       VAL  12   0.807   7.913   0.451
  475   HG11  VAL  12          HG11      VAL  12   2.719   8.957  -0.574
  476   HG12  VAL  12          HG12      VAL  12   2.348   7.450  -1.417
  477   HG13  VAL  12          HG13      VAL  12   3.699   7.519  -0.285
  478   HG21  VAL  12          HG21      VAL  12   2.560   5.497   0.876
  479   HG22  VAL  12          HG22      VAL  12   1.258   5.625  -0.308
  480   HG23  VAL  12          HG23      VAL  12   0.891   5.686   1.416
  481    H    ILE  13           H        ILE  13   2.344   6.245   3.798
  482    HA   ILE  13           HA       ILE  13  -0.432   6.531   4.562
  483    HB   ILE  13           HB       ILE  13   1.496   4.526   5.653
  484   HG12  ILE  13          HG12      ILE  13   1.458   4.429   3.150
  485   HG13  ILE  13          HG13      ILE  13   0.886   2.970   3.944
  486   HG21  ILE  13          HG21      ILE  13  -0.531   3.213   6.008
  487   HG22  ILE  13          HG22      ILE  13  -1.488   4.548   5.359
  488   HG23  ILE  13          HG23      ILE  13  -0.575   4.761   6.853
  489   HD11  ILE  13          HD11      ILE  13  -1.348   3.538   3.504
  490   HD12  ILE  13          HD12      ILE  13  -0.423   3.682   2.004
  491   HD13  ILE  13          HD13      ILE  13  -0.886   5.128   2.906
  492    H    CYS  14           H        CYS  14   2.691   6.219   6.186
  493    HA   CYS  14           HA       CYS  14   1.580   6.954   8.733
  494    HB2  CYS  14           HB2      CYS  14   4.385   6.461   7.880
  495    HB3  CYS  14           HB3      CYS  14   3.928   6.734   9.527
  496    H    ASP  15           H        ASP  15   3.099   8.608   6.138
  497    HA   ASP  15           HA       ASP  15   3.910  10.697   5.806
  498    HB2  ASP  15           HB2      ASP  15   1.816  11.206   7.288
  499    HB3  ASP  15           HB3      ASP  15   3.032  11.613   8.481
  500    H    GLN  16           H        GLN  16   5.474   8.663   6.977
  501    HA   GLN  16           HA       GLN  16   7.390  10.181   8.595
  502    HB2  GLN  16           HB2      GLN  16   6.741   7.234   8.745
  503    HB3  GLN  16           HB3      GLN  16   8.012   8.034   9.648
  504    HG2  GLN  16           HG2      GLN  16   5.091   8.592   9.873
  505    HG3  GLN  16           HG3      GLN  16   6.058   7.676  11.019
  506   HE21  GLN  16          HE21      GLN  16   4.485  10.126  11.354
  507   HE22  GLN  16          HE22      GLN  16   5.582  11.313  11.970
  508    H    GLU  17           H        GLU  17   9.519   9.954   8.094
  509    HA   GLU  17           HA       GLU  17  10.133   9.305   5.373
  510    HB2  GLU  17           HB2      GLU  17  11.809  10.409   7.623
  511    HB3  GLU  17           HB3      GLU  17  12.371  10.207   5.968
  512    HG2  GLU  17           HG2      GLU  17  10.884  11.810   5.143
  513    HG3  GLU  17           HG3      GLU  17   9.933  11.802   6.624
  514    H    LYS  18           H        LYS  18  10.234   7.262   4.980
  515    HA   LYS  18           HA       LYS  18  11.958   5.528   6.629
  516    HB2  LYS  18           HB2      LYS  18   9.811   4.335   5.028
  517    HB3  LYS  18           HB3      LYS  18  10.494   3.796   6.526
  518    HG2  LYS  18           HG2      LYS  18   8.525   6.022   6.168
  519    HG3  LYS  18           HG3      LYS  18   8.202   4.427   6.843
  520    HD2  LYS  18           HD2      LYS  18  10.273   6.160   8.082
  521    HD3  LYS  18           HD3      LYS  18   8.587   6.470   8.392
  522    HE2  LYS  18           HE2      LYS  18   9.537   5.111  10.137
  523    HE3  LYS  18           HE3      LYS  18   8.344   4.227   9.219
  524    HZ1  LYS  18           HZ1      LYS  18  10.095   3.078   8.048
  525    HZ2  LYS  18           HZ2      LYS  18  10.312   2.889   9.712
  526    HZ3  LYS  18           HZ3      LYS  18  11.273   3.983   8.856
  527    H    ASN  19           H        ASN  19  13.594   4.495   5.563
  528    HA   ASN  19           HA       ASN  19  13.645   4.814   2.670
  529    HB2  ASN  19           HB2      ASN  19  15.650   5.337   4.127
  530    HB3  ASN  19           HB3      ASN  19  15.803   3.604   4.336
  531   HD21  ASN  19          HD21      ASN  19  17.787   3.504   3.329
  532   HD22  ASN  19          HD22      ASN  19  17.961   3.716   1.592
  533    H    ARG  20           H        ARG  20  12.342   2.649   4.704
  534    HA   ARG  20           HA       ARG  20  12.974   0.359   2.970
  535    HB2  ARG  20           HB2      ARG  20  12.495   0.421   5.935
  536    HB3  ARG  20           HB3      ARG  20  12.532  -1.059   5.019
  537    HG2  ARG  20           HG2      ARG  20  14.798  -0.626   4.352
  538    HG3  ARG  20           HG3      ARG  20  14.778   0.885   5.252
  539    HD2  ARG  20           HD2      ARG  20  14.224  -0.384   7.216
  540    HD3  ARG  20           HD3      ARG  20  14.349  -1.870   6.329
  541    HE   ARG  20           HE       ARG  20  16.749  -0.501   5.994
  542   HH11  ARG  20          HH11      ARG  20  14.957  -2.012   8.599
  543   HH12  ARG  20          HH12      ARG  20  16.380  -2.480   9.475
  544   HH21  ARG  20          HH21      ARG  20  18.619  -1.138   7.137
  545   HH22  ARG  20          HH22      ARG  20  18.462  -1.976   8.646
  546    H    GLY  21           H        GLY  21  11.363  -0.285   1.811
  547    HA2  GLY  21           HA2      GLY  21   8.883  -1.152   2.468
  548    HA3  GLY  21           HA3      GLY  21   8.642   0.575   2.250
  549    H    ILE  22           H        ILE  22   7.312   0.037   0.254
  550    HA   ILE  22           HA       ILE  22   9.099  -0.733  -1.946
  551    HB   ILE  22           HB       ILE  22   7.455  -1.922  -2.995
  552   HG12  ILE  22          HG12      ILE  22   5.400  -0.428  -1.402
  553   HG13  ILE  22          HG13      ILE  22   5.899  -0.007  -3.007
  554   HG21  ILE  22          HG21      ILE  22   6.224  -3.270  -1.319
  555   HG22  ILE  22          HG22      ILE  22   6.750  -2.136  -0.071
  556   HG23  ILE  22          HG23      ILE  22   7.941  -3.094  -0.955
  557   HD11  ILE  22          HD11      ILE  22   3.887  -1.167  -3.240
  558   HD12  ILE  22          HD12      ILE  22   4.414  -2.429  -2.118
  559   HD13  ILE  22          HD13      ILE  22   5.162  -2.294  -3.708
  560    H    HIS  23           H        HIS  23   7.699  -0.091  -4.056
  561    HA   HIS  23           HA       HIS  23   7.108   2.764  -3.925
  562    HB2  HIS  23           HB2      HIS  23   9.274   1.600  -5.691
  563    HB3  HIS  23           HB3      HIS  23   8.712   3.256  -5.735
  564    HD1  HIS  23           HD1      HIS  23   9.528   4.844  -3.881
  565    HD2  HIS  23           HD2      HIS  23  10.952   0.966  -3.616
  566    HE1  HIS  23           HE1      HIS  23  11.395   4.930  -2.196
  567    HE2  HIS  23           HE2      HIS  23  12.230   2.559  -2.022
  568    H    LEU  24           H        LEU  24   5.022   2.530  -4.778
  569    HA   LEU  24           HA       LEU  24   4.807   1.432  -7.467
  570    HB2  LEU  24           HB2      LEU  24   2.829   2.640  -5.540
  571    HB3  LEU  24           HB3      LEU  24   2.461   2.425  -7.192
  572    HG   LEU  24           HG       LEU  24   1.730   0.373  -6.816
  573   HD11  LEU  24          HD11      LEU  24   3.962  -0.492  -7.072
  574   HD12  LEU  24          HD12      LEU  24   3.001  -1.406  -5.908
  575   HD13  LEU  24          HD13      LEU  24   4.237  -0.276  -5.341
  576   HD21  LEU  24          HD21      LEU  24   0.990   1.438  -4.793
  577   HD22  LEU  24          HD22      LEU  24   2.451   0.886  -3.971
  578   HD23  LEU  24          HD23      LEU  24   1.277  -0.286  -4.576
  579    H    TYR  25           H        TYR  25   4.783   2.848  -9.223
  580    HA   TYR  25           HA       TYR  25   4.745   4.810 -10.388
  581    HB2  TYR  25           HB2      TYR  25   3.428   6.039  -7.991
  582    HB3  TYR  25           HB3      TYR  25   3.350   6.623  -9.635
  583    HD1  TYR  25           HD1      TYR  25   2.977   3.076  -8.792
  584    HD2  TYR  25           HD2      TYR  25   0.843   6.649  -9.698
  585    HE1  TYR  25           HE1      TYR  25   0.968   1.768  -9.075
  586    HE2  TYR  25           HE2      TYR  25  -1.213   5.325 -10.014
  587    HH   TYR  25           HH       TYR  25  -1.717   2.933 -10.690
  588    H    THR  26           H        THR  26   4.826   7.241  -8.241
  589    HA   THR  26           HA       THR  26   7.750   7.164  -8.032
  590    HB   THR  26           HB       THR  26   7.206   9.026  -9.336
  591    HG1  THR  26           HG1      THR  26   7.697   9.673  -6.646
  592   HG21  THR  26          HG21      THR  26   4.782   8.932  -8.899
  593   HG22  THR  26          HG22      THR  26   5.419  10.583  -8.892
  594   HG23  THR  26          HG23      THR  26   5.050   9.772  -7.368
  595    H    LYS  27           H        LYS  27   5.553   6.028  -6.177
  596    HA   LYS  27           HA       LYS  27   5.847   7.853  -3.884
  597    HB2  LYS  27           HB2      LYS  27   3.887   5.670  -3.715
  598    HB3  LYS  27           HB3      LYS  27   3.774   7.327  -3.160
  599    HG2  LYS  27           HG2      LYS  27   3.468   6.375  -5.966
  600    HG3  LYS  27           HG3      LYS  27   2.187   6.870  -4.894
  601    HD2  LYS  27           HD2      LYS  27   4.427   8.660  -5.749
  602    HD3  LYS  27           HD3      LYS  27   2.847   8.612  -6.531
  603    HE2  LYS  27           HE2      LYS  27   2.706   8.904  -3.631
  604    HE3  LYS  27           HE3      LYS  27   3.544  10.235  -4.426
  605    HZ1  LYS  27           HZ1      LYS  27   0.738   9.488  -4.510
  606    HZ2  LYS  27           HZ2      LYS  27   1.400   9.912  -6.007
  607    HZ3  LYS  27           HZ3      LYS  27   1.463  11.008  -4.719
  608    H    PHE  28           H        PHE  28   5.186   6.461  -1.856
  609    HA   PHE  28           HA       PHE  28   6.796   4.061  -1.655
  610    HB2  PHE  28           HB2      PHE  28   8.465   5.729  -1.216
  611    HB3  PHE  28           HB3      PHE  28   7.401   6.584  -0.107
  612    HD1  PHE  28           HD1      PHE  28   7.195   5.941   2.143
  613    HD2  PHE  28           HD2      PHE  28   9.392   3.516  -0.560
  614    HE1  PHE  28           HE1      PHE  28   8.042   4.630   4.034
  615    HE2  PHE  28           HE2      PHE  28  10.256   2.196   1.326
  616    HZ   PHE  28           HZ       PHE  28   9.571   2.745   3.643
  617    H    ILE  29           H        ILE  29   5.428   2.677  -0.706
  618    HA   ILE  29           HA       ILE  29   3.970   3.545   1.702
  619    HB   ILE  29           HB       ILE  29   3.931   0.835   0.333
  620   HG12  ILE  29          HG12      ILE  29   1.468   1.554  -0.065
  621   HG13  ILE  29          HG13      ILE  29   2.065   3.188   0.185
  622   HG21  ILE  29          HG21      ILE  29   2.112   0.299   1.853
  623   HG22  ILE  29          HG22      ILE  29   2.215   1.904   2.573
  624   HG23  ILE  29          HG23      ILE  29   3.554   0.763   2.768
  625   HD11  ILE  29          HD11      ILE  29   1.909   2.542  -2.182
  626   HD12  ILE  29          HD12      ILE  29   3.116   1.284  -1.889
  627   HD13  ILE  29          HD13      ILE  29   3.546   2.983  -1.688
  628    H    CYS  30           H        CYS  30   4.943   3.147   3.667
  629    HA   CYS  30           HA       CYS  30   7.502   1.938   3.715
  630    HB2  CYS  30           HB2      CYS  30   7.598   2.371   5.988
  631    HB3  CYS  30           HB3      CYS  30   6.483   3.595   5.437
  632    H    LEU  31           H        LEU  31   8.138   0.085   4.686
  633    HA   LEU  31           HA       LEU  31   7.012  -2.122   3.546
  634    HB2  LEU  31           HB2      LEU  31   8.785  -3.254   4.472
  635    HB3  LEU  31           HB3      LEU  31   9.371  -1.627   4.395
  636    HG   LEU  31           HG       LEU  31   8.482  -1.552   6.892
  637   HD11  LEU  31          HD11      LEU  31   7.587  -3.829   6.874
  638   HD12  LEU  31          HD12      LEU  31   8.889  -3.656   8.051
  639   HD13  LEU  31          HD13      LEU  31   9.194  -4.460   6.511
  640   HD21  LEU  31          HD21      LEU  31  10.753  -1.079   6.207
  641   HD22  LEU  31          HD22      LEU  31  11.085  -2.802   6.029
  642   HD23  LEU  31          HD23      LEU  31  10.752  -2.127   7.624
  643    H    ASP  32           H        ASP  32   6.115  -0.608   6.400
  644    HA   ASP  32           HA       ASP  32   5.175  -2.947   7.814
  645    HB2  ASP  32           HB2      ASP  32   6.149  -0.888   8.885
  646    HB3  ASP  32           HB3      ASP  32   4.693  -0.074   8.412
  647    H    CYS  33           H        CYS  33   3.931  -0.118   6.275
  648    HA   CYS  33           HA       CYS  33   1.183  -0.762   6.356
  649    HB2  CYS  33           HB2      CYS  33   2.689   1.200   4.641
  650    HB3  CYS  33           HB3      CYS  33   0.963   0.999   4.624
  651    H    GLU  34           H        GLU  34   3.812  -1.317   4.181
  652    HA   GLU  34           HA       GLU  34   2.398  -2.185   1.986
  653    HB2  GLU  34           HB2      GLU  34   4.793  -1.791   1.911
  654    HB3  GLU  34           HB3      GLU  34   5.073  -3.096   3.026
  655    HG2  GLU  34           HG2      GLU  34   3.704  -3.757   0.520
  656    HG3  GLU  34           HG3      GLU  34   5.411  -3.371   0.436
  657    H    ARG  35           H        ARG  35   3.508  -3.974   4.799
  658    HA   ARG  35           HA       ARG  35   2.109  -6.318   3.930
  659    HB2  ARG  35           HB2      ARG  35   2.738  -7.384   5.994
  660    HB3  ARG  35           HB3      ARG  35   4.125  -6.518   5.360
  661    HG2  ARG  35           HG2      ARG  35   3.654  -4.688   6.955
  662    HG3  ARG  35           HG3      ARG  35   2.361  -5.666   7.630
  663    HD2  ARG  35           HD2      ARG  35   5.251  -6.376   7.541
  664    HD3  ARG  35           HD3      ARG  35   4.350  -5.895   8.966
  665    HE   ARG  35           HE       ARG  35   2.986  -8.053   8.080
  666   HH11  ARG  35          HH11      ARG  35   6.363  -7.493   8.795
  667   HH12  ARG  35          HH12      ARG  35   6.681  -9.142   9.229
  668   HH21  ARG  35          HH21      ARG  35   3.392 -10.229   8.656
  669   HH22  ARG  35          HH22      ARG  35   4.988 -10.701   9.150
  670    H    LYS  36           H        LYS  36   1.225  -3.552   5.739
  671    HA   LYS  36           HA       LYS  36  -0.837  -4.541   7.332
  672    HB2  LYS  36           HB2      LYS  36  -0.409  -1.881   5.995
  673    HB3  LYS  36           HB3      LYS  36  -1.723  -2.195   7.086
  674    HG2  LYS  36           HG2      LYS  36   0.061  -2.743   8.793
  675    HG3  LYS  36           HG3      LYS  36   1.198  -2.093   7.681
  676    HD2  LYS  36           HD2      LYS  36   0.276  -0.037   7.854
  677    HD3  LYS  36           HD3      LYS  36  -1.212  -0.589   8.571
  678    HE2  LYS  36           HE2      LYS  36   1.496  -0.750   9.873
  679    HE3  LYS  36           HE3      LYS  36   0.355   0.558  10.134
  680    HZ1  LYS  36           HZ1      LYS  36  -0.146  -2.302  10.731
  681    HZ2  LYS  36           HZ2      LYS  36  -1.233  -1.040  11.003
  682    HZ3  LYS  36           HZ3      LYS  36   0.215  -1.111  11.873
  683    H    VAL  37           H        VAL  37  -0.602  -3.318   4.108
  684    HA   VAL  37           HA       VAL  37  -3.258  -3.117   3.485
  685    HB   VAL  37           HB       VAL  37  -2.600  -3.167   1.148
  686   HG11  VAL  37          HG11      VAL  37  -0.441  -1.659   2.584
  687   HG12  VAL  37          HG12      VAL  37  -2.133  -1.169   2.721
  688   HG13  VAL  37          HG13      VAL  37  -1.346  -1.183   1.141
  689   HG21  VAL  37          HG21      VAL  37  -0.107  -4.317   2.249
  690   HG22  VAL  37          HG22      VAL  37  -0.032  -3.309   0.803
  691   HG23  VAL  37          HG23      VAL  37  -1.031  -4.764   0.808
  692    H    ILE  38           H        ILE  38  -1.076  -5.763   2.912
  693    HA   ILE  38           HA       ILE  38  -2.728  -7.489   1.480
  694    HB   ILE  38           HB       ILE  38  -0.646  -8.504   3.393
  695   HG12  ILE  38          HG12      ILE  38  -0.142  -6.896   0.900
  696   HG13  ILE  38          HG13      ILE  38   0.528  -6.664   2.497
  697   HG21  ILE  38          HG21      ILE  38  -1.834 -10.156   2.133
  698   HG22  ILE  38          HG22      ILE  38  -0.175 -10.063   1.542
  699   HG23  ILE  38          HG23      ILE  38  -1.480  -9.316   0.627
  700   HD11  ILE  38          HD11      ILE  38   2.068  -8.351   2.245
  701   HD12  ILE  38          HD12      ILE  38   1.994  -7.665   0.617
  702   HD13  ILE  38          HD13      ILE  38   1.133  -9.158   0.992
  703    H    SER  39           H        SER  39  -2.333  -6.759   4.822
  704    HA   SER  39           HA       SER  39  -3.732  -9.050   5.678
  705    HB2  SER  39           HB2      SER  39  -2.787  -6.664   7.259
  706    HB3  SER  39           HB3      SER  39  -3.212  -8.240   7.888
  707    HG   SER  39           HG       SER  39  -0.988  -7.537   6.299
  708    H    THR  40           H        THR  40  -4.343  -5.696   5.102
  709    HA   THR  40           HA       THR  40  -6.794  -5.562   6.609
  710    HB   THR  40           HB       THR  40  -5.537  -3.599   4.690
  711    HG1  THR  40           HG1      THR  40  -4.339  -4.131   6.652
  712   HG21  THR  40          HG21      THR  40  -6.974  -1.922   5.697
  713   HG22  THR  40          HG22      THR  40  -7.705  -3.143   6.739
  714   HG23  THR  40          HG23      THR  40  -7.951  -3.210   4.994
  715    H    SER  41           H        SER  41  -5.866  -5.787   3.202
  716    HA   SER  41           HA       SER  41  -8.411  -5.252   2.122
  717    HB2  SER  41           HB2      SER  41  -6.288  -5.052   0.885
  718    HB3  SER  41           HB3      SER  41  -6.207  -6.798   0.888
  719    HG   SER  41           HG       SER  41  -7.170  -5.671  -1.026
  720    H    THR  42           H        THR  42  -6.937  -8.140   3.314
  721    HA   THR  42           HA       THR  42  -8.631  -9.918   1.830
  722    HB   THR  42           HB       THR  42  -7.462 -11.662   3.275
  723    HG1  THR  42           HG1      THR  42  -5.407 -10.010   3.911
  724   HG21  THR  42          HG21      THR  42  -6.742 -11.092   1.003
  725   HG22  THR  42          HG22      THR  42  -5.355 -11.418   2.042
  726   HG23  THR  42          HG23      THR  42  -5.783  -9.754   1.640
  727    H    SER  43           H        SER  43 -10.169  -8.186   3.366
  728    HA   SER  43           HA       SER  43 -11.844 -10.025   4.736
  729    HB2  SER  43           HB2      SER  43 -11.746  -8.720   6.946
  730    HB3  SER  43           HB3      SER  43 -10.407  -9.818   6.609
  731    HG   SER  43           HG       SER  43 -10.288  -7.092   5.878
  732    H    ASP  44           H        ASP  44 -13.428  -9.272   3.381
  733    HA   ASP  44           HA       ASP  44 -14.561  -6.695   4.152
  734    HB2  ASP  44           HB2      ASP  44 -14.956  -5.967   1.896
  735    HB3  ASP  44           HB3      ASP  44 -13.244  -6.351   2.029
  736    HA   PRO  45           HA       PRO  45 -18.210  -9.151   4.440
  737    HB2  PRO  45           HB2      PRO  45 -19.769  -6.808   3.574
  738    HB3  PRO  45           HB3      PRO  45 -19.839  -7.707   5.089
  739    HG2  PRO  45           HG2      PRO  45 -18.766  -5.228   4.895
  740    HG3  PRO  45           HG3      PRO  45 -18.212  -6.425   6.065
  741    HD2  PRO  45           HD2      PRO  45 -16.950  -5.517   3.569
  742    HD3  PRO  45           HD3      PRO  45 -16.202  -6.089   5.064
  743    H    ASP  46           H        ASP  46 -19.260  -6.847   1.991
  744    HA   ASP  46           HA       ASP  46 -18.760  -8.242  -0.341
  745    HB2  ASP  46           HB2      ASP  46 -20.222 -10.020   0.617
  746    HB3  ASP  46           HB3      ASP  46 -21.537  -8.852   0.711
  747    H    TYR  47           H        TYR  47 -21.465  -6.621   1.278
  748    HA   TYR  47           HA       TYR  47 -21.667  -4.757  -0.962
  749    HB2  TYR  47           HB2      TYR  47 -23.498  -5.248   1.369
  750    HB3  TYR  47           HB3      TYR  47 -23.774  -4.027   0.141
  751    HD1  TYR  47           HD1      TYR  47 -24.194  -4.755  -2.220
  752    HD2  TYR  47           HD2      TYR  47 -24.101  -7.511   1.017
  753    HE1  TYR  47           HE1      TYR  47 -25.375  -6.407  -3.602
  754    HE2  TYR  47           HE2      TYR  47 -25.279  -9.173  -0.360
  755    HH   TYR  47           HH       TYR  47 -25.636  -8.864  -3.707
  756    H    ALA  48           H        ALA  48 -20.762  -2.849  -0.817
  757    HA   ALA  48           HA       ALA  48 -19.844  -0.930  -0.046
  758    HB1  ALA  48           HB1      ALA  48 -22.025  -0.566   0.971
  759    HB2  ALA  48           HB2      ALA  48 -20.738   0.060   2.001
  760    HB3  ALA  48           HB3      ALA  48 -21.520  -1.467   2.401
  Start of MODEL    7
    1    H1   SER   0           H1       SER   0  -7.722  21.045   8.971
    2    H2   SER   0           H2       SER   0  -6.149  21.133   8.356
    3    H3   SER   0           H3       SER   0  -6.416  20.531   9.912
    4    HA   SER   0           HA       SER   0  -7.556  18.634   9.068
    5    HB2  SER   0           HB2      SER   0  -6.972  19.822   6.343
    6    HB3  SER   0           HB3      SER   0  -7.739  18.265   6.648
    7    HG   SER   0           HG       SER   0  -9.510  19.307   7.500
    8    H    MET   1           H        MET   1  -6.426  16.794   7.806
    9    HA   MET   1           HA       MET   1  -3.508  17.195   7.902
   10    HB2  MET   1           HB2      MET   1  -5.092  14.837   8.935
   11    HB3  MET   1           HB3      MET   1  -3.345  14.831   8.734
   12    HG2  MET   1           HG2      MET   1  -3.130  16.626  10.349
   13    HG3  MET   1           HG3      MET   1  -4.882  16.701  10.522
   14    HE1  MET   1           HE1      MET   1  -3.650  15.192  13.940
   15    HE2  MET   1           HE2      MET   1  -4.537  16.506  13.167
   16    HE3  MET   1           HE3      MET   1  -2.792  16.374  12.950
   17    H    ASP   2           H        ASP   2  -4.250  17.611   5.572
   18    HA   ASP   2           HA       ASP   2  -4.291  17.020   3.387
   19    HB2  ASP   2           HB2      ASP   2  -2.772  14.666   4.507
   20    HB3  ASP   2           HB3      ASP   2  -3.051  14.882   2.782
   21    H    GLU   3           H        GLU   3  -6.576  16.895   3.460
   22    HA   GLU   3           HA       GLU   3  -7.975  14.527   4.093
   23    HB2  GLU   3           HB2      GLU   3  -8.846  16.868   2.415
   24    HB3  GLU   3           HB3      GLU   3  -9.906  15.626   3.074
   25    HG2  GLU   3           HG2      GLU   3  -8.308  17.667   4.590
   26    HG3  GLU   3           HG3      GLU   3 -10.054  17.520   4.474
   27    H    THR   4           H        THR   4  -8.603  12.829   2.852
   28    HA   THR   4           HA       THR   4  -7.291  12.645   0.252
   29    HB   THR   4           HB       THR   4  -7.852  10.168   0.511
   30    HG1  THR   4           HG1      THR   4  -7.938  10.275   3.214
   31   HG21  THR   4          HG21      THR   4  -5.944   9.789   1.958
   32   HG22  THR   4          HG22      THR   4  -6.062  11.429   2.592
   33   HG23  THR   4          HG23      THR   4  -5.620  11.164   0.905
   34    H    VAL   5           H        VAL   5 -10.187  13.598   1.253
   35    HA   VAL   5           HA       VAL   5 -12.063  14.124   0.087
   36    HB   VAL   5           HB       VAL   5 -10.825  12.554  -2.181
   37   HG11  VAL   5          HG11      VAL   5 -13.177  14.439  -2.217
   38   HG12  VAL   5          HG12      VAL   5 -13.264  12.687  -2.383
   39   HG13  VAL   5          HG13      VAL   5 -12.453  13.650  -3.617
   40   HG21  VAL   5          HG21      VAL   5 -10.326  14.778  -3.110
   41   HG22  VAL   5          HG22      VAL   5  -9.505  14.495  -1.576
   42   HG23  VAL   5          HG23      VAL   5 -10.941  15.518  -1.633
   43    H    LYS   6           H        LYS   6 -14.055  13.307   0.219
   44    HA   LYS   6           HA       LYS   6 -14.305  10.501   0.917
   45    HB2  LYS   6           HB2      LYS   6 -16.232  12.782   1.116
   46    HB3  LYS   6           HB3      LYS   6 -16.592  11.151   1.635
   47    HG2  LYS   6           HG2      LYS   6 -14.844  11.271   3.280
   48    HG3  LYS   6           HG3      LYS   6 -14.381  12.874   2.725
   49    HD2  LYS   6           HD2      LYS   6 -17.079  12.166   3.858
   50    HD3  LYS   6           HD3      LYS   6 -15.771  12.897   4.784
   51    HE2  LYS   6           HE2      LYS   6 -15.799  14.804   3.247
   52    HE3  LYS   6           HE3      LYS   6 -17.138  14.077   2.372
   53    HZ1  LYS   6           HZ1      LYS   6 -18.473  14.210   4.380
   54    HZ2  LYS   6           HZ2      LYS   6 -17.907  15.740   3.938
   55    HZ3  LYS   6           HZ3      LYS   6 -17.183  14.911   5.219
   56    H    LEU   7           H        LEU   7 -16.772   9.786   0.265
   57    HA   LEU   7           HA       LEU   7 -17.964   8.791  -1.373
   58    HB2  LEU   7           HB2      LEU   7 -17.007  11.121  -2.944
   59    HB3  LEU   7           HB3      LEU   7 -17.939   9.869  -3.691
   60    HG   LEU   7           HG       LEU   7 -19.484  11.535  -3.220
   61   HD11  LEU   7          HD11      LEU   7 -20.173   9.312  -2.468
   62   HD12  LEU   7          HD12      LEU   7 -20.936  10.607  -1.547
   63   HD13  LEU   7          HD13      LEU   7 -19.594   9.700  -0.851
   64   HD21  LEU   7          HD21      LEU   7 -18.070  12.930  -1.845
   65   HD22  LEU   7          HD22      LEU   7 -18.221  11.799  -0.503
   66   HD23  LEU   7          HD23      LEU   7 -19.635  12.689  -1.069
   67    H    ASN   8           H        ASN   8 -15.301   9.956  -3.397
   68    HA   ASN   8           HA       ASN   8 -14.306   7.179  -3.498
   69    HB2  ASN   8           HB2      ASN   8 -13.896   9.365  -5.557
   70    HB3  ASN   8           HB3      ASN   8 -13.179   7.775  -5.615
   71   HD21  ASN   8          HD21      ASN   8 -14.079   7.329  -7.582
   72   HD22  ASN   8          HD22      ASN   8 -15.761   6.982  -7.779
   73    H    HIS   9           H        HIS   9 -12.820   7.183  -1.890
   74    HA   HIS   9           HA       HIS   9 -11.147   9.331  -1.213
   75    HB2  HIS   9           HB2      HIS   9 -10.944   6.362  -0.769
   76    HB3  HIS   9           HB3      HIS   9  -9.656   7.450  -0.263
   77    HD1  HIS   9           HD1      HIS   9 -13.002   6.224   0.702
   78    HD2  HIS   9           HD2      HIS   9 -10.414   9.294   1.785
   79    HE1  HIS   9           HE1      HIS   9 -13.866   7.098   2.897
   80    HE2  HIS   9           HE2      HIS   9 -12.314   8.988   3.508
   81    H    THR  10           H        THR  10  -9.423  10.144  -2.169
   82    HA   THR  10           HA       THR  10  -8.661   9.163  -4.741
   83    HB   THR  10           HB       THR  10  -7.301  11.267  -3.026
   84    HG1  THR  10           HG1      THR  10  -9.715  11.370  -3.820
   85   HG21  THR  10          HG21      THR  10  -6.507  12.167  -5.167
   86   HG22  THR  10          HG22      THR  10  -7.270  10.821  -6.014
   87   HG23  THR  10          HG23      THR  10  -5.930  10.520  -4.907
   88    H    CYS  11           H        CYS  11  -6.984   7.942  -5.331
   89    HA   CYS  11           HA       CYS  11  -5.801   6.274  -3.392
   90    HB2  CYS  11           HB2      CYS  11  -6.244   5.640  -5.760
   91    HB3  CYS  11           HB3      CYS  11  -4.922   6.682  -6.230
   92    H    VAL  12           H        VAL  12  -4.272   6.652  -2.126
   93    HA   VAL  12           HA       VAL  12  -2.402   8.596  -1.985
   94    HB   VAL  12           HB       VAL  12  -3.107   6.324  -0.669
   95   HG11  VAL  12          HG11      VAL  12  -1.755   4.821  -1.850
   96   HG12  VAL  12          HG12      VAL  12  -1.023   5.060  -0.265
   97   HG13  VAL  12          HG13      VAL  12  -0.341   5.857  -1.683
   98   HG21  VAL  12          HG21      VAL  12  -0.882   8.224  -0.221
   99   HG22  VAL  12          HG22      VAL  12  -1.290   6.953   0.930
  100   HG23  VAL  12          HG23      VAL  12  -2.489   8.173   0.501
  101    H    ILE  13           H        ILE  13  -2.501   5.954  -4.241
  102    HA   ILE  13           HA       ILE  13   0.342   6.230  -4.859
  103    HB   ILE  13           HB       ILE  13  -1.569   4.233  -6.024
  104   HG12  ILE  13          HG12      ILE  13  -1.509   4.063  -3.554
  105   HG13  ILE  13          HG13      ILE  13  -0.849   2.652  -4.358
  106   HG21  ILE  13          HG21      ILE  13   0.488   4.558  -7.262
  107   HG22  ILE  13          HG22      ILE  13   0.477   2.973  -6.489
  108   HG23  ILE  13          HG23      ILE  13   1.426   4.287  -5.795
  109   HD11  ILE  13          HD11      ILE  13   0.421   3.407  -2.410
  110   HD12  ILE  13          HD12      ILE  13   0.798   4.887  -3.288
  111   HD13  ILE  13          HD13      ILE  13   1.356   3.334  -3.901
  112    H    CYS  14           H        CYS  14  -2.708   5.917  -6.728
  113    HA   CYS  14           HA       CYS  14  -1.256   7.049  -8.948
  114    HB2  CYS  14           HB2      CYS  14  -3.020   6.092 -10.365
  115    HB3  CYS  14           HB3      CYS  14  -2.175   4.898  -9.413
  116    H    ASP  15           H        ASP  15  -3.100   8.237  -6.606
  117    HA   ASP  15           HA       ASP  15  -4.063  10.266  -6.271
  118    HB2  ASP  15           HB2      ASP  15  -2.006  10.883  -7.546
  119    HB3  ASP  15           HB3      ASP  15  -2.997  10.984  -8.984
  120    H    GLN  16           H        GLN  16  -5.456   8.167  -7.700
  121    HA   GLN  16           HA       GLN  16  -7.440   9.702  -9.197
  122    HB2  GLN  16           HB2      GLN  16  -7.018   6.721  -9.085
  123    HB3  GLN  16           HB3      GLN  16  -8.177   7.560 -10.105
  124    HG2  GLN  16           HG2      GLN  16  -5.182   7.748 -10.258
  125    HG3  GLN  16           HG3      GLN  16  -6.242   6.917 -11.385
  126   HE21  GLN  16          HE21      GLN  16  -4.333   9.031 -11.834
  127   HE22  GLN  16          HE22      GLN  16  -5.221  10.316 -12.566
  128    H    GLU  17           H        GLU  17  -9.489   9.765  -8.566
  129    HA   GLU  17           HA       GLU  17 -10.158   9.244  -5.857
  130    HB2  GLU  17           HB2      GLU  17 -11.811  10.263  -8.163
  131    HB3  GLU  17           HB3      GLU  17 -12.384  10.157  -6.507
  132    HG2  GLU  17           HG2      GLU  17 -10.902  11.795  -5.773
  133    HG3  GLU  17           HG3      GLU  17  -9.925  11.694  -7.231
  134    H    LYS  18           H        LYS  18 -10.443   7.269  -5.287
  135    HA   LYS  18           HA       LYS  18 -12.058   5.451  -6.948
  136    HB2  LYS  18           HB2      LYS  18 -10.010   4.424  -5.102
  137    HB3  LYS  18           HB3      LYS  18 -10.671   3.672  -6.513
  138    HG2  LYS  18           HG2      LYS  18  -8.643   5.872  -6.412
  139    HG3  LYS  18           HG3      LYS  18  -8.395   4.210  -6.939
  140    HD2  LYS  18           HD2      LYS  18 -10.385   5.927  -8.311
  141    HD3  LYS  18           HD3      LYS  18  -8.696   6.096  -8.670
  142    HE2  LYS  18           HE2      LYS  18  -9.749   4.641 -10.271
  143    HE3  LYS  18           HE3      LYS  18  -8.599   3.774  -9.284
  144    HZ1  LYS  18           HZ1      LYS  18 -10.708   2.571  -9.686
  145    HZ2  LYS  18           HZ2      LYS  18 -11.512   3.757  -8.787
  146    HZ3  LYS  18           HZ3      LYS  18 -10.348   2.777  -8.046
  147    H    ASN  19           H        ASN  19 -13.630   4.267  -5.927
  148    HA   ASN  19           HA       ASN  19 -13.944   4.825  -3.066
  149    HB2  ASN  19           HB2      ASN  19 -16.273   4.253  -3.317
  150    HB3  ASN  19           HB3      ASN  19 -15.836   5.395  -4.577
  151   HD21  ASN  19          HD21      ASN  19 -16.861   2.171  -3.863
  152   HD22  ASN  19          HD22      ASN  19 -17.137   1.678  -5.529
  153    H    ARG  20           H        ARG  20 -12.765   2.495  -5.097
  154    HA   ARG  20           HA       ARG  20 -13.246   0.407  -3.090
  155    HB2  ARG  20           HB2      ARG  20 -12.881   0.087  -6.068
  156    HB3  ARG  20           HB3      ARG  20 -12.789  -1.237  -4.937
  157    HG2  ARG  20           HG2      ARG  20 -15.073  -0.785  -4.247
  158    HG3  ARG  20           HG3      ARG  20 -15.139   0.540  -5.399
  159    HD2  ARG  20           HD2      ARG  20 -14.723  -0.932  -7.216
  160    HD3  ARG  20           HD3      ARG  20 -14.519  -2.240  -6.090
  161    HE   ARG  20           HE       ARG  20 -17.081  -0.835  -6.217
  162   HH11  ARG  20          HH11      ARG  20 -15.279  -3.800  -6.699
  163   HH12  ARG  20          HH12      ARG  20 -16.703  -4.781  -6.832
  164   HH21  ARG  20          HH21      ARG  20 -18.934  -2.118  -6.404
  165   HH22  ARG  20          HH22      ARG  20 -18.778  -3.828  -6.668
  166    H    GLY  21           H        GLY  21 -11.603  -0.462  -2.122
  167    HA2  GLY  21           HA2      GLY  21  -9.049  -0.975  -2.675
  168    HA3  GLY  21           HA3      GLY  21  -9.009   0.781  -2.504
  169    H    ILE  22           H        ILE  22  -7.573   0.283  -0.554
  170    HA   ILE  22           HA       ILE  22  -9.352  -0.278   1.702
  171    HB   ILE  22           HB       ILE  22  -7.766  -1.527   2.779
  172   HG12  ILE  22          HG12      ILE  22  -5.685  -0.141   1.126
  173   HG13  ILE  22          HG13      ILE  22  -6.101   0.236   2.760
  174   HG21  ILE  22          HG21      ILE  22  -6.519  -2.960   1.116
  175   HG22  ILE  22          HG22      ILE  22  -7.168  -1.915  -0.150
  176   HG23  ILE  22          HG23      ILE  22  -8.263  -2.850   0.874
  177   HD11  ILE  22          HD11      ILE  22  -4.071  -1.051   2.692
  178   HD12  ILE  22          HD12      ILE  22  -4.897  -2.325   1.796
  179   HD13  ILE  22          HD13      ILE  22  -5.357  -1.978   3.467
  180    H    HIS  23           H        HIS  23  -7.989   0.516   3.708
  181    HA   HIS  23           HA       HIS  23  -6.773   3.070   3.349
  182    HB2  HIS  23           HB2      HIS  23  -8.495   4.393   4.531
  183    HB3  HIS  23           HB3      HIS  23  -9.066   3.795   2.997
  184    HD1  HIS  23           HD1      HIS  23 -10.048   4.144   6.430
  185    HD2  HIS  23           HD2      HIS  23 -10.745   1.433   3.388
  186    HE1  HIS  23           HE1      HIS  23 -12.138   2.916   7.099
  187    HE2  HIS  23           HE2      HIS  23 -12.557   1.279   5.229
  188    H    LEU  24           H        LEU  24  -5.222   3.033   4.816
  189    HA   LEU  24           HA       LEU  24  -5.415   1.139   6.981
  190    HB2  LEU  24           HB2      LEU  24  -3.193   2.877   5.947
  191    HB3  LEU  24           HB3      LEU  24  -3.028   1.766   7.258
  192    HG   LEU  24           HG       LEU  24  -3.709   0.961   4.444
  193   HD11  LEU  24          HD11      LEU  24  -1.422   1.769   4.617
  194   HD12  LEU  24          HD12      LEU  24  -1.448   0.023   4.397
  195   HD13  LEU  24          HD13      LEU  24  -1.134   0.706   5.991
  196   HD21  LEU  24          HD21      LEU  24  -3.066  -0.686   6.884
  197   HD22  LEU  24          HD22      LEU  24  -3.304  -1.313   5.253
  198   HD23  LEU  24          HD23      LEU  24  -4.646  -0.552   6.109
  199    H    TYR  25           H        TYR  25  -4.177   4.414   6.678
  200    HA   TYR  25           HA       TYR  25  -4.931   4.914   9.423
  201    HB2  TYR  25           HB2      TYR  25  -3.133   6.427   7.580
  202    HB3  TYR  25           HB3      TYR  25  -3.509   6.949   9.209
  203    HD1  TYR  25           HD1      TYR  25  -3.079   3.395   8.473
  204    HD2  TYR  25           HD2      TYR  25  -1.125   6.918   9.824
  205    HE1  TYR  25           HE1      TYR  25  -1.222   2.031   9.291
  206    HE2  TYR  25           HE2      TYR  25   0.742   5.561  10.659
  207    HH   TYR  25           HH       TYR  25   1.139   3.212  11.390
  208    H    THR  26           H        THR  26  -4.612   7.726   7.573
  209    HA   THR  26           HA       THR  26  -7.526   7.892   7.283
  210    HB   THR  26           HB       THR  26  -6.479   9.679   8.635
  211    HG1  THR  26           HG1      THR  26  -7.440  10.736   6.168
  212   HG21  THR  26          HG21      THR  26  -5.114  10.477   6.067
  213   HG22  THR  26          HG22      THR  26  -4.320   9.748   7.461
  214   HG23  THR  26          HG23      THR  26  -5.054  11.348   7.600
  215    H    LYS  27           H        LYS  27  -5.073   6.825   5.524
  216    HA   LYS  27           HA       LYS  27  -5.829   8.271   3.078
  217    HB2  LYS  27           HB2      LYS  27  -3.676   6.972   2.244
  218    HB3  LYS  27           HB3      LYS  27  -3.588   8.530   3.050
  219    HG2  LYS  27           HG2      LYS  27  -3.405   5.974   4.593
  220    HG3  LYS  27           HG3      LYS  27  -1.992   6.678   3.796
  221    HD2  LYS  27           HD2      LYS  27  -3.727   7.937   5.908
  222    HD3  LYS  27           HD3      LYS  27  -2.040   7.479   6.049
  223    HE2  LYS  27           HE2      LYS  27  -2.065   9.122   3.841
  224    HE3  LYS  27           HE3      LYS  27  -3.255   9.862   4.900
  225    HZ1  LYS  27           HZ1      LYS  27  -1.710  10.352   6.486
  226    HZ2  LYS  27           HZ2      LYS  27  -0.773  10.531   5.090
  227    HZ3  LYS  27           HZ3      LYS  27  -0.645   9.122   6.021
  228    H    PHE  28           H        PHE  28  -5.029   6.717   1.158
  229    HA   PHE  28           HA       PHE  28  -6.616   4.284   1.345
  230    HB2  PHE  28           HB2      PHE  28  -8.236   6.002   0.931
  231    HB3  PHE  28           HB3      PHE  28  -7.240   6.716  -0.322
  232    HD1  PHE  28           HD1      PHE  28  -9.355   3.784   0.469
  233    HD2  PHE  28           HD2      PHE  28  -7.280   5.954  -2.532
  234    HE1  PHE  28           HE1      PHE  28 -10.432   2.415  -1.273
  235    HE2  PHE  28           HE2      PHE  28  -8.330   4.593  -4.269
  236    HZ   PHE  28           HZ       PHE  28  -9.906   2.803  -3.664
  237    H    ILE  29           H        ILE  29  -5.218   2.829   0.462
  238    HA   ILE  29           HA       ILE  29  -3.934   3.529  -2.074
  239    HB   ILE  29           HB       ILE  29  -3.968   0.834  -0.677
  240   HG12  ILE  29          HG12      ILE  29  -1.440   1.420  -0.416
  241   HG13  ILE  29          HG13      ILE  29  -1.980   3.085  -0.594
  242   HG21  ILE  29          HG21      ILE  29  -2.214   0.234  -2.274
  243   HG22  ILE  29          HG22      ILE  29  -2.376   1.813  -3.039
  244   HG23  ILE  29          HG23      ILE  29  -3.724   0.670  -3.086
  245   HD11  ILE  29          HD11      ILE  29  -3.274   2.975   1.366
  246   HD12  ILE  29          HD12      ILE  29  -1.727   2.222   1.761
  247   HD13  ILE  29          HD13      ILE  29  -3.142   1.218   1.446
  248    H    CYS  30           H        CYS  30  -5.137   3.244  -3.923
  249    HA   CYS  30           HA       CYS  30  -7.688   2.007  -3.757
  250    HB2  CYS  30           HB2      CYS  30  -8.043   2.534  -5.962
  251    HB3  CYS  30           HB3      CYS  30  -6.828   3.724  -5.534
  252    H    LEU  31           H        LEU  31  -8.378   0.212  -4.950
  253    HA   LEU  31           HA       LEU  31  -7.257  -2.033  -3.889
  254    HB2  LEU  31           HB2      LEU  31  -9.023  -3.137  -4.842
  255    HB3  LEU  31           HB3      LEU  31  -9.618  -1.517  -4.708
  256    HG   LEU  31           HG       LEU  31  -8.713  -1.388  -7.216
  257   HD11  LEU  31          HD11      LEU  31  -7.885  -3.682  -7.262
  258   HD12  LEU  31          HD12      LEU  31  -9.205  -3.457  -8.411
  259   HD13  LEU  31          HD13      LEU  31  -9.500  -4.280  -6.880
  260   HD21  LEU  31          HD21      LEU  31 -11.352  -2.581  -6.384
  261   HD22  LEU  31          HD22      LEU  31 -10.998  -1.862  -7.955
  262   HD23  LEU  31          HD23      LEU  31 -10.970  -0.863  -6.501
  263    H    ASP  32           H        ASP  32  -6.459  -0.504  -6.829
  264    HA   ASP  32           HA       ASP  32  -5.498  -2.893  -8.151
  265    HB2  ASP  32           HB2      ASP  32  -6.500  -0.773  -9.253
  266    HB3  ASP  32           HB3      ASP  32  -4.900  -0.115  -9.011
  267    H    CYS  33           H        CYS  33  -4.316  -0.037  -6.650
  268    HA   CYS  33           HA       CYS  33  -1.559  -0.626  -6.919
  269    HB2  CYS  33           HB2      CYS  33  -2.924   1.401  -5.155
  270    HB3  CYS  33           HB3      CYS  33  -1.212   1.237  -5.392
  271    H    GLU  34           H        GLU  34  -4.029  -1.099  -4.574
  272    HA   GLU  34           HA       GLU  34  -2.493  -1.839  -2.398
  273    HB2  GLU  34           HB2      GLU  34  -4.931  -1.358  -2.363
  274    HB3  GLU  34           HB3      GLU  34  -5.223  -2.886  -3.136
  275    HG2  GLU  34           HG2      GLU  34  -3.771  -2.809  -0.571
  276    HG3  GLU  34           HG3      GLU  34  -5.507  -2.666  -0.597
  277    H    ARG  35           H        ARG  35  -3.712  -3.761  -5.079
  278    HA   ARG  35           HA       ARG  35  -2.315  -6.080  -4.131
  279    HB2  ARG  35           HB2      ARG  35  -2.855  -7.137  -6.294
  280    HB3  ARG  35           HB3      ARG  35  -4.272  -6.465  -5.504
  281    HG2  ARG  35           HG2      ARG  35  -4.139  -4.518  -6.982
  282    HG3  ARG  35           HG3      ARG  35  -2.759  -5.239  -7.794
  283    HD2  ARG  35           HD2      ARG  35  -4.134  -7.101  -8.454
  284    HD3  ARG  35           HD3      ARG  35  -5.514  -6.424  -7.606
  285    HE   ARG  35           HE       ARG  35  -4.627  -4.503  -9.400
  286   HH11  ARG  35          HH11      ARG  35  -5.943  -7.734  -9.529
  287   HH12  ARG  35          HH12      ARG  35  -6.751  -7.484 -11.042
  288   HH21  ARG  35          HH21      ARG  35  -5.698  -4.147 -11.379
  289   HH22  ARG  35          HH22      ARG  35  -6.602  -5.444 -12.102
  290    H    LYS  36           H        LYS  36  -1.436  -3.367  -6.007
  291    HA   LYS  36           HA       LYS  36   0.612  -4.449  -7.591
  292    HB2  LYS  36           HB2      LYS  36   0.324  -1.706  -6.467
  293    HB3  LYS  36           HB3      LYS  36   1.536  -2.155  -7.634
  294    HG2  LYS  36           HG2      LYS  36  -0.350  -2.717  -9.170
  295    HG3  LYS  36           HG3      LYS  36  -1.432  -2.030  -8.021
  296    HD2  LYS  36           HD2      LYS  36  -0.336   0.026  -8.234
  297    HD3  LYS  36           HD3      LYS  36   0.893  -0.629  -9.280
  298    HE2  LYS  36           HE2      LYS  36  -2.052  -0.519  -9.904
  299    HE3  LYS  36           HE3      LYS  36  -0.863   0.649 -10.470
  300    HZ1  LYS  36           HZ1      LYS  36  -1.327  -1.028 -12.142
  301    HZ2  LYS  36           HZ2      LYS  36  -0.848  -2.253 -11.082
  302    HZ3  LYS  36           HZ3      LYS  36   0.284  -1.123 -11.635
  303    H    VAL  37           H        VAL  37   0.393  -3.109  -4.420
  304    HA   VAL  37           HA       VAL  37   3.064  -2.923  -3.806
  305    HB   VAL  37           HB       VAL  37   2.423  -2.947  -1.465
  306   HG11  VAL  37          HG11      VAL  37   1.079  -0.977  -1.448
  307   HG12  VAL  37          HG12      VAL  37   0.365  -1.389  -3.008
  308   HG13  VAL  37          HG13      VAL  37   2.064  -0.912  -2.910
  309   HG21  VAL  37          HG21      VAL  37  -0.141  -3.990  -2.521
  310   HG22  VAL  37          HG22      VAL  37  -0.111  -3.031  -1.039
  311   HG23  VAL  37          HG23      VAL  37   0.822  -4.527  -1.138
  312    H    ILE  38           H        ILE  38   0.829  -5.521  -3.155
  313    HA   ILE  38           HA       ILE  38   2.513  -7.257  -1.764
  314    HB   ILE  38           HB       ILE  38   0.369  -8.294  -3.593
  315   HG12  ILE  38          HG12      ILE  38  -0.083  -6.675  -1.093
  316   HG13  ILE  38          HG13      ILE  38  -0.764  -6.421  -2.682
  317   HG21  ILE  38          HG21      ILE  38   1.366  -9.060  -0.870
  318   HG22  ILE  38          HG22      ILE  38   1.535  -9.957  -2.376
  319   HG23  ILE  38          HG23      ILE  38  -0.051  -9.781  -1.626
  320   HD11  ILE  38          HD11      ILE  38  -2.288  -8.147  -2.447
  321   HD12  ILE  38          HD12      ILE  38  -2.253  -7.410  -0.839
  322   HD13  ILE  38          HD13      ILE  38  -1.374  -8.906  -1.148
  323    H    SER  39           H        SER  39   1.918  -6.595  -5.094
  324    HA   SER  39           HA       SER  39   3.185  -8.969  -5.973
  325    HB2  SER  39           HB2      SER  39   1.316  -8.045  -7.257
  326    HB3  SER  39           HB3      SER  39   2.237  -6.572  -7.551
  327    HG   SER  39           HG       SER  39   3.249  -9.086  -8.333
  328    H    THR  40           H        THR  40   4.035  -5.674  -5.482
  329    HA   THR  40           HA       THR  40   6.510  -5.751  -6.949
  330    HB   THR  40           HB       THR  40   5.393  -3.730  -4.993
  331    HG1  THR  40           HG1      THR  40   4.172  -3.961  -6.918
  332   HG21  THR  40          HG21      THR  40   7.867  -3.612  -5.227
  333   HG22  THR  40          HG22      THR  40   7.030  -2.173  -5.808
  334   HG23  THR  40          HG23      THR  40   7.652  -3.359  -6.961
  335    H    SER  41           H        SER  41   5.485  -5.993  -3.585
  336    HA   SER  41           HA       SER  41   8.099  -5.722  -2.503
  337    HB2  SER  41           HB2      SER  41   5.990  -5.066  -1.371
  338    HB3  SER  41           HB3      SER  41   5.685  -6.775  -1.163
  339    HG   SER  41           HG       SER  41   6.713  -5.692   0.654
  340    H    THR  42           H        THR  42   6.075  -8.467  -3.344
  341    HA   THR  42           HA       THR  42   7.679 -10.326  -1.841
  342    HB   THR  42           HB       THR  42   6.249 -12.061  -2.936
  343    HG1  THR  42           HG1      THR  42   4.451 -10.175  -3.865
  344   HG21  THR  42          HG21      THR  42   4.192 -11.418  -1.764
  345   HG22  THR  42          HG22      THR  42   4.779  -9.760  -1.640
  346   HG23  THR  42          HG23      THR  42   5.619 -11.058  -0.791
  347    H    SER  43           H        SER  43   9.279  -8.924  -3.586
  348    HA   SER  43           HA       SER  43  10.487 -11.104  -5.042
  349    HB2  SER  43           HB2      SER  43   9.681  -8.566  -6.492
  350    HB3  SER  43           HB3      SER  43  10.646  -9.877  -7.170
  351    HG   SER  43           HG       SER  43   8.335 -10.817  -6.123
  352    H    ASP  44           H        ASP  44  11.121  -9.488  -2.722
  353    HA   ASP  44           HA       ASP  44  13.576  -8.203  -3.703
  354    HB2  ASP  44           HB2      ASP  44  11.947  -6.438  -3.197
  355    HB3  ASP  44           HB3      ASP  44  11.747  -7.086  -1.574
  356    HA   PRO  45           HA       PRO  45  14.919 -10.851  -0.252
  357    HB2  PRO  45           HB2      PRO  45  16.919 -12.068  -1.577
  358    HB3  PRO  45           HB3      PRO  45  15.257 -12.621  -1.704
  359    HG2  PRO  45           HG2      PRO  45  16.903 -11.054  -3.592
  360    HG3  PRO  45           HG3      PRO  45  15.677 -12.278  -3.889
  361    HD2  PRO  45           HD2      PRO  45  15.303  -9.513  -4.055
  362    HD3  PRO  45           HD3      PRO  45  14.013 -10.725  -3.975
  363    H    ASP  46           H        ASP  46  17.009 -10.868   0.779
  364    HA   ASP  46           HA       ASP  46  18.289  -9.380   1.994
  365    HB2  ASP  46           HB2      ASP  46  20.560  -9.456   0.914
  366    HB3  ASP  46           HB3      ASP  46  19.772 -10.988   1.200
  367    H    TYR  47           H        TYR  47  19.831  -8.192  -0.919
  368    HA   TYR  47           HA       TYR  47  18.769  -5.528  -0.345
  369    HB2  TYR  47           HB2      TYR  47  21.657  -6.247  -0.701
  370    HB3  TYR  47           HB3      TYR  47  21.039  -4.617  -0.614
  371    HD1  TYR  47           HD1      TYR  47  22.410  -7.290   1.212
  372    HD2  TYR  47           HD2      TYR  47  19.705  -4.028   1.567
  373    HE1  TYR  47           HE1      TYR  47  22.678  -7.342   3.652
  374    HE2  TYR  47           HE2      TYR  47  19.965  -4.073   4.014
  375    HH   TYR  47           HH       TYR  47  22.433  -5.805   5.555
  376    H    ALA  48           H        ALA  48  18.610  -4.164  -2.076
  377    HA   ALA  48           HA       ALA  48  19.800  -4.949  -4.626
  378    HB1  ALA  48           HB1      ALA  48  17.686  -4.360  -5.814
  379    HB2  ALA  48           HB2      ALA  48  16.875  -4.314  -4.248
  380    HB3  ALA  48           HB3      ALA  48  17.579  -5.820  -4.835
  381    H1   SER   0           H1       SER   0   8.015  20.874  -9.290
  382    H2   SER   0           H2       SER   0   6.449  20.994  -8.668
  383    H3   SER   0           H3       SER   0   6.695  20.380 -10.224
  384    HA   SER   0           HA       SER   0   7.808  18.468  -9.371
  385    HB2  SER   0           HB2      SER   0   7.246  19.684  -6.655
  386    HB3  SER   0           HB3      SER   0   7.990  18.113  -6.952
  387    HG   SER   0           HG       SER   0   9.773  19.112  -7.800
  388    H    MET   1           H        MET   1   6.642  16.657  -8.096
  389    HA   MET   1           HA       MET   1   3.733  17.109  -8.201
  390    HB2  MET   1           HB2      MET   1   5.277  14.720  -9.229
  391    HB3  MET   1           HB3      MET   1   3.530  14.743  -9.029
  392    HG2  MET   1           HG2      MET   1   3.347  16.541 -10.647
  393    HG3  MET   1           HG3      MET   1   5.101  16.582 -10.820
  394    HE1  MET   1           HE1      MET   1   3.841  15.090 -14.238
  395    HE2  MET   1           HE2      MET   1   4.752  16.388 -13.467
  396    HE3  MET   1           HE3      MET   1   3.004  16.289 -13.252
  397    H    ASP   2           H        ASP   2   4.489  17.520  -5.875
  398    HA   ASP   2           HA       ASP   2   4.514  16.938  -3.687
  399    HB2  ASP   2           HB2      ASP   2   2.952  14.606  -4.800
  400    HB3  ASP   2           HB3      ASP   2   3.230  14.827  -3.075
  401    H    GLU   3           H        GLU   3   6.797  16.769  -3.766
  402    HA   GLU   3           HA       GLU   3   8.152  14.371  -4.387
  403    HB2  GLU   3           HB2      GLU   3   9.062  16.703  -2.718
  404    HB3  GLU   3           HB3      GLU   3  10.100  15.441  -3.370
  405    HG2  GLU   3           HG2      GLU   3   8.542  17.506  -4.892
  406    HG3  GLU   3           HG3      GLU   3  10.284  17.327  -4.775
  407    H    THR   4           H        THR   4   8.772  12.672  -3.133
  408    HA   THR   4           HA       THR   4   7.436  12.518  -0.540
  409    HB   THR   4           HB       THR   4   7.952  10.029  -0.794
  410    HG1  THR   4           HG1      THR   4   8.035  10.093  -3.480
  411   HG21  THR   4          HG21      THR   4   6.036   9.687  -2.239
  412   HG22  THR   4          HG22      THR   4   6.187  11.322  -2.877
  413   HG23  THR   4          HG23      THR   4   5.741  11.072  -1.191
  414    H    VAL   5           H        VAL   5  10.353  13.410  -1.547
  415    HA   VAL   5           HA       VAL   5  12.233  13.913  -0.375
  416    HB   VAL   5           HB       VAL   5  10.965  12.374   1.898
  417   HG11  VAL   5          HG11      VAL   5  13.354  14.213   1.929
  418   HG12  VAL   5          HG12      VAL   5  13.405  12.460   2.100
  419   HG13  VAL   5          HG13      VAL   5  12.614  13.443   3.331
  420   HG21  VAL   5          HG21      VAL   5  10.512  14.615   2.821
  421   HG22  VAL   5          HG22      VAL   5   9.682  14.338   1.290
  422   HG23  VAL   5          HG23      VAL   5  11.136  15.334   1.336
  423    H    LYS   6           H        LYS   6  14.211  13.063  -0.506
  424    HA   LYS   6           HA       LYS   6  14.408  10.247  -1.195
  425    HB2  LYS   6           HB2      LYS   6  16.376  12.492  -1.403
  426    HB3  LYS   6           HB3      LYS   6  16.709  10.853  -1.913
  427    HG2  LYS   6           HG2      LYS   6  14.963  10.997  -3.560
  428    HG3  LYS   6           HG3      LYS   6  14.529  12.611  -3.011
  429    HD2  LYS   6           HD2      LYS   6  17.218  11.845  -4.144
  430    HD3  LYS   6           HD3      LYS   6  15.925  12.603  -5.064
  431    HE2  LYS   6           HE2      LYS   6  15.975  14.515  -3.531
  432    HE3  LYS   6           HE3      LYS   6  17.302  13.758  -2.663
  433    HZ1  LYS   6           HZ1      LYS   6  18.643  13.877  -4.664
  434    HZ2  LYS   6           HZ2      LYS   6  18.096  15.416  -4.221
  435    HZ3  LYS   6           HZ3      LYS   6  17.362  14.596  -5.506
  436    H    LEU   7           H        LEU   7  16.872   9.497  -0.538
  437    HA   LEU   7           HA       LEU   7  18.035   8.477   1.101
  438    HB2  LEU   7           HB2      LEU   7  17.124  10.829   2.669
  439    HB3  LEU   7           HB3      LEU   7  18.036   9.563   3.419
  440    HG   LEU   7           HG       LEU   7  19.610  11.199   2.937
  441   HD11  LEU   7          HD11      LEU   7  20.254   8.962   2.190
  442   HD12  LEU   7          HD12      LEU   7  21.040  10.241   1.264
  443   HD13  LEU   7          HD13      LEU   7  19.681   9.356   0.572
  444   HD21  LEU   7          HD21      LEU   7  18.215  12.615   1.562
  445   HD22  LEU   7          HD22      LEU   7  18.347  11.477   0.221
  446   HD23  LEU   7          HD23      LEU   7  19.776  12.345   0.785
  447    H    ASN   8           H        ASN   8  15.397   9.698   3.125
  448    HA   ASN   8           HA       ASN   8  14.348   6.941   3.231
  449    HB2  ASN   8           HB2      ASN   8  13.975   9.139   5.283
  450    HB3  ASN   8           HB3      ASN   8  13.232   7.563   5.349
  451   HD21  ASN   8          HD21      ASN   8  14.126   7.101   7.312
  452   HD22  ASN   8          HD22      ASN   8  15.804   6.737   7.518
  453    H    HIS   9           H        HIS   9  12.866   6.969   1.626
  454    HA   HIS   9           HA       HIS   9  11.228   9.141   0.940
  455    HB2  HIS   9           HB2      HIS   9  10.973   6.174   0.509
  456    HB3  HIS   9           HB3      HIS   9   9.704   7.283  -0.003
  457    HD1  HIS   9           HD1      HIS   9  13.034   6.004  -0.956
  458    HD2  HIS   9           HD2      HIS   9  10.496   9.105  -2.059
  459    HE1  HIS   9           HE1      HIS   9  13.908   6.845  -3.155
  460    HE2  HIS   9           HE2      HIS   9  12.393   8.755  -3.777
  461    H    THR  10           H        THR  10   9.520   9.988   1.892
  462    HA   THR  10           HA       THR  10   8.738   9.031   4.465
  463    HB   THR  10           HB       THR  10   7.417  11.152   2.746
  464    HG1  THR  10           HG1      THR  10   9.835  11.212   3.541
  465   HG21  THR  10          HG21      THR  10   6.642  12.070   4.883
  466   HG22  THR  10          HG22      THR  10   7.382  10.713   5.735
  467   HG23  THR  10          HG23      THR  10   6.036  10.434   4.631
  468    H    CYS  11           H        CYS  11   7.045   7.838   5.062
  469    HA   CYS  11           HA       CYS  11   5.831   6.186   3.128
  470    HB2  CYS  11           HB2      CYS  11   6.262   5.552   5.500
  471    HB3  CYS  11           HB3      CYS  11   4.957   6.619   5.965
  472    H    VAL  12           H        VAL  12   4.307   6.590   1.858
  473    HA   VAL  12           HA       VAL  12   2.474   8.564   1.712
  474    HB   VAL  12           HB       VAL  12   3.134   6.276   0.403
  475   HG11  VAL  12          HG11      VAL  12   1.759   4.801   1.588
  476   HG12  VAL  12          HG12      VAL  12   1.026   5.050   0.006
  477   HG13  VAL  12          HG13      VAL  12   0.364   5.861   1.425
  478   HG21  VAL  12          HG21      VAL  12   0.945   8.213  -0.050
  479   HG22  VAL  12          HG22      VAL  12   1.327   6.933  -1.197
  480   HG23  VAL  12          HG23      VAL  12   2.550   8.132  -0.772
  481    H    ILE  13           H        ILE  13   2.525   5.929   3.975
  482    HA   ILE  13           HA       ILE  13  -0.313   6.257   4.594
  483    HB   ILE  13           HB       ILE  13   1.563   4.230   5.768
  484   HG12  ILE  13          HG12      ILE  13   1.500   4.054   3.295
  485   HG13  ILE  13          HG13      ILE  13   0.818   2.658   4.103
  486   HG21  ILE  13          HG21      ILE  13  -0.489   4.595   7.003
  487   HG22  ILE  13          HG22      ILE  13  -0.503   3.008   6.235
  488   HG23  ILE  13          HG23      ILE  13  -1.431   4.336   5.535
  489   HD11  ILE  13          HD11      ILE  13  -0.442   3.427   2.155
  490   HD12  ILE  13          HD12      ILE  13  -0.793   4.917   3.027
  491   HD13  ILE  13          HD13      ILE  13  -1.376   3.375   3.648
  492    H    CYS  14           H        CYS  14   2.731   5.896   6.466
  493    HA   CYS  14           HA       CYS  14   1.298   7.060   8.680
  494    HB2  CYS  14           HB2      CYS  14   3.047   6.078  10.101
  495    HB3  CYS  14           HB3      CYS  14   2.184   4.894   9.151
  496    H    ASP  15           H        ASP  15   3.164   8.202   6.334
  497    HA   ASP  15           HA       ASP  15   4.161  10.217   5.991
  498    HB2  ASP  15           HB2      ASP  15   2.112  10.869   7.268
  499    HB3  ASP  15           HB3      ASP  15   3.109  10.959   8.704
  500    H    GLN  16           H        GLN  16   5.523   8.100   7.426
  501    HA   GLN  16           HA       GLN  16   7.529   9.607   8.921
  502    HB2  GLN  16           HB2      GLN  16   7.056   6.634   8.817
  503    HB3  GLN  16           HB3      GLN  16   8.231   7.456   9.836
  504    HG2  GLN  16           HG2      GLN  16   5.239   7.694   9.988
  505    HG3  GLN  16           HG3      GLN  16   6.285   6.848  11.116
  506   HE21  GLN  16          HE21      GLN  16   4.413   9.006  11.558
  507   HE22  GLN  16          HE22      GLN  16   5.327  10.272  12.293
  508    H    GLU  17           H        GLU  17   9.581   9.632   8.292
  509    HA   GLU  17           HA       GLU  17  10.238   9.091   5.584
  510    HB2  GLU  17           HB2      GLU  17  11.912  10.086   7.887
  511    HB3  GLU  17           HB3      GLU  17  12.481   9.964   6.231
  512    HG2  GLU  17           HG2      GLU  17  11.028  11.624   5.492
  513    HG3  GLU  17           HG3      GLU  17  10.051  11.547   6.951
  514    H    LYS  18           H        LYS  18  10.483   7.105   5.021
  515    HA   LYS  18           HA       LYS  18  12.069   5.266   6.687
  516    HB2  LYS  18           HB2      LYS  18  10.004   4.267   4.845
  517    HB3  LYS  18           HB3      LYS  18  10.652   3.509   6.263
  518    HG2  LYS  18           HG2      LYS  18   8.663   5.745   6.151
  519    HG3  LYS  18           HG3      LYS  18   8.383   4.090   6.682
  520    HD2  LYS  18           HD2      LYS  18  10.407   5.775   8.050
  521    HD3  LYS  18           HD3      LYS  18   8.721   5.976   8.408
  522    HE2  LYS  18           HE2      LYS  18   9.750   4.507  10.012
  523    HE3  LYS  18           HE3      LYS  18   8.583   3.659   9.029
  524    HZ1  LYS  18           HZ1      LYS  18  10.672   2.421   9.432
  525    HZ2  LYS  18           HZ2      LYS  18  11.494   3.587   8.525
  526    HZ3  LYS  18           HZ3      LYS  18  10.308   2.627   7.795
  527    H    ASN  19           H        ASN  19  13.619   4.048   5.674
  528    HA   ASN  19           HA       ASN  19  13.945   4.590   2.812
  529    HB2  ASN  19           HB2      ASN  19  16.261   3.979   3.061
  530    HB3  ASN  19           HB3      ASN  19  15.847   5.133   4.317
  531   HD21  ASN  19          HD21      ASN  19  16.808   1.888   3.609
  532   HD22  ASN  19          HD22      ASN  19  17.086   1.396   5.274
  533    H    ARG  20           H        ARG  20  12.721   2.291   4.841
  534    HA   ARG  20           HA       ARG  20  13.187   0.171   2.865
  535    HB2  ARG  20           HB2      ARG  20  12.811  -0.026   5.836
  536    HB3  ARG  20           HB3      ARG  20  12.673  -1.414   4.791
  537    HG2  ARG  20           HG2      ARG  20  14.942  -1.032   4.009
  538    HG3  ARG  20           HG3      ARG  20  15.084   0.292   5.151
  539    HD2  ARG  20           HD2      ARG  20  14.560  -1.228   6.909
  540    HD3  ARG  20           HD3      ARG  20  14.429  -2.552   5.794
  541    HE   ARG  20           HE       ARG  20  16.969  -1.099   6.006
  542   HH11  ARG  20          HH11      ARG  20  15.131  -4.044   6.475
  543   HH12  ARG  20          HH12      ARG  20  16.539  -5.048   6.598
  544   HH21  ARG  20          HH21      ARG  20  18.814  -2.425   6.177
  545   HH22  ARG  20          HH22      ARG  20  18.630  -4.132   6.431
  546    H    GLY  21           H        GLY  21  11.510  -0.656   1.878
  547    HA2  GLY  21           HA2      GLY  21   8.947  -1.121   2.434
  548    HA3  GLY  21           HA3      GLY  21   8.942   0.634   2.259
  549    H    ILE  22           H        ILE  22   7.497   0.153   0.309
  550    HA   ILE  22           HA       ILE  22   9.267  -0.447  -1.945
  551    HB   ILE  22           HB       ILE  22   7.656  -1.671  -3.017
  552   HG12  ILE  22          HG12      ILE  22   5.601  -0.240  -1.369
  553   HG13  ILE  22          HG13      ILE  22   6.023   0.123  -3.005
  554   HG21  ILE  22          HG21      ILE  22   6.386  -3.074  -1.348
  555   HG22  ILE  22          HG22      ILE  22   7.050  -2.034  -0.087
  556   HG23  ILE  22          HG23      ILE  22   8.130  -2.990  -1.102
  557   HD11  ILE  22          HD11      ILE  22   3.971  -1.127  -2.931
  558   HD12  ILE  22          HD12      ILE  22   4.772  -2.411  -2.029
  559   HD13  ILE  22          HD13      ILE  22   5.241  -2.082  -3.700
  560    H    HIS  23           H        HIS  23   7.905   0.368  -3.954
  561    HA   HIS  23           HA       HIS  23   6.746   2.944  -3.600
  562    HB2  HIS  23           HB2      HIS  23   8.492   4.231  -4.786
  563    HB3  HIS  23           HB3      HIS  23   9.053   3.625  -3.251
  564    HD1  HIS  23           HD1      HIS  23  10.040   3.950  -6.684
  565    HD2  HIS  23           HD2      HIS  23  10.685   1.231  -3.639
  566    HE1  HIS  23           HE1      HIS  23  12.102   2.673  -7.357
  567    HE2  HIS  23           HE2      HIS  23  12.512   1.059  -5.466
  568    H    LEU  24           H        LEU  24   5.193   2.932  -5.068
  569    HA   LEU  24           HA       LEU  24   5.355   1.024  -7.223
  570    HB2  LEU  24           HB2      LEU  24   3.161   2.806  -6.200
  571    HB3  LEU  24           HB3      LEU  24   2.981   1.692  -7.507
  572    HG   LEU  24           HG       LEU  24   3.646   0.884  -4.689
  573   HD11  LEU  24          HD11      LEU  24   1.370   1.732  -4.866
  574   HD12  LEU  24          HD12      LEU  24   1.368  -0.015  -4.639
  575   HD13  LEU  24          HD13      LEU  24   1.068   0.667  -6.236
  576   HD21  LEU  24          HD21      LEU  24   2.970  -0.758  -7.125
  577   HD22  LEU  24          HD22      LEU  24   3.198  -1.386  -5.493
  578   HD23  LEU  24          HD23      LEU  24   4.553  -0.651  -6.351
  579    H    TYR  25           H        TYR  25   4.176   4.323  -6.932
  580    HA   TYR  25           HA       TYR  25   4.937   4.796  -9.682
  581    HB2  TYR  25           HB2      TYR  25   3.165   6.348  -7.845
  582    HB3  TYR  25           HB3      TYR  25   3.549   6.858  -9.477
  583    HD1  TYR  25           HD1      TYR  25   3.055   3.315  -8.727
  584    HD2  TYR  25           HD2      TYR  25   1.169   6.867 -10.091
  585    HE1  TYR  25           HE1      TYR  25   1.173   1.981  -9.538
  586    HE2  TYR  25           HE2      TYR  25  -0.726   5.542 -10.920
  587    HH   TYR  25           HH       TYR  25  -1.152   3.190 -11.648
  588    H    THR  26           H        THR  26   4.666   7.623  -7.840
  589    HA   THR  26           HA       THR  26   7.584   7.737  -7.553
  590    HB   THR  26           HB       THR  26   6.573   9.540  -8.911
  591    HG1  THR  26           HG1      THR  26   7.535  10.604  -6.452
  592   HG21  THR  26          HG21      THR  26   5.223  10.371  -6.345
  593   HG22  THR  26          HG22      THR  26   4.415   9.654  -7.737
  594   HG23  THR  26          HG23      THR  26   5.178  11.238  -7.881
  595    H    LYS  27           H        LYS  27   5.115   6.721  -5.789
  596    HA   LYS  27           HA       LYS  27   5.897   8.160  -3.349
  597    HB2  LYS  27           HB2      LYS  27   3.719   6.906  -2.510
  598    HB3  LYS  27           HB3      LYS  27   3.660   8.463  -3.319
  599    HG2  LYS  27           HG2      LYS  27   3.425   5.904  -4.853
  600    HG3  LYS  27           HG3      LYS  27   2.028   6.640  -4.057
  601    HD2  LYS  27           HD2      LYS  27   3.788   7.857  -6.173
  602    HD3  LYS  27           HD3      LYS  27   2.094   7.431  -6.316
  603    HE2  LYS  27           HE2      LYS  27   2.147   9.080  -4.112
  604    HE3  LYS  27           HE3      LYS  27   3.351   9.794  -5.174
  605    HZ1  LYS  27           HZ1      LYS  27   1.815  10.310  -6.764
  606    HZ2  LYS  27           HZ2      LYS  27   0.880  10.511  -5.369
  607    HZ3  LYS  27           HZ3      LYS  27   0.728   9.101  -6.293
  608    H    PHE  28           H        PHE  28   5.075   6.636  -1.419
  609    HA   PHE  28           HA       PHE  28   6.610   4.166  -1.602
  610    HB2  PHE  28           HB2      PHE  28   8.260   5.854  -1.194
  611    HB3  PHE  28           HB3      PHE  28   7.279   6.592   0.057
  612    HD1  PHE  28           HD1      PHE  28   9.340   3.617  -0.723
  613    HD2  PHE  28           HD2      PHE  28   7.306   5.836   2.269
  614    HE1  PHE  28           HE1      PHE  28  10.393   2.235   1.024
  615    HE2  PHE  28           HE2      PHE  28   8.330   4.463   4.012
  616    HZ   PHE  28           HZ       PHE  28   9.874   2.645   3.414
  617    H    ILE  29           H        ILE  29   5.183   2.742  -0.716
  618    HA   ILE  29           HA       ILE  29   3.914   3.472   1.818
  619    HB   ILE  29           HB       ILE  29   3.899   0.771   0.430
  620   HG12  ILE  29          HG12      ILE  29   1.383   1.399   0.167
  621   HG13  ILE  29          HG13      ILE  29   1.950   3.056   0.338
  622   HG21  ILE  29          HG21      ILE  29   2.134   0.208   2.029
  623   HG22  ILE  29          HG22      ILE  29   2.327   1.786   2.791
  624   HG23  ILE  29          HG23      ILE  29   3.652   0.617   2.838
  625   HD11  ILE  29          HD11      ILE  29   3.244   2.917  -1.620
  626   HD12  ILE  29          HD12      ILE  29   1.684   2.188  -2.013
  627   HD13  ILE  29          HD13      ILE  29   3.080   1.162  -1.692
  628    H    CYS  30           H        CYS  30   5.113   3.171   3.670
  629    HA   CYS  30           HA       CYS  30   7.642   1.888   3.508
  630    HB2  CYS  30           HB2      CYS  30   8.005   2.413   5.713
  631    HB3  CYS  30           HB3      CYS  30   6.811   3.625   5.280
  632    H    LEU  31           H        LEU  31   8.299   0.083   4.705
  633    HA   LEU  31           HA       LEU  31   7.139  -2.145   3.654
  634    HB2  LEU  31           HB2      LEU  31   8.884  -3.277   4.610
  635    HB3  LEU  31           HB3      LEU  31   9.506  -1.669   4.470
  636    HG   LEU  31           HG       LEU  31   8.602  -1.514   6.978
  637   HD11  LEU  31          HD11      LEU  31   7.736  -3.795   7.032
  638   HD12  LEU  31          HD12      LEU  31   9.055  -3.585   8.182
  639   HD13  LEU  31          HD13      LEU  31   9.342  -4.419   6.656
  640   HD21  LEU  31          HD21      LEU  31  11.218  -2.754   6.148
  641   HD22  LEU  31          HD22      LEU  31  10.878  -2.030   7.719
  642   HD23  LEU  31          HD23      LEU  31  10.869  -1.030   6.265
  643    H    ASP  32           H        ASP  32   6.366  -0.591   6.590
  644    HA   ASP  32           HA       ASP  32   5.361  -2.958   7.917
  645    HB2  ASP  32           HB2      ASP  32   6.402  -0.853   9.014
  646    HB3  ASP  32           HB3      ASP  32   4.812  -0.169   8.772
  647    H    CYS  33           H        CYS  33   4.233  -0.086   6.406
  648    HA   CYS  33           HA       CYS  33   1.467  -0.624   6.679
  649    HB2  CYS  33           HB2      CYS  33   2.866   1.372   4.909
  650    HB3  CYS  33           HB3      CYS  33   1.151   1.239   5.147
  651    H    GLU  34           H        GLU  34   3.926  -1.146   4.333
  652    HA   GLU  34           HA       GLU  34   2.377  -1.869   2.162
  653    HB2  GLU  34           HB2      GLU  34   4.823  -1.431   2.124
  654    HB3  GLU  34           HB3      GLU  34   5.088  -2.962   2.905
  655    HG2  GLU  34           HG2      GLU  34   3.638  -2.870   0.339
  656    HG3  GLU  34           HG3      GLU  34   5.376  -2.760   0.365
  657    H    ARG  35           H        ARG  35   3.562  -3.804   4.849
  658    HA   ARG  35           HA       ARG  35   2.124  -6.099   3.908
  659    HB2  ARG  35           HB2      ARG  35   2.643  -7.156   6.077
  660    HB3  ARG  35           HB3      ARG  35   4.072  -6.516   5.283
  661    HG2  ARG  35           HG2      ARG  35   3.978  -4.550   6.748
  662    HG3  ARG  35           HG3      ARG  35   2.595  -5.258   7.562
  663    HD2  ARG  35           HD2      ARG  35   3.919  -7.154   8.246
  664    HD3  ARG  35           HD3      ARG  35   5.297  -6.491   7.386
  665    HE   ARG  35           HE       ARG  35   4.462  -4.548   9.170
  666   HH11  ARG  35          HH11      ARG  35   5.720  -7.804   9.318
  667   HH12  ARG  35          HH12      ARG  35   6.535  -7.556  10.829
  668   HH21  ARG  35          HH21      ARG  35   5.542  -4.204  11.150
  669   HH22  ARG  35          HH22      ARG  35   6.421  -5.520  11.877
  670    H    LYS  36           H        LYS  36   1.293  -3.366   5.774
  671    HA   LYS  36           HA       LYS  36  -0.774  -4.405   7.361
  672    HB2  LYS  36           HB2      LYS  36  -0.435  -1.672   6.228
  673    HB3  LYS  36           HB3      LYS  36  -1.656  -2.094   7.395
  674    HG2  LYS  36           HG2      LYS  36   0.218  -2.682   8.935
  675    HG3  LYS  36           HG3      LYS  36   1.313  -2.022   7.784
  676    HD2  LYS  36           HD2      LYS  36   0.255   0.055   7.989
  677    HD3  LYS  36           HD3      LYS  36  -0.985  -0.571   9.035
  678    HE2  LYS  36           HE2      LYS  36   1.959  -0.514   9.663
  679    HE3  LYS  36           HE3      LYS  36   0.793   0.677  10.220
  680    HZ1  LYS  36           HZ1      LYS  36   1.220  -0.995  11.905
  681    HZ2  LYS  36           HZ2      LYS  36   0.724  -2.218  10.850
  682    HZ3  LYS  36           HZ3      LYS  36  -0.390  -1.069  11.392
  683    H    VAL  37           H        VAL  37  -0.529  -3.081   4.185
  684    HA   VAL  37           HA       VAL  37  -3.198  -2.851   3.575
  685    HB   VAL  37           HB       VAL  37  -2.560  -2.893   1.232
  686   HG11  VAL  37          HG11      VAL  37  -1.176  -0.948   1.207
  687   HG12  VAL  37          HG12      VAL  37  -0.475  -1.365   2.771
  688   HG13  VAL  37          HG13      VAL  37  -2.164  -0.856   2.666
  689   HG21  VAL  37          HG21      VAL  37  -0.014  -3.978   2.289
  690   HG22  VAL  37          HG22      VAL  37  -0.029  -3.025   0.804
  691   HG23  VAL  37          HG23      VAL  37  -0.986  -4.503   0.908
  692    H    ILE  38           H        ILE  38  -1.011  -5.490   2.930
  693    HA   ILE  38           HA       ILE  38  -2.724  -7.199   1.545
  694    HB   ILE  38           HB       ILE  38  -0.600  -8.267   3.377
  695   HG12  ILE  38          HG12      ILE  38  -0.118  -6.666   0.872
  696   HG13  ILE  38          HG13      ILE  38   0.565  -6.418   2.461
  697   HG21  ILE  38          HG21      ILE  38  -1.612  -9.025   0.658
  698   HG22  ILE  38          HG22      ILE  38  -1.797  -9.913   2.166
  699   HG23  ILE  38          HG23      ILE  38  -0.207  -9.769   1.415
  700   HD11  ILE  38          HD11      ILE  38   2.060  -8.170   2.232
  701   HD12  ILE  38          HD12      ILE  38   2.036  -7.441   0.621
  702   HD13  ILE  38          HD13      ILE  38   1.132  -8.920   0.938
  703    H    SER  39           H        SER  39  -2.119  -6.537   4.874
  704    HA   SER  39           HA       SER  39  -3.427  -8.887   5.762
  705    HB2  SER  39           HB2      SER  39  -1.540  -7.987   7.037
  706    HB3  SER  39           HB3      SER  39  -2.438  -6.501   7.333
  707    HG   SER  39           HG       SER  39  -3.529  -8.974   8.116
  708    H    THR  40           H        THR  40  -4.219  -5.579   5.256
  709    HA   THR  40           HA       THR  40  -6.695  -5.607   6.722
  710    HB   THR  40           HB       THR  40  -5.540  -3.609   4.764
  711    HG1  THR  40           HG1      THR  40  -4.322  -3.846   6.689
  712   HG21  THR  40          HG21      THR  40  -8.013  -3.448   4.994
  713   HG22  THR  40          HG22      THR  40  -7.151  -2.023   5.574
  714   HG23  THR  40          HG23      THR  40  -7.794  -3.195   6.728
  715    H    SER  41           H        SER  41  -5.673  -5.875   3.360
  716    HA   SER  41           HA       SER  41  -8.281  -5.562   2.278
  717    HB2  SER  41           HB2      SER  41  -6.165  -4.948   1.140
  718    HB3  SER  41           HB3      SER  41  -5.884  -6.662   0.945
  719    HG   SER  41           HG       SER  41  -6.896  -5.560  -0.878
  720    H    THR  42           H        THR  42  -6.307  -8.340   3.129
  721    HA   THR  42           HA       THR  42  -7.947 -10.174   1.634
  722    HB   THR  42           HB       THR  42  -6.546 -11.934   2.731
  723    HG1  THR  42           HG1      THR  42  -4.721 -10.063   3.649
  724   HG21  THR  42          HG21      THR  42  -4.481 -11.332   1.555
  725   HG22  THR  42          HG22      THR  42  -5.037  -9.664   1.425
  726   HG23  THR  42          HG23      THR  42  -5.899 -10.950   0.581
  727    H    SER  43           H        SER  43  -9.515  -8.736   3.381
  728    HA   SER  43           HA       SER  43 -10.767 -10.891   4.839
  729    HB2  SER  43           HB2      SER  43  -9.910  -8.366   6.281
  730    HB3  SER  43           HB3      SER  43 -10.899  -9.654   6.964
  731    HG   SER  43           HG       SER  43  -8.609 -10.644   5.915
  732    H    ASP  44           H        ASP  44 -11.372  -9.275   2.513
  733    HA   ASP  44           HA       ASP  44 -13.805  -7.942   3.486
  734    HB2  ASP  44           HB2      ASP  44 -12.151  -6.201   2.977
  735    HB3  ASP  44           HB3      ASP  44 -11.961  -6.856   1.354
  736    HA   PRO  45           HA       PRO  45 -15.191 -10.588   0.047
  737    HB2  PRO  45           HB2      PRO  45 -17.230 -11.739   1.373
  738    HB3  PRO  45           HB3      PRO  45 -15.600 -12.320   1.523
  739    HG2  PRO  45           HG2      PRO  45 -17.145 -10.768   3.369
  740    HG3  PRO  45           HG3      PRO  45 -15.944 -11.981   3.710
  741    HD2  PRO  45           HD2      PRO  45 -15.565  -9.214   3.835
  742    HD3  PRO  45           HD3      PRO  45 -14.293 -10.438   3.768
  743    H    ASP  46           H        ASP  46 -17.278 -10.549  -1.010
  744    HA   ASP  46           HA       ASP  46 -18.539  -9.048  -2.209
  745    HB2  ASP  46           HB2      ASP  46 -20.807  -9.081  -1.129
  746    HB3  ASP  46           HB3      ASP  46 -20.046 -10.630  -1.404
  747    H    TYR  47           H        TYR  47 -20.053  -7.824   0.700
  748    HA   TYR  47           HA       TYR  47 -18.945  -5.180   0.119
  749    HB2  TYR  47           HB2      TYR  47 -21.847  -5.849   0.477
  750    HB3  TYR  47           HB3      TYR  47 -21.200  -4.229   0.383
  751    HD1  TYR  47           HD1      TYR  47 -22.619  -6.887  -1.434
  752    HD2  TYR  47           HD2      TYR  47 -19.854  -3.675  -1.801
  753    HE1  TYR  47           HE1      TYR  47 -22.885  -6.945  -3.874
  754    HE2  TYR  47           HE2      TYR  47 -20.113  -3.725  -4.246
  755    HH   TYR  47           HH       TYR  47 -22.612  -5.402  -5.783
  756    H    ALA  48           H        ALA  48 -18.760  -3.819   1.849
  757    HA   ALA  48           HA       ALA  48 -19.968  -4.574   4.399
  758    HB1  ALA  48           HB1      ALA  48 -17.845  -4.015   5.583
  759    HB2  ALA  48           HB2      ALA  48 -17.034  -3.990   4.017
  760    HB3  ALA  48           HB3      ALA  48 -17.761  -5.481   4.610
  Start of MODEL    8
    1    H1   SER   0           H1       SER   0   5.011  19.814  -2.631
    2    H2   SER   0           H2       SER   0   4.113  18.708  -1.724
    3    H3   SER   0           H3       SER   0   4.950  19.963  -0.948
    4    HA   SER   0           HA       SER   0   2.568  20.386  -1.082
    5    HB2  SER   0           HB2      SER   0   2.843  22.658  -2.224
    6    HB3  SER   0           HB3      SER   0   3.948  22.306  -0.897
    7    HG   SER   0           HG       SER   0   5.037  23.166  -2.708
    8    H    MET   1           H        MET   1   1.150  21.726  -2.820
    9    HA   MET   1           HA       MET   1  -0.063  21.773  -4.735
   10    HB2  MET   1           HB2      MET   1   2.116  20.019  -5.868
   11    HB3  MET   1           HB3      MET   1   0.784  20.682  -6.801
   12    HG2  MET   1           HG2      MET   1   1.552  22.933  -6.346
   13    HG3  MET   1           HG3      MET   1   2.855  22.303  -5.340
   14    HE1  MET   1           HE1      MET   1   4.822  20.799  -6.269
   15    HE2  MET   1           HE2      MET   1   5.062  20.418  -7.973
   16    HE3  MET   1           HE3      MET   1   3.713  19.704  -7.091
   17    H    ASP   2           H        ASP   2   1.232  18.529  -4.123
   18    HA   ASP   2           HA       ASP   2  -0.928  17.088  -5.185
   19    HB2  ASP   2           HB2      ASP   2   1.242  16.061  -4.734
   20    HB3  ASP   2           HB3      ASP   2   1.019  16.310  -3.006
   21    H    GLU   3           H        GLU   3  -2.960  17.183  -4.541
   22    HA   GLU   3           HA       GLU   3  -3.529  16.982  -1.674
   23    HB2  GLU   3           HB2      GLU   3  -3.810  19.341  -2.352
   24    HB3  GLU   3           HB3      GLU   3  -4.959  18.837  -3.583
   25    HG2  GLU   3           HG2      GLU   3  -6.519  18.113  -1.942
   26    HG3  GLU   3           HG3      GLU   3  -5.339  18.326  -0.649
   27    H    THR   4           H        THR   4  -5.020  15.473  -1.211
   28    HA   THR   4           HA       THR   4  -6.419  14.240  -3.488
   29    HB   THR   4           HB       THR   4  -6.077  12.055  -2.185
   30    HG1  THR   4           HG1      THR   4  -3.866  13.445  -1.077
   31   HG21  THR   4          HG21      THR   4  -3.837  11.703  -3.140
   32   HG22  THR   4          HG22      THR   4  -3.679  13.442  -3.394
   33   HG23  THR   4          HG23      THR   4  -4.905  12.529  -4.275
   34    H    VAL   5           H        VAL   5  -7.966  12.457  -2.450
   35    HA   VAL   5           HA       VAL   5  -9.615  11.779  -1.057
   36    HB   VAL   5           HB       VAL   5  -8.945  14.180   0.648
   37   HG11  VAL   5          HG11      VAL   5 -11.287  13.540   0.912
   38   HG12  VAL   5          HG12      VAL   5 -10.354  13.135   2.352
   39   HG13  VAL   5          HG13      VAL   5 -10.804  11.870   1.209
   40   HG21  VAL   5          HG21      VAL   5  -8.349  11.243   1.003
   41   HG22  VAL   5          HG22      VAL   5  -7.977  12.516   2.165
   42   HG23  VAL   5          HG23      VAL   5  -7.180  12.498   0.592
   43    H    LYS   6           H        LYS   6 -11.117  11.982  -2.580
   44    HA   LYS   6           HA       LYS   6 -12.882  14.323  -2.361
   45    HB2  LYS   6           HB2      LYS   6 -12.262  12.589  -4.721
   46    HB3  LYS   6           HB3      LYS   6 -13.727  13.537  -4.661
   47    HG2  LYS   6           HG2      LYS   6 -12.229  14.806  -5.918
   48    HG3  LYS   6           HG3      LYS   6 -12.207  15.536  -4.319
   49    HD2  LYS   6           HD2      LYS   6 -10.117  14.542  -3.798
   50    HD3  LYS   6           HD3      LYS   6 -10.184  13.501  -5.216
   51    HE2  LYS   6           HE2      LYS   6  -8.636  15.327  -5.578
   52    HE3  LYS   6           HE3      LYS   6 -10.024  15.472  -6.645
   53    HZ1  LYS   6           HZ1      LYS   6 -10.953  17.140  -5.170
   54    HZ2  LYS   6           HZ2      LYS   6  -9.410  17.600  -5.686
   55    HZ3  LYS   6           HZ3      LYS   6  -9.630  16.988  -4.128
   56    H    LEU   7           H        LEU   7 -15.098  13.091  -3.684
   57    HA   LEU   7           HA       LEU   7 -16.366  11.642  -1.679
   58    HB2  LEU   7           HB2      LEU   7 -17.577  12.723  -3.482
   59    HB3  LEU   7           HB3      LEU   7 -16.871  11.619  -4.617
   60    HG   LEU   7           HG       LEU   7 -18.048   9.747  -3.451
   61   HD11  LEU   7          HD11      LEU   7 -18.388  10.836  -1.330
   62   HD12  LEU   7          HD12      LEU   7 -19.942  10.383  -2.030
   63   HD13  LEU   7          HD13      LEU   7 -19.397  12.059  -2.094
   64   HD21  LEU   7          HD21      LEU   7 -19.745  11.941  -4.639
   65   HD22  LEU   7          HD22      LEU   7 -20.222  10.252  -4.462
   66   HD23  LEU   7          HD23      LEU   7 -18.891  10.685  -5.536
   67    H    ASN   8           H        ASN   8 -15.376  10.274  -4.796
   68    HA   ASN   8           HA       ASN   8 -14.845   7.628  -3.841
   69    HB2  ASN   8           HB2      ASN   8 -13.961   9.217  -6.247
   70    HB3  ASN   8           HB3      ASN   8 -13.377   7.594  -5.967
   71   HD21  ASN   8          HD21      ASN   8 -14.308   6.885  -7.861
   72   HD22  ASN   8          HD22      ASN   8 -16.012   6.655  -8.023
   73    H    HIS   9           H        HIS   9 -13.274   7.161  -2.418
   74    HA   HIS   9           HA       HIS   9 -11.422   8.968  -1.426
   75    HB2  HIS   9           HB2      HIS   9 -10.884   6.014  -1.583
   76    HB3  HIS   9           HB3      HIS   9 -10.265   7.146  -0.401
   77    HD1  HIS   9           HD1      HIS   9 -12.274   8.247   1.170
   78    HD2  HIS   9           HD2      HIS   9 -13.032   4.618  -0.713
   79    HE1  HIS   9           HE1      HIS   9 -14.176   7.211   2.440
   80    HE2  HIS   9           HE2      HIS   9 -14.695   5.073   1.213
   81    H    THR  10           H        THR  10  -9.640   9.805  -2.233
   82    HA   THR  10           HA       THR  10  -8.800   8.976  -4.861
   83    HB   THR  10           HB       THR  10  -7.489  11.087  -3.152
   84    HG1  THR  10           HG1      THR  10  -9.899  11.163  -4.649
   85   HG21  THR  10          HG21      THR  10  -6.961  12.099  -5.331
   86   HG22  THR  10          HG22      THR  10  -7.758  10.751  -6.142
   87   HG23  THR  10          HG23      THR  10  -6.297  10.472  -5.194
   88    H    CYS  11           H        CYS  11  -7.059   7.843  -5.358
   89    HA   CYS  11           HA       CYS  11  -5.874   6.263  -3.346
   90    HB2  CYS  11           HB2      CYS  11  -6.233   5.630  -5.730
   91    HB3  CYS  11           HB3      CYS  11  -4.900   6.688  -6.142
   92    H    VAL  12           H        VAL  12  -4.362   6.734  -2.013
   93    HA   VAL  12           HA       VAL  12  -2.548   8.741  -1.953
   94    HB   VAL  12           HB       VAL  12  -3.234   6.685  -0.408
   95   HG11  VAL  12          HG11      VAL  12  -2.054   4.952  -1.508
   96   HG12  VAL  12          HG12      VAL  12  -1.337   5.256   0.078
   97   HG13  VAL  12          HG13      VAL  12  -0.545   5.854  -1.387
   98   HG21  VAL  12          HG21      VAL  12  -1.282   7.271   0.998
   99   HG22  VAL  12          HG22      VAL  12  -2.406   8.539   0.514
  100   HG23  VAL  12          HG23      VAL  12  -0.850   8.383  -0.298
  101    H    ILE  13           H        ILE  13  -2.657   6.200  -4.220
  102    HA   ILE  13           HA       ILE  13   0.210   6.356  -4.730
  103    HB   ILE  13           HB       ILE  13  -1.717   4.366  -5.830
  104   HG12  ILE  13          HG12      ILE  13  -1.577   4.411  -3.303
  105   HG13  ILE  13          HG13      ILE  13  -1.165   2.899  -4.081
  106   HG21  ILE  13          HG21      ILE  13   0.282   3.083  -6.263
  107   HG22  ILE  13          HG22      ILE  13   1.267   4.355  -5.548
  108   HG23  ILE  13          HG23      ILE  13   0.375   4.663  -7.038
  109   HD11  ILE  13          HD11      ILE  13   0.847   4.929  -3.219
  110   HD12  ILE  13          HD12      ILE  13   1.142   3.282  -3.799
  111   HD13  ILE  13          HD13      ILE  13   0.340   3.546  -2.246
  112    H    CYS  14           H        CYS  14  -2.731   5.907  -6.703
  113    HA   CYS  14           HA       CYS  14  -1.266   6.988  -8.934
  114    HB2  CYS  14           HB2      CYS  14  -3.049   5.974 -10.313
  115    HB3  CYS  14           HB3      CYS  14  -2.189   4.819  -9.319
  116    H    ASP  15           H        ASP  15  -3.083   8.294  -6.673
  117    HA   ASP  15           HA       ASP  15  -4.210  10.258  -6.417
  118    HB2  ASP  15           HB2      ASP  15  -2.198  10.999  -7.666
  119    HB3  ASP  15           HB3      ASP  15  -3.143  10.952  -9.138
  120    H    GLN  16           H        GLN  16  -5.497   8.064  -7.714
  121    HA   GLN  16           HA       GLN  16  -7.458   9.392  -9.411
  122    HB2  GLN  16           HB2      GLN  16  -6.883   6.457  -9.042
  123    HB3  GLN  16           HB3      GLN  16  -8.102   7.124 -10.123
  124    HG2  GLN  16           HG2      GLN  16  -5.135   7.584 -10.304
  125    HG3  GLN  16           HG3      GLN  16  -6.077   6.506 -11.323
  126   HE21  GLN  16          HE21      GLN  16  -4.438   8.787 -12.014
  127   HE22  GLN  16          HE22      GLN  16  -5.470   9.863 -12.876
  128    H    GLU  17           H        GLU  17  -9.548   9.375  -8.919
  129    HA   GLU  17           HA       GLU  17 -10.311   9.056  -6.185
  130    HB2  GLU  17           HB2      GLU  17 -11.967   9.836  -8.588
  131    HB3  GLU  17           HB3      GLU  17 -12.465   9.954  -6.916
  132    HG2  GLU  17           HG2      GLU  17 -10.930  11.640  -6.448
  133    HG3  GLU  17           HG3      GLU  17 -10.071  11.376  -7.957
  134    H    LYS  18           H        LYS  18 -10.607   7.112  -5.522
  135    HA   LYS  18           HA       LYS  18 -12.070   5.188  -7.185
  136    HB2  LYS  18           HB2      LYS  18 -10.115   4.276  -5.178
  137    HB3  LYS  18           HB3      LYS  18 -10.666   3.463  -6.609
  138    HG2  LYS  18           HG2      LYS  18  -8.707   5.725  -6.453
  139    HG3  LYS  18           HG3      LYS  18  -8.379   4.059  -6.904
  140    HD2  LYS  18           HD2      LYS  18 -10.290   5.717  -8.457
  141    HD3  LYS  18           HD3      LYS  18  -8.580   5.829  -8.731
  142    HE2  LYS  18           HE2      LYS  18  -9.518   4.327 -10.322
  143    HE3  LYS  18           HE3      LYS  18  -8.537   3.445  -9.178
  144    HZ1  LYS  18           HZ1      LYS  18 -11.476   3.636  -8.966
  145    HZ2  LYS  18           HZ2      LYS  18 -10.453   2.596  -8.108
  146    HZ3  LYS  18           HZ3      LYS  18 -10.685   2.374  -9.765
  147    H    ASN  19           H        ASN  19 -13.902   4.502  -6.292
  148    HA   ASN  19           HA       ASN  19 -14.383   5.123  -3.505
  149    HB2  ASN  19           HB2      ASN  19 -16.668   4.593  -3.918
  150    HB3  ASN  19           HB3      ASN  19 -16.097   5.490  -5.316
  151   HD21  ASN  19          HD21      ASN  19 -17.233   2.446  -4.133
  152   HD22  ASN  19          HD22      ASN  19 -17.399   1.673  -5.704
  153    H    ARG  20           H        ARG  20 -12.798   2.739  -5.016
  154    HA   ARG  20           HA       ARG  20 -13.496   0.732  -2.984
  155    HB2  ARG  20           HB2      ARG  20 -13.091   0.347  -5.921
  156    HB3  ARG  20           HB3      ARG  20 -12.754  -0.963  -4.806
  157    HG2  ARG  20           HG2      ARG  20 -15.071  -0.771  -3.982
  158    HG3  ARG  20           HG3      ARG  20 -15.386   0.410  -5.244
  159    HD2  ARG  20           HD2      ARG  20 -14.445  -1.375  -6.783
  160    HD3  ARG  20           HD3      ARG  20 -14.682  -2.486  -5.459
  161    HE   ARG  20           HE       ARG  20 -17.112  -1.434  -5.660
  162   HH11  ARG  20          HH11      ARG  20 -14.932  -2.534  -8.156
  163   HH12  ARG  20          HH12      ARG  20 -16.196  -3.096  -9.202
  164   HH21  ARG  20          HH21      ARG  20 -18.808  -2.191  -7.035
  165   HH22  ARG  20          HH22      ARG  20 -18.390  -2.896  -8.568
  166    H    GLY  21           H        GLY  21 -11.833  -0.229  -1.968
  167    HA2  GLY  21           HA2      GLY  21  -9.347  -0.939  -2.593
  168    HA3  GLY  21           HA3      GLY  21  -9.126   0.796  -2.406
  169    H    ILE  22           H        ILE  22  -7.703   0.255  -0.472
  170    HA   ILE  22           HA       ILE  22  -9.393  -0.500   1.810
  171    HB   ILE  22           HB       ILE  22  -7.677  -1.648   2.844
  172   HG12  ILE  22          HG12      ILE  22  -5.738  -0.238   1.045
  173   HG13  ILE  22          HG13      ILE  22  -6.095   0.209   2.680
  174   HG21  ILE  22          HG21      ILE  22  -8.279  -2.990   0.968
  175   HG22  ILE  22          HG22      ILE  22  -6.521  -3.100   1.147
  176   HG23  ILE  22          HG23      ILE  22  -7.225  -2.069  -0.104
  177   HD11  ILE  22          HD11      ILE  22  -4.923  -2.429   1.884
  178   HD12  ILE  22          HD12      ILE  22  -5.131  -1.791   3.526
  179   HD13  ILE  22          HD13      ILE  22  -3.986  -1.033   2.423
  180    H    HIS  23           H        HIS  23  -7.874   0.242   3.824
  181    HA   HIS  23           HA       HIS  23  -7.164   3.011   3.441
  182    HB2  HIS  23           HB2      HIS  23  -8.762   3.819   5.183
  183    HB3  HIS  23           HB3      HIS  23  -9.530   3.293   3.705
  184    HD1  HIS  23           HD1      HIS  23  -9.338   2.580   7.350
  185    HD2  HIS  23           HD2      HIS  23 -11.052   0.977   3.942
  186    HE1  HIS  23           HE1      HIS  23 -11.050   0.939   8.176
  187    HE2  HIS  23           HE2      HIS  23 -11.989  -0.122   6.094
  188    H    LEU  24           H        LEU  24  -5.221   2.901   4.290
  189    HA   LEU  24           HA       LEU  24  -4.849   1.737   6.941
  190    HB2  LEU  24           HB2      LEU  24  -3.071   2.501   4.709
  191    HB3  LEU  24           HB3      LEU  24  -2.477   2.919   6.267
  192    HG   LEU  24           HG       LEU  24  -2.602   0.528   6.893
  193   HD11  LEU  24          HD11      LEU  24  -3.370   0.144   4.076
  194   HD12  LEU  24          HD12      LEU  24  -4.230  -0.370   5.531
  195   HD13  LEU  24          HD13      LEU  24  -2.675  -1.107   5.113
  196   HD21  LEU  24          HD21      LEU  24  -0.755  -0.177   5.313
  197   HD22  LEU  24          HD22      LEU  24  -0.494   1.251   6.307
  198   HD23  LEU  24          HD23      LEU  24  -0.940   1.426   4.609
  199    H    TYR  25           H        TYR  25  -4.996   3.045   8.672
  200    HA   TYR  25           HA       TYR  25  -4.965   4.917   9.972
  201    HB2  TYR  25           HB2      TYR  25  -3.362   6.233   7.819
  202    HB3  TYR  25           HB3      TYR  25  -3.391   6.662   9.515
  203    HD1  TYR  25           HD1      TYR  25  -1.094   6.434  10.129
  204    HD2  TYR  25           HD2      TYR  25  -2.995   3.305   8.001
  205    HE1  TYR  25           HE1      TYR  25   0.866   5.004  10.475
  206    HE2  TYR  25           HE2      TYR  25  -1.074   1.867   8.276
  207    HH   TYR  25           HH       TYR  25   1.409   2.630  10.552
  208    H    THR  26           H        THR  26  -4.605   7.428   7.918
  209    HA   THR  26           HA       THR  26  -7.496   7.680   7.499
  210    HB   THR  26           HB       THR  26  -6.926   9.485   8.819
  211    HG1  THR  26           HG1      THR  26  -7.294  10.069   6.221
  212   HG21  THR  26          HG21      THR  26  -4.871  10.768   8.663
  213   HG22  THR  26          HG22      THR  26  -4.377   9.829   7.254
  214   HG23  THR  26          HG23      THR  26  -4.527   9.042   8.828
  215    H    LYS  27           H        LYS  27  -5.194   6.399   5.773
  216    HA   LYS  27           HA       LYS  27  -5.507   8.134   3.411
  217    HB2  LYS  27           HB2      LYS  27  -3.634   5.900   3.153
  218    HB3  LYS  27           HB3      LYS  27  -3.492   7.551   2.595
  219    HG2  LYS  27           HG2      LYS  27  -2.813   6.413   5.252
  220    HG3  LYS  27           HG3      LYS  27  -1.762   7.182   4.088
  221    HD2  LYS  27           HD2      LYS  27  -3.927   8.565   5.649
  222    HD3  LYS  27           HD3      LYS  27  -2.191   8.670   5.973
  223    HE2  LYS  27           HE2      LYS  27  -2.085   9.409   3.468
  224    HE3  LYS  27           HE3      LYS  27  -3.784   9.804   3.726
  225    HZ1  LYS  27           HZ1      LYS  27  -1.952  10.755   5.770
  226    HZ2  LYS  27           HZ2      LYS  27  -3.289  11.527   5.071
  227    HZ3  LYS  27           HZ3      LYS  27  -1.806  11.491   4.261
  228    H    PHE  28           H        PHE  28  -4.964   6.610   1.436
  229    HA   PHE  28           HA       PHE  28  -6.761   4.333   1.399
  230    HB2  PHE  28           HB2      PHE  28  -8.245   6.199   0.968
  231    HB3  PHE  28           HB3      PHE  28  -7.156   6.831  -0.261
  232    HD1  PHE  28           HD1      PHE  28  -7.368   6.176  -2.476
  233    HD2  PHE  28           HD2      PHE  28  -9.243   3.892   0.575
  234    HE1  PHE  28           HE1      PHE  28  -8.460   4.802  -4.190
  235    HE2  PHE  28           HE2      PHE  28 -10.350   2.514  -1.136
  236    HZ   PHE  28           HZ       PHE  28  -9.947   2.956  -3.536
  237    H    ILE  29           H        ILE  29  -5.274   2.912   0.637
  238    HA   ILE  29           HA       ILE  29  -3.949   3.605  -1.877
  239    HB   ILE  29           HB       ILE  29  -4.012   0.898  -0.484
  240   HG12  ILE  29          HG12      ILE  29  -1.488   1.398  -0.236
  241   HG13  ILE  29          HG13      ILE  29  -1.943   3.085  -0.447
  242   HG21  ILE  29          HG21      ILE  29  -2.431   1.856  -2.865
  243   HG22  ILE  29          HG22      ILE  29  -3.784   0.721  -2.890
  244   HG23  ILE  29          HG23      ILE  29  -2.268   0.277  -2.096
  245   HD11  ILE  29          HD11      ILE  29  -1.717   2.330   1.908
  246   HD12  ILE  29          HD12      ILE  29  -3.112   1.281   1.648
  247   HD13  ILE  29          HD13      ILE  29  -3.290   3.030   1.515
  248    H    CYS  30           H        CYS  30  -5.188   3.338  -3.723
  249    HA   CYS  30           HA       CYS  30  -7.734   2.103  -3.562
  250    HB2  CYS  30           HB2      CYS  30  -8.061   2.557  -5.782
  251    HB3  CYS  30           HB3      CYS  30  -6.846   3.764  -5.379
  252    H    LEU  31           H        LEU  31  -8.455   0.280  -4.651
  253    HA   LEU  31           HA       LEU  31  -7.349  -1.976  -3.593
  254    HB2  LEU  31           HB2      LEU  31  -9.162  -3.038  -4.475
  255    HB3  LEU  31           HB3      LEU  31  -9.707  -1.394  -4.457
  256    HG   LEU  31           HG       LEU  31  -8.771  -1.460  -6.954
  257   HD11  LEU  31          HD11      LEU  31  -9.654  -4.295  -6.432
  258   HD12  LEU  31          HD12      LEU  31  -8.020  -3.775  -6.840
  259   HD13  LEU  31          HD13      LEU  31  -9.321  -3.587  -8.014
  260   HD21  LEU  31          HD21      LEU  31 -11.010  -0.809  -6.294
  261   HD22  LEU  31          HD22      LEU  31 -11.453  -2.499  -6.058
  262   HD23  LEU  31          HD23      LEU  31 -11.071  -1.903  -7.674
  263    H    ASP  32           H        ASP  32  -6.494  -0.443  -6.493
  264    HA   ASP  32           HA       ASP  32  -5.614  -2.852  -7.848
  265    HB2  ASP  32           HB2      ASP  32  -6.600  -0.691  -8.928
  266    HB3  ASP  32           HB3      ASP  32  -4.956  -0.106  -8.757
  267    H    CYS  33           H        CYS  33  -4.291   0.038  -6.486
  268    HA   CYS  33           HA       CYS  33  -1.554  -0.604  -6.692
  269    HB2  CYS  33           HB2      CYS  33  -3.014   1.408  -4.981
  270    HB3  CYS  33           HB3      CYS  33  -1.277   1.284  -5.118
  271    H    GLU  34           H        GLU  34  -4.070  -1.016  -4.381
  272    HA   GLU  34           HA       GLU  34  -2.597  -1.793  -2.181
  273    HB2  GLU  34           HB2      GLU  34  -4.893  -1.306  -1.934
  274    HB3  GLU  34           HB3      GLU  34  -5.351  -2.442  -3.158
  275    HG2  GLU  34           HG2      GLU  34  -4.049  -3.638  -0.855
  276    HG3  GLU  34           HG3      GLU  34  -5.576  -2.866  -0.521
  277    H    ARG  35           H        ARG  35  -3.850  -3.658  -4.858
  278    HA   ARG  35           HA       ARG  35  -2.516  -6.022  -3.959
  279    HB2  ARG  35           HB2      ARG  35  -3.362  -7.151  -5.833
  280    HB3  ARG  35           HB3      ARG  35  -4.608  -5.991  -5.418
  281    HG2  ARG  35           HG2      ARG  35  -3.574  -4.498  -7.202
  282    HG3  ARG  35           HG3      ARG  35  -2.705  -5.934  -7.718
  283    HD2  ARG  35           HD2      ARG  35  -5.632  -5.462  -7.680
  284    HD3  ARG  35           HD3      ARG  35  -4.619  -5.883  -9.048
  285    HE   ARG  35           HE       ARG  35  -4.327  -8.033  -7.496
  286   HH11  ARG  35          HH11      ARG  35  -7.181  -6.290  -8.521
  287   HH12  ARG  35          HH12      ARG  35  -8.227  -7.668  -8.393
  288   HH21  ARG  35          HH21      ARG  35  -5.704  -9.854  -7.312
  289   HH22  ARG  35          HH22      ARG  35  -7.391  -9.695  -7.693
  290    H    LYS  36           H        LYS  36  -1.569  -3.350  -5.862
  291    HA   LYS  36           HA       LYS  36   0.372  -4.521  -7.520
  292    HB2  LYS  36           HB2      LYS  36   0.082  -1.754  -6.392
  293    HB3  LYS  36           HB3      LYS  36   1.302  -2.196  -7.544
  294    HG2  LYS  36           HG2      LYS  36  -0.625  -2.834  -9.053
  295    HG3  LYS  36           HG3      LYS  36  -1.643  -2.032  -7.926
  296    HD2  LYS  36           HD2      LYS  36  -0.540  -0.039  -8.310
  297    HD3  LYS  36           HD3      LYS  36   0.735  -0.783  -9.238
  298    HE2  LYS  36           HE2      LYS  36  -2.170  -0.652 -10.003
  299    HE3  LYS  36           HE3      LYS  36  -0.908   0.396 -10.643
  300    HZ1  LYS  36           HZ1      LYS  36   0.207  -1.585 -11.511
  301    HZ2  LYS  36           HZ2      LYS  36  -1.339  -1.392 -12.165
  302    HZ3  LYS  36           HZ3      LYS  36  -1.070  -2.549 -10.963
  303    H    VAL  37           H        VAL  37   0.310  -3.032  -4.423
  304    HA   VAL  37           HA       VAL  37   2.989  -2.889  -3.865
  305    HB   VAL  37           HB       VAL  37   2.374  -2.818  -1.524
  306   HG11  VAL  37          HG11      VAL  37   1.411  -0.736  -1.626
  307   HG12  VAL  37          HG12      VAL  37   0.198  -1.255  -2.802
  308   HG13  VAL  37          HG13      VAL  37   1.856  -0.928  -3.331
  309   HG21  VAL  37          HG21      VAL  37  -0.219  -3.850  -2.531
  310   HG22  VAL  37          HG22      VAL  37  -0.151  -2.865  -1.064
  311   HG23  VAL  37          HG23      VAL  37   0.757  -4.375  -1.153
  312    H    ILE  38           H        ILE  38   0.727  -5.444  -3.194
  313    HA   ILE  38           HA       ILE  38   2.335  -7.153  -1.684
  314    HB   ILE  38           HB       ILE  38   0.236  -8.133  -3.600
  315   HG12  ILE  38          HG12      ILE  38  -0.166  -6.606  -1.045
  316   HG13  ILE  38          HG13      ILE  38  -0.859  -6.289  -2.617
  317   HG21  ILE  38          HG21      ILE  38  -0.220  -9.744  -1.783
  318   HG22  ILE  38          HG22      ILE  38   1.128  -9.052  -0.885
  319   HG23  ILE  38          HG23      ILE  38   1.417  -9.853  -2.426
  320   HD11  ILE  38          HD11      ILE  38  -1.516  -8.796  -1.142
  321   HD12  ILE  38          HD12      ILE  38  -2.427  -7.977  -2.410
  322   HD13  ILE  38          HD13      ILE  38  -2.346  -7.284  -0.788
  323    H    SER  39           H        SER  39   1.923  -6.545  -5.036
  324    HA   SER  39           HA       SER  39   3.307  -8.832  -5.913
  325    HB2  SER  39           HB2      SER  39   1.596  -7.746  -7.307
  326    HB3  SER  39           HB3      SER  39   2.606  -6.307  -7.416
  327    HG   SER  39           HG       SER  39   3.623  -8.803  -8.226
  328    H    THR  40           H        THR  40   4.102  -5.512  -5.272
  329    HA   THR  40           HA       THR  40   6.815  -5.669  -6.247
  330    HB   THR  40           HB       THR  40   5.517  -3.558  -4.516
  331    HG1  THR  40           HG1      THR  40   4.380  -3.959  -6.524
  332   HG21  THR  40          HG21      THR  40   7.183  -2.060  -5.441
  333   HG22  THR  40          HG22      THR  40   7.846  -3.365  -6.425
  334   HG23  THR  40          HG23      THR  40   7.975  -3.431  -4.667
  335    H    SER  41           H        SER  41   5.109  -6.273  -3.366
  336    HA   SER  41           HA       SER  41   7.110  -5.818  -1.443
  337    HB2  SER  41           HB2      SER  41   4.949  -5.668  -0.667
  338    HB3  SER  41           HB3      SER  41   4.487  -7.142  -1.470
  339    HG   SER  41           HG       SER  41   5.279  -6.804   1.031
  340    H    THR  42           H        THR  42   6.832  -8.224  -3.712
  341    HA   THR  42           HA       THR  42   7.608 -10.507  -2.210
  342    HB   THR  42           HB       THR  42   7.907 -11.577  -4.393
  343    HG1  THR  42           HG1      THR  42   8.521 -10.321  -5.983
  344   HG21  THR  42          HG21      THR  42   5.498  -9.750  -4.286
  345   HG22  THR  42          HG22      THR  42   5.642 -11.315  -3.480
  346   HG23  THR  42          HG23      THR  42   5.631 -11.229  -5.242
  347    H    SER  43           H        SER  43   9.305  -8.505  -1.505
  348    HA   SER  43           HA       SER  43  11.879  -9.683  -1.984
  349    HB2  SER  43           HB2      SER  43  11.551  -8.014  -3.885
  350    HB3  SER  43           HB3      SER  43  11.490  -6.751  -2.660
  351    HG   SER  43           HG       SER  43  13.651  -8.292  -2.255
  352    H    ASP  44           H        ASP  44  10.387  -9.728   0.223
  353    HA   ASP  44           HA       ASP  44  10.491  -7.364   1.801
  354    HB2  ASP  44           HB2      ASP  44   9.201  -8.486   3.388
  355    HB3  ASP  44           HB3      ASP  44   8.690  -9.161   1.847
  356    HA   PRO  45           HA       PRO  45  14.074 -10.033   4.104
  357    HB2  PRO  45           HB2      PRO  45  15.633  -9.794   1.596
  358    HB3  PRO  45           HB3      PRO  45  15.790 -10.961   2.874
  359    HG2  PRO  45           HG2      PRO  45  14.623 -11.526   0.579
  360    HG3  PRO  45           HG3      PRO  45  14.052 -12.133   2.107
  361    HD2  PRO  45           HD2      PRO  45  12.872 -10.093   0.384
  362    HD3  PRO  45           HD3      PRO  45  12.066 -11.186   1.515
  363    H    ASP  46           H        ASP  46  16.035  -8.933   4.784
  364    HA   ASP  46           HA       ASP  46  15.527  -6.087   4.730
  365    HB2  ASP  46           HB2      ASP  46  17.379  -7.826   6.346
  366    HB3  ASP  46           HB3      ASP  46  17.386  -6.073   6.456
  367    H    TYR  47           H        TYR  47  18.547  -7.926   4.597
  368    HA   TYR  47           HA       TYR  47  20.615  -7.204   3.951
  369    HB2  TYR  47           HB2      TYR  47  20.871  -7.660   1.597
  370    HB3  TYR  47           HB3      TYR  47  19.788  -8.814   2.335
  371    HD1  TYR  47           HD1      TYR  47  20.300  -6.784  -0.458
  372    HD2  TYR  47           HD2      TYR  47  17.213  -8.160   2.120
  373    HE1  TYR  47           HE1      TYR  47  18.648  -6.361  -2.229
  374    HE2  TYR  47           HE2      TYR  47  15.549  -7.746   0.351
  375    HH   TYR  47           HH       TYR  47  15.335  -6.283  -1.668
  376    H    ALA  48           H        ALA  48  19.861  -4.946   4.899
  377    HA   ALA  48           HA       ALA  48  20.918  -3.012   3.010
  378    HB1  ALA  48           HB1      ALA  48  19.122  -1.396   3.370
  379    HB2  ALA  48           HB2      ALA  48  18.247  -2.577   4.345
  380    HB3  ALA  48           HB3      ALA  48  18.506  -2.872   2.625
  381    H1   SER   0           H1       SER   0  -4.731  19.922   2.333
  382    H2   SER   0           H2       SER   0  -3.851  18.801   1.427
  383    H3   SER   0           H3       SER   0  -4.669  20.065   0.649
  384    HA   SER   0           HA       SER   0  -2.284  20.448   0.778
  385    HB2  SER   0           HB2      SER   0  -2.510  22.728   1.918
  386    HB3  SER   0           HB3      SER   0  -3.618  22.391   0.590
  387    HG   SER   0           HG       SER   0  -4.700  23.279   2.394
  388    H    MET   1           H        MET   1  -0.838  21.766   2.513
  389    HA   MET   1           HA       MET   1   0.378  21.795   4.425
  390    HB2  MET   1           HB2      MET   1  -1.833  20.085   5.568
  391    HB3  MET   1           HB3      MET   1  -0.488  20.728   6.496
  392    HG2  MET   1           HG2      MET   1  -1.216  22.991   6.034
  393    HG3  MET   1           HG3      MET   1  -2.530  22.382   5.031
  394    HE1  MET   1           HE1      MET   1  -4.529  20.921   5.965
  395    HE2  MET   1           HE2      MET   1  -4.771  20.544   7.669
  396    HE3  MET   1           HE3      MET   1  -3.437  19.806   6.785
  397    H    ASP   2           H        ASP   2  -0.978  18.573   3.819
  398    HA   ASP   2           HA       ASP   2   1.155  17.099   4.889
  399    HB2  ASP   2           HB2      ASP   2  -1.032  16.106   4.443
  400    HB3  ASP   2           HB3      ASP   2  -0.804  16.341   2.714
  401    H    GLU   3           H        GLU   3   3.188  17.150   4.245
  402    HA   GLU   3           HA       GLU   3   3.754  16.931   1.380
  403    HB2  GLU   3           HB2      GLU   3   4.079  19.287   2.050
  404    HB3  GLU   3           HB3      GLU   3   5.219  18.767   3.282
  405    HG2  GLU   3           HG2      GLU   3   6.767  18.011   1.642
  406    HG3  GLU   3           HG3      GLU   3   5.590  18.241   0.348
  407    H    THR   4           H        THR   4   5.219  15.396   0.922
  408    HA   THR   4           HA       THR   4   6.593  14.140   3.202
  409    HB   THR   4           HB       THR   4   6.209  11.960   1.902
  410    HG1  THR   4           HG1      THR   4   4.023  13.393   0.791
  411   HG21  THR   4          HG21      THR   4   3.966  11.653   2.861
  412   HG22  THR   4          HG22      THR   4   3.840  13.394   3.110
  413   HG23  THR   4          HG23      THR   4   5.050  12.463   3.992
  414    H    VAL   5           H        VAL   5   8.111  12.330   2.168
  415    HA   VAL   5           HA       VAL   5   9.743  11.620   0.772
  416    HB   VAL   5           HB       VAL   5   9.116  14.030  -0.936
  417   HG11  VAL   5          HG11      VAL   5  11.446  13.347  -1.201
  418   HG12  VAL   5          HG12      VAL   5  10.506  12.951  -2.640
  419   HG13  VAL   5          HG13      VAL   5  10.933  11.684  -1.490
  420   HG21  VAL   5          HG21      VAL   5   8.466  11.102  -1.282
  421   HG22  VAL   5          HG22      VAL   5   8.118  12.377  -2.449
  422   HG23  VAL   5          HG23      VAL   5   7.321  12.379  -0.876
  423    H    LYS   6           H        LYS   6  11.251  11.796   2.298
  424    HA   LYS   6           HA       LYS   6  13.058  14.103   2.071
  425    HB2  LYS   6           HB2      LYS   6  12.407  12.389   4.436
  426    HB3  LYS   6           HB3      LYS   6  13.889  13.310   4.375
  427    HG2  LYS   6           HG2      LYS   6  12.411  14.610   5.625
  428    HG3  LYS   6           HG3      LYS   6  12.404  15.335   4.024
  429    HD2  LYS   6           HD2      LYS   6  10.295  14.379   3.506
  430    HD3  LYS   6           HD3      LYS   6  10.344  13.340   4.927
  431    HE2  LYS   6           HE2      LYS   6   8.831  15.195   5.288
  432    HE3  LYS   6           HE3      LYS   6  10.225  15.318   6.351
  433    HZ1  LYS   6           HZ1      LYS   6  11.180  16.965   4.873
  434    HZ2  LYS   6           HZ2      LYS   6   9.644  17.454   5.385
  435    HZ3  LYS   6           HZ3      LYS   6   9.857  16.831   3.831
  436    H    LEU   7           H        LEU   7  15.257  12.842   3.394
  437    HA   LEU   7           HA       LEU   7  16.493  11.356   1.396
  438    HB2  LEU   7           HB2      LEU   7  17.723  12.419   3.196
  439    HB3  LEU   7           HB3      LEU   7  16.998  11.332   4.334
  440    HG   LEU   7           HG       LEU   7  18.141   9.437   3.173
  441   HD11  LEU   7          HD11      LEU   7  18.495  10.514   1.050
  442   HD12  LEU   7          HD12      LEU   7  20.043  10.037   1.748
  443   HD13  LEU   7          HD13      LEU   7  19.526  11.721   1.809
  444   HD21  LEU   7          HD21      LEU   7  19.876  11.606   4.352
  445   HD22  LEU   7          HD22      LEU   7  20.322   9.909   4.181
  446   HD23  LEU   7          HD23      LEU   7  19.002  10.369   5.254
  447    H    ASN   8           H        ASN   8  15.484  10.016   4.520
  448    HA   ASN   8           HA       ASN   8  14.898   7.382   3.569
  449    HB2  ASN   8           HB2      ASN   8  14.063   8.989   5.980
  450    HB3  ASN   8           HB3      ASN   8  13.448   7.369   5.694
  451   HD21  ASN   8          HD21      ASN   8  14.356   6.671   7.593
  452   HD22  ASN   8          HD22      ASN   8  16.050   6.401   7.754
  453    H    HIS   9           H        HIS   9  13.317   6.938   2.150
  454    HA   HIS   9           HA       HIS   9  11.500   8.774   1.154
  455    HB2  HIS   9           HB2      HIS   9  10.908   5.831   1.317
  456    HB3  HIS   9           HB3      HIS   9  10.311   6.972   0.132
  457    HD1  HIS   9           HD1      HIS   9  12.324   8.028  -1.449
  458    HD2  HIS   9           HD2      HIS   9  13.037   4.398   0.452
  459    HE1  HIS   9           HE1      HIS   9  14.225   6.967  -2.705
  460    HE2  HIS   9           HE2      HIS   9  14.697   4.817  -1.484
  461    H    THR  10           H        THR  10   9.734   9.646   1.958
  462    HA   THR  10           HA       THR  10   8.880   8.841   4.589
  463    HB   THR  10           HB       THR  10   7.608  10.969   2.874
  464    HG1  THR  10           HG1      THR  10  10.018  11.009   4.373
  465   HG21  THR  10          HG21      THR  10   7.100  11.998   5.049
  466   HG22  THR  10          HG22      THR  10   7.872  10.639   5.865
  467   HG23  THR  10          HG23      THR  10   6.405  10.383   4.918
  468    H    CYS  11           H        CYS  11   7.119   7.742   5.090
  469    HA   CYS  11           HA       CYS  11   5.905   6.178   3.084
  470    HB2  CYS  11           HB2      CYS  11   6.254   5.546   5.469
  471    HB3  CYS  11           HB3      CYS  11   4.941   6.632   5.879
  472    H    VAL  12           H        VAL  12   4.401   6.672   1.748
  473    HA   VAL  12           HA       VAL  12   2.623   8.712   1.683
  474    HB   VAL  12           HB       VAL  12   3.272   6.639   0.145
  475   HG11  VAL  12          HG11      VAL  12   2.062   4.931   1.252
  476   HG12  VAL  12          HG12      VAL  12   1.350   5.243  -0.335
  477   HG13  VAL  12          HG13      VAL  12   0.568   5.859   1.127
  478   HG21  VAL  12          HG21      VAL  12   1.330   7.255  -1.262
  479   HG22  VAL  12          HG22      VAL  12   2.478   8.505  -0.783
  480   HG23  VAL  12          HG23      VAL  12   0.920   8.379   0.031
  481    H    ILE  13           H        ILE  13   2.697   6.201   3.967
  482    HA   ILE  13           HA       ILE  13  -0.178   6.392   4.472
  483    HB   ILE  13           HB       ILE  13   1.716   4.359   5.573
  484   HG12  ILE  13          HG12      ILE  13   1.566   4.387   3.041
  485   HG13  ILE  13          HG13      ILE  13   1.124   2.879   3.826
  486   HG21  ILE  13          HG21      ILE  13  -0.308   3.119   6.019
  487   HG22  ILE  13          HG22      ILE  13  -1.270   4.408   5.300
  488   HG23  ILE  13          HG23      ILE  13  -0.368   4.704   6.786
  489   HD11  ILE  13          HD11      ILE  13  -0.835   4.964   2.968
  490   HD12  ILE  13          HD12      ILE  13  -1.168   3.324   3.548
  491   HD13  ILE  13          HD13      ILE  13  -0.362   3.570   1.994
  492    H    CYS  14           H        CYS  14   2.755   5.886   6.443
  493    HA   CYS  14           HA       CYS  14   1.313   7.001   8.669
  494    HB2  CYS  14           HB2      CYS  14   3.077   5.963  10.055
  495    HB3  CYS  14           HB3      CYS  14   2.194   4.819   9.068
  496    H    ASP  15           H        ASP  15   3.150   8.270   6.407
  497    HA   ASP  15           HA       ASP  15   4.315  10.213   6.146
  498    HB2  ASP  15           HB2      ASP  15   2.317  10.994   7.394
  499    HB3  ASP  15           HB3      ASP  15   3.263  10.939   8.866
  500    H    GLN  16           H        GLN  16   5.564   7.999   7.446
  501    HA   GLN  16           HA       GLN  16   7.549   9.296   9.140
  502    HB2  GLN  16           HB2      GLN  16   6.920   6.372   8.776
  503    HB3  GLN  16           HB3      GLN  16   8.149   7.019   9.858
  504    HG2  GLN  16           HG2      GLN  16   5.192   7.533  10.035
  505    HG3  GLN  16           HG3      GLN  16   6.113   6.438  11.055
  506   HE21  GLN  16          HE21      GLN  16   4.517   8.755  11.741
  507   HE22  GLN  16          HE22      GLN  16   5.573   9.810  12.600
  508    H    GLU  17           H        GLU  17   9.640   9.239   8.649
  509    HA   GLU  17           HA       GLU  17  10.394   8.896   5.915
  510    HB2  GLU  17           HB2      GLU  17  12.068   9.652   8.314
  511    HB3  GLU  17           HB3      GLU  17  12.565   9.754   6.638
  512    HG2  GLU  17           HG2      GLU  17  11.062  11.471   6.157
  513    HG3  GLU  17           HG3      GLU  17  10.188  11.214   7.662
  514    H    LYS  18           H        LYS  18  10.633   6.963   5.267
  515    HA   LYS  18           HA       LYS  18  12.077   5.005   6.919
  516    HB2  LYS  18           HB2      LYS  18  10.106   4.116   4.919
  517    HB3  LYS  18           HB3      LYS  18  10.648   3.302   6.356
  518    HG2  LYS  18           HG2      LYS  18   8.726   5.597   6.191
  519    HG3  LYS  18           HG3      LYS  18   8.368   3.939   6.648
  520    HD2  LYS  18           HD2      LYS  18  10.312   5.566   8.192
  521    HD3  LYS  18           HD3      LYS  18   8.604   5.712   8.468
  522    HE2  LYS  18           HE2      LYS  18   9.514   4.197  10.064
  523    HE3  LYS  18           HE3      LYS  18   8.519   3.329   8.923
  524    HZ1  LYS  18           HZ1      LYS  18  11.461   3.468   8.706
  525    HZ2  LYS  18           HZ2      LYS  18  10.419   2.439   7.859
  526    HZ3  LYS  18           HZ3      LYS  18  10.653   2.227   9.517
  527    H    ASN  19           H        ASN  19  13.896   4.284   6.035
  528    HA   ASN  19           HA       ASN  19  14.389   4.882   3.242
  529    HB2  ASN  19           HB2      ASN  19  16.667   4.311   3.657
  530    HB3  ASN  19           HB3      ASN  19  16.113   5.226   5.051
  531   HD21  ASN  19          HD21      ASN  19  17.195   2.160   3.883
  532   HD22  ASN  19          HD22      ASN  19  17.338   1.389   5.456
  533    H    ARG  20           H        ARG  20  12.759   2.536   4.755
  534    HA   ARG  20           HA       ARG  20  13.423   0.509   2.735
  535    HB2  ARG  20           HB2      ARG  20  13.014   0.139   5.673
  536    HB3  ARG  20           HB3      ARG  20  12.652  -1.167   4.563
  537    HG2  ARG  20           HG2      ARG  20  14.973  -1.021   3.737
  538    HG3  ARG  20           HG3      ARG  20  15.308   0.158   4.996
  539    HD2  ARG  20           HD2      ARG  20  14.336  -1.605   6.541
  540    HD3  ARG  20           HD3      ARG  20  14.552  -2.725   5.222
  541    HE   ARG  20           HE       ARG  20  17.001  -1.717   5.416
  542   HH11  ARG  20          HH11      ARG  20  14.806  -2.777   7.920
  543   HH12  ARG  20          HH12      ARG  20  16.062  -3.352   8.966
  544   HH21  ARG  20          HH21      ARG  20  18.681  -2.495   6.796
  545   HH22  ARG  20          HH22      ARG  20  18.256  -3.190   8.331
  546    H    GLY  21           H        GLY  21  11.740  -0.425   1.724
  547    HA2  GLY  21           HA2      GLY  21   9.246  -1.089   2.353
  548    HA3  GLY  21           HA3      GLY  21   9.054   0.648   2.159
  549    H    ILE  22           H        ILE  22   7.621   0.128   0.227
  550    HA   ILE  22           HA       ILE  22   9.295  -0.665  -2.055
  551    HB   ILE  22           HB       ILE  22   7.561  -1.784  -3.084
  552   HG12  ILE  22          HG12      ILE  22   5.647  -0.335  -1.287
  553   HG13  ILE  22          HG13      ILE  22   6.011   0.100  -2.925
  554   HG21  ILE  22          HG21      ILE  22   8.137  -3.133  -1.203
  555   HG22  ILE  22          HG22      ILE  22   6.378  -3.212  -1.383
  556   HG23  ILE  22          HG23      ILE  22   7.100  -2.189  -0.134
  557   HD11  ILE  22          HD11      ILE  22   4.794  -2.514  -2.119
  558   HD12  ILE  22          HD12      ILE  22   5.013  -1.886  -3.763
  559   HD13  ILE  22          HD13      ILE  22   3.881  -1.104  -2.664
  560    H    HIS  23           H        HIS  23   7.785   0.100  -4.070
  561    HA   HIS  23           HA       HIS  23   7.129   2.881  -3.697
  562    HB2  HIS  23           HB2      HIS  23   8.742   3.654  -5.441
  563    HB3  HIS  23           HB3      HIS  23   9.499   3.117  -3.963
  564    HD1  HIS  23           HD1      HIS  23   9.291   2.400  -7.605
  565    HD2  HIS  23           HD2      HIS  23  10.979   0.775  -4.192
  566    HE1  HIS  23           HE1      HIS  23  10.978   0.727  -8.427
  567    HE2  HIS  23           HE2      HIS  23  11.902  -0.339  -6.340
  568    H    LEU  24           H        LEU  24   5.187   2.804  -4.546
  569    HA   LEU  24           HA       LEU  24   4.793   1.640  -7.191
  570    HB2  LEU  24           HB2      LEU  24   3.031   2.442  -4.960
  571    HB3  LEU  24           HB3      LEU  24   2.443   2.866  -6.519
  572    HG   LEU  24           HG       LEU  24   2.525   0.468  -7.137
  573   HD11  LEU  24          HD11      LEU  24   3.286   0.082  -4.319
  574   HD12  LEU  24          HD12      LEU  24   4.137  -0.453  -5.771
  575   HD13  LEU  24          HD13      LEU  24   2.570  -1.159  -5.350
  576   HD21  LEU  24          HD21      LEU  24   0.665  -0.198  -5.556
  577   HD22  LEU  24          HD22      LEU  24   0.430   1.232  -6.552
  578   HD23  LEU  24          HD23      LEU  24   0.880   1.404  -4.856
  579    H    TYR  25           H        TYR  25   4.964   2.939  -8.926
  580    HA   TYR  25           HA       TYR  25   4.966   4.805 -10.231
  581    HB2  TYR  25           HB2      TYR  25   3.387   6.161  -8.082
  582    HB3  TYR  25           HB3      TYR  25   3.424   6.580  -9.779
  583    HD1  TYR  25           HD1      TYR  25   1.121   6.394 -10.392
  584    HD2  TYR  25           HD2      TYR  25   2.968   3.237  -8.253
  585    HE1  TYR  25           HE1      TYR  25  -0.864   4.996 -10.735
  586    HE2  TYR  25           HE2      TYR  25   1.021   1.833  -8.524
  587    HH   TYR  25           HH       TYR  25  -1.455   2.637 -10.795
  588    H    THR  26           H        THR  26   4.655   7.329  -8.188
  589    HA   THR  26           HA       THR  26   7.548   7.532  -7.766
  590    HB   THR  26           HB       THR  26   7.009   9.346  -9.086
  591    HG1  THR  26           HG1      THR  26   7.411   9.926  -6.507
  592   HG21  THR  26          HG21      THR  26   4.976  10.657  -8.941
  593   HG22  THR  26          HG22      THR  26   4.463   9.730  -7.531
  594   HG23  THR  26          HG23      THR  26   4.604   8.937  -9.104
  595    H    LYS  27           H        LYS  27   5.223   6.296  -6.036
  596    HA   LYS  27           HA       LYS  27   5.568   8.032  -3.680
  597    HB2  LYS  27           HB2      LYS  27   3.652   5.835  -3.416
  598    HB3  LYS  27           HB3      LYS  27   3.542   7.489  -2.862
  599    HG2  LYS  27           HG2      LYS  27   2.844   6.358  -5.517
  600    HG3  LYS  27           HG3      LYS  27   1.804   7.147  -4.355
  601    HD2  LYS  27           HD2      LYS  27   3.995   8.491  -5.916
  602    HD3  LYS  27           HD3      LYS  27   2.260   8.629  -6.246
  603    HE2  LYS  27           HE2      LYS  27   2.165   9.370  -3.737
  604    HE3  LYS  27           HE3      LYS  27   3.871   9.733  -3.996
  605    HZ1  LYS  27           HZ1      LYS  27   2.056  10.716  -6.041
  606    HZ2  LYS  27           HZ2      LYS  27   3.410  11.462  -5.352
  607    HZ3  LYS  27           HZ3      LYS  27   1.930  11.463  -4.536
  608    H    PHE  28           H        PHE  28   4.997   6.525  -1.699
  609    HA   PHE  28           HA       PHE  28   6.754   4.217  -1.654
  610    HB2  PHE  28           HB2      PHE  28   8.271   6.057  -1.232
  611    HB3  PHE  28           HB3      PHE  28   7.197   6.713  -0.004
  612    HD1  PHE  28           HD1      PHE  28   7.397   6.060   2.213
  613    HD2  PHE  28           HD2      PHE  28   9.229   3.734  -0.831
  614    HE1  PHE  28           HE1      PHE  28   8.462   4.673   3.930
  615    HE2  PHE  28           HE2      PHE  28  10.314   2.340   0.884
  616    HZ   PHE  28           HZ       PHE  28   9.918   2.797   3.282
  617    H    ILE  29           H        ILE  29   5.241   2.827  -0.888
  618    HA   ILE  29           HA       ILE  29   3.931   3.549   1.625
  619    HB   ILE  29           HB       ILE  29   3.945   0.838   0.239
  620   HG12  ILE  29          HG12      ILE  29   1.431   1.383  -0.012
  621   HG13  ILE  29          HG13      ILE  29   1.915   3.063   0.193
  622   HG21  ILE  29          HG21      ILE  29   2.382   1.834   2.615
  623   HG22  ILE  29          HG22      ILE  29   3.713   0.674   2.644
  624   HG23  ILE  29          HG23      ILE  29   2.190   0.255   1.852
  625   HD11  ILE  29          HD11      ILE  29   1.683   2.296  -2.158
  626   HD12  ILE  29          HD12      ILE  29   3.056   1.226  -1.892
  627   HD13  ILE  29          HD13      ILE  29   3.265   2.975  -1.767
  628    H    CYS  30           H        CYS  30   5.163   3.266   3.469
  629    HA   CYS  30           HA       CYS  30   7.690   1.987   3.313
  630    HB2  CYS  30           HB2      CYS  30   8.021   2.442   5.530
  631    HB3  CYS  30           HB3      CYS  30   6.828   3.669   5.123
  632    H    LEU  31           H        LEU  31   8.376   0.153   4.410
  633    HA   LEU  31           HA       LEU  31   7.228  -2.086   3.354
  634    HB2  LEU  31           HB2      LEU  31   9.022  -3.178   4.238
  635    HB3  LEU  31           HB3      LEU  31   9.597  -1.545   4.216
  636    HG   LEU  31           HG       LEU  31   8.663  -1.585   6.711
  637   HD11  LEU  31          HD11      LEU  31   9.491  -4.437   6.200
  638   HD12  LEU  31          HD12      LEU  31   7.867  -3.885   6.605
  639   HD13  LEU  31          HD13      LEU  31   9.170  -3.716   7.779
  640   HD21  LEU  31          HD21      LEU  31  10.912  -0.980   6.049
  641   HD22  LEU  31          HD22      LEU  31  11.323  -2.679   5.818
  642   HD23  LEU  31          HD23      LEU  31  10.952  -2.072   7.431
  643    H    ASP  32           H        ASP  32   6.403  -0.531   6.249
  644    HA   ASP  32           HA       ASP  32   5.482  -2.918   7.615
  645    HB2  ASP  32           HB2      ASP  32   6.510  -0.774   8.688
  646    HB3  ASP  32           HB3      ASP  32   4.879  -0.155   8.511
  647    H    CYS  33           H        CYS  33   4.211  -0.010   6.238
  648    HA   CYS  33           HA       CYS  33   1.461  -0.603   6.452
  649    HB2  CYS  33           HB2      CYS  33   2.952   1.380   4.735
  650    HB3  CYS  33           HB3      CYS  33   1.214   1.288   4.879
  651    H    GLU  34           H        GLU  34   3.969  -1.065   4.140
  652    HA   GLU  34           HA       GLU  34   2.482  -1.822   1.942
  653    HB2  GLU  34           HB2      GLU  34   4.786  -1.379   1.695
  654    HB3  GLU  34           HB3      GLU  34   5.223  -2.518   2.923
  655    HG2  GLU  34           HG2      GLU  34   3.898  -3.698   0.622
  656    HG3  GLU  34           HG3      GLU  34   5.441  -2.955   0.285
  657    H    ARG  35           H        ARG  35   3.700  -3.702   4.627
  658    HA   ARG  35           HA       ARG  35   2.327  -6.044   3.741
  659    HB2  ARG  35           HB2      ARG  35   3.145  -7.181   5.614
  660    HB3  ARG  35           HB3      ARG  35   4.414  -6.047   5.196
  661    HG2  ARG  35           HG2      ARG  35   3.410  -4.530   6.974
  662    HG3  ARG  35           HG3      ARG  35   2.513  -5.947   7.494
  663    HD2  ARG  35           HD2      ARG  35   5.449  -5.528   7.454
  664    HD3  ARG  35           HD3      ARG  35   4.428  -5.928   8.825
  665    HE   ARG  35           HE       ARG  35   4.102  -8.076   7.275
  666   HH11  ARG  35          HH11      ARG  35   6.987  -6.378   8.295
  667   HH12  ARG  35          HH12      ARG  35   8.007  -7.779   8.174
  668   HH21  ARG  35          HH21      ARG  35   5.445  -9.921   7.100
  669   HH22  ARG  35          HH22      ARG  35   7.133  -9.791   7.482
  670    H    LYS  36           H        LYS  36   1.424  -3.349   5.631
  671    HA   LYS  36           HA       LYS  36  -0.537  -4.478   7.291
  672    HB2  LYS  36           HB2      LYS  36  -0.196  -1.719   6.158
  673    HB3  LYS  36           HB3      LYS  36  -1.423  -2.136   7.310
  674    HG2  LYS  36           HG2      LYS  36   0.491  -2.804   8.820
  675    HG3  LYS  36           HG3      LYS  36   1.524  -2.025   7.691
  676    HD2  LYS  36           HD2      LYS  36   0.458  -0.012   8.070
  677    HD3  LYS  36           HD3      LYS  36  -0.830  -0.729   8.998
  678    HE2  LYS  36           HE2      LYS  36   2.076  -0.648   9.762
  679    HE3  LYS  36           HE3      LYS  36   0.831   0.421  10.405
  680    HZ1  LYS  36           HZ1      LYS  36  -0.313  -1.545  11.275
  681    HZ2  LYS  36           HZ2      LYS  36   1.239  -1.380  11.924
  682    HZ3  LYS  36           HZ3      LYS  36   0.947  -2.530  10.721
  683    H    VAL  37           H        VAL  37  -0.446  -3.004   4.189
  684    HA   VAL  37           HA       VAL  37  -3.123  -2.810   3.632
  685    HB   VAL  37           HB       VAL  37  -2.508  -2.758   1.290
  686   HG11  VAL  37          HG11      VAL  37  -1.510  -0.694   1.386
  687   HG12  VAL  37          HG12      VAL  37  -0.306  -1.230   2.563
  688   HG13  VAL  37          HG13      VAL  37  -1.957  -0.873   3.091
  689   HG21  VAL  37          HG21      VAL  37   0.067  -3.834   2.302
  690   HG22  VAL  37          HG22      VAL  37   0.016  -2.852   0.832
  691   HG23  VAL  37          HG23      VAL  37  -0.919  -4.346   0.926
  692    H    ILE  38           H        ILE  38  -0.912  -5.411   2.969
  693    HA   ILE  38           HA       ILE  38  -2.549  -7.095   1.461
  694    HB   ILE  38           HB       ILE  38  -0.472  -8.107   3.387
  695   HG12  ILE  38          HG12      ILE  38  -0.058  -6.585   0.846
  696   HG13  ILE  38          HG13      ILE  38   0.656  -6.287   2.410
  697   HG21  ILE  38          HG21      ILE  38  -0.040  -9.729   1.572
  698   HG22  ILE  38          HG22      ILE  38  -1.376  -9.014   0.673
  699   HG23  ILE  38          HG23      ILE  38  -1.681  -9.808   2.214
  700   HD11  ILE  38          HD11      ILE  38   1.265  -8.802   0.923
  701   HD12  ILE  38          HD12      ILE  38   2.198  -7.997   2.185
  702   HD13  ILE  38          HD13      ILE  38   2.118  -7.303   0.565
  703    H    SER  39           H        SER  39  -2.101  -6.495   4.794
  704    HA   SER  39           HA       SER  39  -3.546  -8.740   5.701
  705    HB2  SER  39           HB2      SER  39  -1.819  -7.684   7.096
  706    HB3  SER  39           HB3      SER  39  -2.794  -6.220   7.190
  707    HG   SER  39           HG       SER  39  -3.867  -8.689   8.025
  708    H    THR  40           H        THR  40  -4.281  -5.407   5.052
  709    HA   THR  40           HA       THR  40  -6.997  -5.512   6.027
  710    HB   THR  40           HB       THR  40  -5.663  -3.432   4.288
  711    HG1  THR  40           HG1      THR  40  -4.529  -3.852   6.296
  712   HG21  THR  40          HG21      THR  40  -7.298  -1.900   5.214
  713   HG22  THR  40          HG22      THR  40  -7.984  -3.191   6.201
  714   HG23  THR  40          HG23      THR  40  -8.116  -3.259   4.444
  715    H    SER  41           H        SER  41  -5.308  -6.157   3.147
  716    HA   SER  41           HA       SER  41  -7.299  -5.672   1.221
  717    HB2  SER  41           HB2      SER  41  -5.137  -5.563   0.442
  718    HB3  SER  41           HB3      SER  41  -4.697  -7.037   1.259
  719    HG   SER  41           HG       SER  41  -5.494  -6.708  -1.248
  720    H    THR  42           H        THR  42  -7.066  -8.074   3.497
  721    HA   THR  42           HA       THR  42  -7.883 -10.346   2.002
  722    HB   THR  42           HB       THR  42  -8.199 -11.404   4.186
  723    HG1  THR  42           HG1      THR  42  -8.779 -10.137   5.777
  724   HG21  THR  42          HG21      THR  42  -5.756  -9.624   4.077
  725   HG22  THR  42          HG22      THR  42  -5.928 -11.187   3.274
  726   HG23  THR  42          HG23      THR  42  -5.919 -11.098   5.035
  727    H    SER  43           H        SER  43  -9.543  -8.312   1.294
  728    HA   SER  43           HA       SER  43 -12.139  -9.445   1.781
  729    HB2  SER  43           HB2      SER  43 -11.773  -7.771   3.673
  730    HB3  SER  43           HB3      SER  43 -11.694  -6.514   2.442
  731    HG   SER  43           HG       SER  43 -13.882  -8.003   2.040
  732    H    ASP  44           H        ASP  44 -10.649  -9.527  -0.428
  733    HA   ASP  44           HA       ASP  44 -10.708  -7.165  -2.012
  734    HB2  ASP  44           HB2      ASP  44  -9.437  -8.310  -3.596
  735    HB3  ASP  44           HB3      ASP  44  -8.941  -8.996  -2.054
  736    HA   PRO  45           HA       PRO  45 -14.342  -9.774  -4.311
  737    HB2  PRO  45           HB2      PRO  45 -15.912  -9.453  -1.792
  738    HB3  PRO  45           HB3      PRO  45 -16.085 -10.650  -3.066
  739    HG2  PRO  45           HG2      PRO  45 -14.930 -11.250  -0.814
  740    HG3  PRO  45           HG3      PRO  45 -14.332 -11.907  -2.331
  741    HD2  PRO  45           HD2      PRO  45 -13.143  -9.835  -0.580
  742    HD3  PRO  45           HD3      PRO  45 -12.351 -10.951  -1.707
  743    H    ASP  46           H        ASP  46 -16.282  -8.651  -4.964
  744    HA   ASP  46           HA       ASP  46 -15.721  -5.808  -4.945
  745    HB2  ASP  46           HB2      ASP  46 -17.605  -7.519  -6.555
  746    HB3  ASP  46           HB3      ASP  46 -17.583  -5.768  -6.668
  747    H    TYR  47           H        TYR  47 -18.775  -7.589  -4.807
  748    HA   TYR  47           HA       TYR  47 -20.826  -6.824  -4.160
  749    HB2  TYR  47           HB2      TYR  47 -21.091  -7.271  -1.807
  750    HB3  TYR  47           HB3      TYR  47 -20.031  -8.449  -2.542
  751    HD1  TYR  47           HD1      TYR  47 -20.505  -6.402   0.245
  752    HD2  TYR  47           HD2      TYR  47 -17.442  -7.840  -2.328
  753    HE1  TYR  47           HE1      TYR  47 -18.847  -5.999   2.015
  754    HE2  TYR  47           HE2      TYR  47 -15.770  -7.446  -0.560
  755    HH   TYR  47           HH       TYR  47 -15.512  -6.015   1.441
  756    H    ALA  48           H        ALA  48 -20.035  -4.586  -5.118
  757    HA   ALA  48           HA       ALA  48 -21.059  -2.626  -3.236
  758    HB1  ALA  48           HB1      ALA  48 -19.233  -1.044  -3.600
  759    HB2  ALA  48           HB2      ALA  48 -18.378  -2.242  -4.572
  760    HB3  ALA  48           HB3      ALA  48 -18.642  -2.528  -2.853
  Start of MODEL    9
    1    H1   SER   0           H1       SER   0   2.130  19.247   3.404
    2    H2   SER   0           H2       SER   0   1.802  18.550   4.906
    3    H3   SER   0           H3       SER   0   3.262  19.364   4.650
    4    HA   SER   0           HA       SER   0   1.795  20.727   5.933
    5    HB2  SER   0           HB2      SER   0   1.679  22.689   4.312
    6    HB3  SER   0           HB3      SER   0   3.266  21.949   4.518
    7    HG   SER   0           HG       SER   0   2.918  22.210   2.337
    8    H    MET   1           H        MET   1   0.376  19.967   2.747
    9    HA   MET   1           HA       MET   1  -2.186  21.018   3.572
   10    HB2  MET   1           HB2      MET   1  -1.312  19.614   1.044
   11    HB3  MET   1           HB3      MET   1  -2.931  20.245   1.314
   12    HG2  MET   1           HG2      MET   1  -0.376  21.826   1.189
   13    HG3  MET   1           HG3      MET   1  -1.667  21.796  -0.011
   14    HE1  MET   1           HE1      MET   1  -4.245  21.784   1.964
   15    HE2  MET   1           HE2      MET   1  -4.135  22.723   0.476
   16    HE3  MET   1           HE3      MET   1  -4.603  23.510   1.982
   17    H    ASP   2           H        ASP   2  -2.746  19.693   5.307
   18    HA   ASP   2           HA       ASP   2  -3.034  16.842   4.887
   19    HB2  ASP   2           HB2      ASP   2  -2.327  17.694   7.092
   20    HB3  ASP   2           HB3      ASP   2  -3.851  18.561   7.242
   21    H    GLU   3           H        GLU   3  -4.649  16.255   3.593
   22    HA   GLU   3           HA       GLU   3  -7.355  16.973   4.338
   23    HB2  GLU   3           HB2      GLU   3  -6.605  18.708   2.693
   24    HB3  GLU   3           HB3      GLU   3  -6.420  17.419   1.510
   25    HG2  GLU   3           HG2      GLU   3  -8.544  18.645   1.322
   26    HG3  GLU   3           HG3      GLU   3  -8.757  16.920   1.590
   27    H    THR   4           H        THR   4  -8.858  15.447   3.715
   28    HA   THR   4           HA       THR   4  -7.888  13.156   2.167
   29    HB   THR   4           HB       THR   4  -9.207  11.722   3.896
   30    HG1  THR   4           HG1      THR   4  -8.438  13.917   5.557
   31   HG21  THR   4          HG21      THR   4  -6.801  11.528   3.526
   32   HG22  THR   4          HG22      THR   4  -7.174  11.423   5.247
   33   HG23  THR   4          HG23      THR   4  -6.516  12.915   4.576
   34    H    VAL   5           H        VAL   5  -9.408  12.209   0.881
   35    HA   VAL   5           HA       VAL   5 -11.933  13.636   0.628
   36    HB   VAL   5           HB       VAL   5 -10.809  11.440  -1.121
   37   HG11  VAL   5          HG11      VAL   5 -13.219  11.682  -1.335
   38   HG12  VAL   5          HG12      VAL   5 -12.410  12.276  -2.784
   39   HG13  VAL   5          HG13      VAL   5 -13.038  13.416  -1.594
   40   HG21  VAL   5          HG21      VAL   5  -9.331  13.380  -1.089
   41   HG22  VAL   5          HG22      VAL   5 -10.691  14.434  -1.474
   42   HG23  VAL   5          HG23      VAL   5 -10.145  13.235  -2.647
   43    H    LYS   6           H        LYS   6 -13.873  12.838   1.167
   44    HA   LYS   6           HA       LYS   6 -13.881  10.399   2.734
   45    HB2  LYS   6           HB2      LYS   6 -14.829  12.500   3.623
   46    HB3  LYS   6           HB3      LYS   6 -16.036  12.441   2.362
   47    HG2  LYS   6           HG2      LYS   6 -16.948  10.399   3.260
   48    HG3  LYS   6           HG3      LYS   6 -15.692  10.384   4.494
   49    HD2  LYS   6           HD2      LYS   6 -16.531  12.529   5.353
   50    HD3  LYS   6           HD3      LYS   6 -17.811  12.490   4.148
   51    HE2  LYS   6           HE2      LYS   6 -18.706  10.464   5.121
   52    HE3  LYS   6           HE3      LYS   6 -17.393  10.434   6.290
   53    HZ1  LYS   6           HZ1      LYS   6 -18.194  12.534   7.186
   54    HZ2  LYS   6           HZ2      LYS   6 -19.396  11.347   7.264
   55    HZ3  LYS   6           HZ3      LYS   6 -19.465  12.546   6.071
   56    H    LEU   7           H        LEU   7 -15.305  11.629  -0.243
   57    HA   LEU   7           HA       LEU   7 -17.118   9.413  -0.483
   58    HB2  LEU   7           HB2      LEU   7 -17.721  11.564  -1.408
   59    HB3  LEU   7           HB3      LEU   7 -16.351  11.499  -2.469
   60    HG   LEU   7           HG       LEU   7 -17.369   9.435  -3.507
   61   HD11  LEU   7          HD11      LEU   7 -18.853   8.889  -1.684
   62   HD12  LEU   7          HD12      LEU   7 -19.770   9.152  -3.167
   63   HD13  LEU   7          HD13      LEU   7 -19.727  10.399  -1.920
   64   HD21  LEU   7          HD21      LEU   7 -17.435  11.598  -4.614
   65   HD22  LEU   7          HD22      LEU   7 -18.876  12.040  -3.698
   66   HD23  LEU   7          HD23      LEU   7 -18.946  10.724  -4.870
   67    H    ASN   8           H        ASN   8 -15.390  10.136  -3.401
   68    HA   ASN   8           HA       ASN   8 -14.268   7.466  -3.472
   69    HB2  ASN   8           HB2      ASN   8 -13.730   9.776  -5.339
   70    HB3  ASN   8           HB3      ASN   8 -13.354   8.110  -5.651
   71   HD21  ASN   8          HD21      ASN   8 -14.879   9.818  -7.290
   72   HD22  ASN   8          HD22      ASN   8 -16.466   9.157  -7.399
   73    H    HIS   9           H        HIS   9 -12.759   7.327  -1.890
   74    HA   HIS   9           HA       HIS   9 -11.078   9.346  -0.986
   75    HB2  HIS   9           HB2      HIS   9 -10.382   6.405  -1.032
   76    HB3  HIS   9           HB3      HIS   9  -9.794   7.618   0.093
   77    HD1  HIS   9           HD1      HIS   9 -11.867   8.714   1.620
   78    HD2  HIS   9           HD2      HIS   9 -12.438   4.960  -0.077
   79    HE1  HIS   9           HE1      HIS   9 -13.748   7.659   2.914
   80    HE2  HIS   9           HE2      HIS   9 -13.981   5.346   1.962
   81    H    THR  10           H        THR  10  -9.446  10.374  -2.010
   82    HA   THR  10           HA       THR  10  -8.502   9.456  -4.525
   83    HB   THR  10           HB       THR  10  -7.325  11.567  -2.677
   84    HG1  THR  10           HG1      THR  10  -8.554  12.423  -4.954
   85   HG21  THR  10          HG21      THR  10  -5.667  10.762  -4.303
   86   HG22  THR  10          HG22      THR  10  -6.167  12.414  -4.661
   87   HG23  THR  10          HG23      THR  10  -6.803  11.077  -5.616
   88    H    CYS  11           H        CYS  11  -6.970   8.098  -4.994
   89    HA   CYS  11           HA       CYS  11  -5.721   6.569  -2.991
   90    HB2  CYS  11           HB2      CYS  11  -6.280   5.653  -5.179
   91    HB3  CYS  11           HB3      CYS  11  -5.186   6.789  -5.963
   92    H    VAL  12           H        VAL  12  -3.782   6.712  -2.030
   93    HA   VAL  12           HA       VAL  12  -2.104   8.985  -2.282
   94    HB   VAL  12           HB       VAL  12  -0.438   7.639  -0.968
   95   HG11  VAL  12          HG11      VAL  12  -3.244   7.818   0.095
   96   HG12  VAL  12          HG12      VAL  12  -1.951   9.008   0.258
   97   HG13  VAL  12          HG13      VAL  12  -1.830   7.451   1.084
   98   HG21  VAL  12          HG21      VAL  12  -2.585   5.533  -1.097
   99   HG22  VAL  12          HG22      VAL  12  -1.194   5.495  -0.015
  100   HG23  VAL  12          HG23      VAL  12  -0.954   5.427  -1.760
  101    H    ILE  13           H        ILE  13  -2.343   6.054  -4.005
  102    HA   ILE  13           HA       ILE  13   0.414   6.068  -4.920
  103    HB   ILE  13           HB       ILE  13  -1.773   4.181  -5.727
  104   HG12  ILE  13          HG12      ILE  13  -1.502   4.126  -3.308
  105   HG13  ILE  13          HG13      ILE  13  -0.900   2.647  -4.049
  106   HG21  ILE  13          HG21      ILE  13   0.146   4.219  -7.214
  107   HG22  ILE  13          HG22      ILE  13   0.073   2.700  -6.321
  108   HG23  ILE  13          HG23      ILE  13   1.222   3.949  -5.843
  109   HD11  ILE  13          HD11      ILE  13   1.338   3.353  -3.814
  110   HD12  ILE  13          HD12      ILE  13   0.518   3.558  -2.257
  111   HD13  ILE  13          HD13      ILE  13   0.828   4.957  -3.283
  112    H    CYS  14           H        CYS  14  -2.793   5.947  -6.361
  113    HA   CYS  14           HA       CYS  14  -1.628   6.725  -8.892
  114    HB2  CYS  14           HB2      CYS  14  -4.416   5.781  -8.524
  115    HB3  CYS  14           HB3      CYS  14  -3.370   5.610  -9.916
  116    H    ASP  15           H        ASP  15  -2.804   8.233  -6.359
  117    HA   ASP  15           HA       ASP  15  -3.734  10.247  -5.887
  118    HB2  ASP  15           HB2      ASP  15  -2.528  10.923  -8.520
  119    HB3  ASP  15           HB3      ASP  15  -2.983  12.083  -7.298
  120    H    GLN  16           H        GLN  16  -5.708   8.641  -6.884
  121    HA   GLN  16           HA       GLN  16  -7.272  10.487  -8.519
  122    HB2  GLN  16           HB2      GLN  16  -6.139   8.510  -9.728
  123    HB3  GLN  16           HB3      GLN  16  -7.370   7.541  -9.017
  124    HG2  GLN  16           HG2      GLN  16  -8.119   8.090 -11.182
  125    HG3  GLN  16           HG3      GLN  16  -9.015   9.095 -10.067
  126   HE21  GLN  16          HE21      GLN  16  -5.740   9.784 -10.753
  127   HE22  GLN  16          HE22      GLN  16  -6.067  11.212 -11.633
  128    H    GLU  17           H        GLU  17  -9.510  10.189  -8.342
  129    HA   GLU  17           HA       GLU  17 -10.258   9.633  -5.627
  130    HB2  GLU  17           HB2      GLU  17 -11.840  10.699  -7.958
  131    HB3  GLU  17           HB3      GLU  17 -12.446  10.581  -6.320
  132    HG2  GLU  17           HG2      GLU  17 -10.779  12.105  -5.545
  133    HG3  GLU  17           HG3      GLU  17 -10.038  12.132  -7.132
  134    H    LYS  18           H        LYS  18 -10.291   7.566  -5.262
  135    HA   LYS  18           HA       LYS  18 -12.139   5.856  -6.803
  136    HB2  LYS  18           HB2      LYS  18 -10.122   4.548  -5.165
  137    HB3  LYS  18           HB3      LYS  18 -10.698   4.130  -6.738
  138    HG2  LYS  18           HG2      LYS  18  -8.689   6.261  -6.138
  139    HG3  LYS  18           HG3      LYS  18  -8.346   4.661  -6.789
  140    HD2  LYS  18           HD2      LYS  18 -10.304   6.278  -8.233
  141    HD3  LYS  18           HD3      LYS  18  -8.672   6.830  -8.281
  142    HE2  LYS  18           HE2      LYS  18  -8.962   5.473 -10.182
  143    HE3  LYS  18           HE3      LYS  18  -8.042   4.544  -9.022
  144    HZ1  LYS  18           HZ1      LYS  18 -10.921   4.247  -9.618
  145    HZ2  LYS  18           HZ2      LYS  18 -10.117   3.419  -8.384
  146    HZ3  LYS  18           HZ3      LYS  18  -9.690   3.152  -9.995
  147    H    ASN  19           H        ASN  19 -13.828   4.999  -5.678
  148    HA   ASN  19           HA       ASN  19 -13.688   5.156  -2.761
  149    HB2  ASN  19           HB2      ASN  19 -15.665   6.129  -3.865
  150    HB3  ASN  19           HB3      ASN  19 -16.057   4.549  -4.489
  151   HD21  ASN  19          HD21      ASN  19 -18.019   4.403  -3.465
  152   HD22  ASN  19          HD22      ASN  19 -18.164   4.227  -1.723
  153    H    ARG  20           H        ARG  20 -12.785   3.031  -5.017
  154    HA   ARG  20           HA       ARG  20 -13.423   0.727  -3.287
  155    HB2  ARG  20           HB2      ARG  20 -14.306   0.779  -5.746
  156    HB3  ARG  20           HB3      ARG  20 -12.644   0.411  -6.158
  157    HG2  ARG  20           HG2      ARG  20 -12.722  -1.625  -4.902
  158    HG3  ARG  20           HG3      ARG  20 -14.316  -1.220  -4.294
  159    HD2  ARG  20           HD2      ARG  20 -15.336  -1.479  -6.348
  160    HD3  ARG  20           HD3      ARG  20 -13.801  -1.412  -7.178
  161    HE   ARG  20           HE       ARG  20 -13.725  -3.641  -5.528
  162   HH11  ARG  20          HH11      ARG  20 -15.559  -2.529  -8.294
  163   HH12  ARG  20          HH12      ARG  20 -15.905  -4.130  -8.870
  164   HH21  ARG  20          HH21      ARG  20 -14.186  -5.747  -6.276
  165   HH22  ARG  20          HH22      ARG  20 -15.141  -5.964  -7.712
  166    H    GLY  21           H        GLY  21 -11.771  -0.027  -2.225
  167    HA2  GLY  21           HA2      GLY  21  -9.285  -0.804  -3.065
  168    HA3  GLY  21           HA3      GLY  21  -9.097   0.906  -2.672
  169    H    ILE  22           H        ILE  22  -7.718   0.387  -0.800
  170    HA   ILE  22           HA       ILE  22  -9.402  -0.478   1.443
  171    HB   ILE  22           HB       ILE  22  -7.703  -1.674   2.438
  172   HG12  ILE  22          HG12      ILE  22  -5.817  -0.106   0.717
  173   HG13  ILE  22          HG13      ILE  22  -6.083   0.084   2.412
  174   HG21  ILE  22          HG21      ILE  22  -7.213  -2.006  -0.519
  175   HG22  ILE  22          HG22      ILE  22  -8.341  -2.919   0.485
  176   HG23  ILE  22          HG23      ILE  22  -6.600  -3.099   0.724
  177   HD11  ILE  22          HD11      ILE  22  -5.157  -2.114   2.832
  178   HD12  ILE  22          HD12      ILE  22  -4.011  -1.069   1.991
  179   HD13  ILE  22          HD13      ILE  22  -4.879  -2.320   1.102
  180    H    HIS  23           H        HIS  23  -7.945   0.183   3.489
  181    HA   HIS  23           HA       HIS  23  -6.900   2.828   3.317
  182    HB2  HIS  23           HB2      HIS  23  -8.667   3.886   4.742
  183    HB3  HIS  23           HB3      HIS  23  -9.226   3.457   3.143
  184    HD1  HIS  23           HD1      HIS  23  -9.868   2.887   6.732
  185    HD2  HIS  23           HD2      HIS  23 -10.992   1.282   3.085
  186    HE1  HIS  23           HE1      HIS  23 -11.887   1.463   7.219
  187    HE2  HIS  23           HE2      HIS  23 -12.587   0.537   4.983
  188    H    LEU  24           H        LEU  24  -5.276   2.738   4.708
  189    HA   LEU  24           HA       LEU  24  -5.331   0.789   6.824
  190    HB2  LEU  24           HB2      LEU  24  -3.187   2.678   5.876
  191    HB3  LEU  24           HB3      LEU  24  -2.984   1.465   7.081
  192    HG   LEU  24           HG       LEU  24  -3.639   0.908   4.207
  193   HD11  LEU  24          HD11      LEU  24  -1.376  -0.001   4.101
  194   HD12  LEU  24          HD12      LEU  24  -1.091   0.512   5.763
  195   HD13  LEU  24          HD13      LEU  24  -1.362   1.714   4.503
  196   HD21  LEU  24          HD21      LEU  24  -3.078  -0.934   6.524
  197   HD22  LEU  24          HD22      LEU  24  -3.170  -1.436   4.834
  198   HD23  LEU  24          HD23      LEU  24  -4.597  -0.780   5.636
  199    H    TYR  25           H        TYR  25  -4.137   4.104   6.723
  200    HA   TYR  25           HA       TYR  25  -4.967   4.427   9.474
  201    HB2  TYR  25           HB2      TYR  25  -3.247   6.211   7.794
  202    HB3  TYR  25           HB3      TYR  25  -3.545   6.419   9.507
  203    HD1  TYR  25           HD1      TYR  25  -0.855   6.449   9.278
  204    HD2  TYR  25           HD2      TYR  25  -3.304   2.989   8.831
  205    HE1  TYR  25           HE1      TYR  25   1.072   5.016   9.762
  206    HE2  TYR  25           HE2      TYR  25  -1.380   1.554   9.293
  207    HH   TYR  25           HH       TYR  25   1.705   2.913  10.300
  208    H    THR  26           H        THR  26  -4.693   7.327   7.715
  209    HA   THR  26           HA       THR  26  -7.606   7.404   7.385
  210    HB   THR  26           HB       THR  26  -6.811   9.212   8.784
  211    HG1  THR  26           HG1      THR  26  -7.798   9.774   6.223
  212   HG21  THR  26          HG21      THR  26  -4.490   9.252   7.940
  213   HG22  THR  26          HG22      THR  26  -5.210  10.857   8.049
  214   HG23  THR  26          HG23      THR  26  -5.059  10.063   6.481
  215    H    LYS  27           H        LYS  27  -5.065   6.486   5.639
  216    HA   LYS  27           HA       LYS  27  -5.684   8.094   3.270
  217    HB2  LYS  27           HB2      LYS  27  -3.628   6.188   2.761
  218    HB3  LYS  27           HB3      LYS  27  -3.541   7.935   2.731
  219    HG2  LYS  27           HG2      LYS  27  -3.157   6.182   5.139
  220    HG3  LYS  27           HG3      LYS  27  -1.893   6.982   4.209
  221    HD2  LYS  27           HD2      LYS  27  -4.106   8.401   5.659
  222    HD3  LYS  27           HD3      LYS  27  -2.493   8.159   6.298
  223    HE2  LYS  27           HE2      LYS  27  -2.265   9.243   3.684
  224    HE3  LYS  27           HE3      LYS  27  -3.456  10.195   4.565
  225    HZ1  LYS  27           HZ1      LYS  27  -0.738   9.595   5.610
  226    HZ2  LYS  27           HZ2      LYS  27  -1.877  10.656   6.269
  227    HZ3  LYS  27           HZ3      LYS  27  -1.147  11.018   4.792
  228    H    PHE  28           H        PHE  28  -5.061   6.683   1.245
  229    HA   PHE  28           HA       PHE  28  -6.601   4.235   1.283
  230    HB2  PHE  28           HB2      PHE  28  -8.319   5.855   1.020
  231    HB3  PHE  28           HB3      PHE  28  -7.395   6.736  -0.189
  232    HD1  PHE  28           HD1      PHE  28  -7.494   6.196  -2.430
  233    HD2  PHE  28           HD2      PHE  28  -9.224   3.578   0.417
  234    HE1  PHE  28           HE1      PHE  28  -8.537   4.945  -4.236
  235    HE2  PHE  28           HE2      PHE  28 -10.265   2.286  -1.395
  236    HZ   PHE  28           HZ       PHE  28  -9.900   2.932  -3.758
  237    H    ILE  29           H        ILE  29  -5.176   2.920   0.378
  238    HA   ILE  29           HA       ILE  29  -3.986   3.597  -2.211
  239    HB   ILE  29           HB       ILE  29  -3.977   0.964  -0.687
  240   HG12  ILE  29          HG12      ILE  29  -1.380   1.709  -0.704
  241   HG13  ILE  29          HG13      ILE  29  -2.148   3.291  -0.610
  242   HG21  ILE  29          HG21      ILE  29  -2.302   0.205  -2.255
  243   HG22  ILE  29          HG22      ILE  29  -2.372   1.744  -3.112
  244   HG23  ILE  29          HG23      ILE  29  -3.783   0.674  -3.111
  245   HD11  ILE  29          HD11      ILE  29  -1.534   2.126   1.571
  246   HD12  ILE  29          HD12      ILE  29  -2.906   1.066   1.246
  247   HD13  ILE  29          HD13      ILE  29  -3.155   2.804   1.432
  248    H    CYS  30           H        CYS  30  -5.207   3.208  -4.066
  249    HA   CYS  30           HA       CYS  30  -7.712   1.926  -3.632
  250    HB2  CYS  30           HB2      CYS  30  -8.344   2.379  -5.882
  251    HB3  CYS  30           HB3      CYS  30  -7.607   3.791  -5.178
  252    H    LEU  31           H        LEU  31  -8.299   0.319  -5.587
  253    HA   LEU  31           HA       LEU  31  -7.440  -1.933  -4.193
  254    HB2  LEU  31           HB2      LEU  31  -9.126  -3.021  -5.402
  255    HB3  LEU  31           HB3      LEU  31  -9.700  -1.433  -5.068
  256    HG   LEU  31           HG       LEU  31  -8.816  -0.926  -7.488
  257   HD11  LEU  31          HD11      LEU  31  -9.403  -3.880  -7.643
  258   HD12  LEU  31          HD12      LEU  31  -7.825  -3.129  -7.875
  259   HD13  LEU  31          HD13      LEU  31  -9.133  -2.803  -9.012
  260   HD21  LEU  31          HD21      LEU  31 -11.104  -0.665  -6.775
  261   HD22  LEU  31          HD22      LEU  31 -11.367  -2.404  -6.882
  262   HD23  LEU  31          HD23      LEU  31 -11.059  -1.469  -8.344
  263    H    ASP  32           H        ASP  32  -6.160  -0.449  -6.916
  264    HA   ASP  32           HA       ASP  32  -5.321  -2.872  -8.266
  265    HB2  ASP  32           HB2      ASP  32  -4.666  -1.463 -10.051
  266    HB3  ASP  32           HB3      ASP  32  -6.123  -0.754  -9.394
  267    H    CYS  33           H        CYS  33  -3.891  -0.100  -6.802
  268    HA   CYS  33           HA       CYS  33  -1.219  -0.861  -6.858
  269    HB2  CYS  33           HB2      CYS  33  -1.216   0.972  -4.979
  270    HB3  CYS  33           HB3      CYS  33  -1.519   1.430  -6.646
  271    H    GLU  34           H        GLU  34  -3.856  -1.246  -4.713
  272    HA   GLU  34           HA       GLU  34  -2.512  -2.001  -2.407
  273    HB2  GLU  34           HB2      GLU  34  -4.900  -1.496  -2.432
  274    HB3  GLU  34           HB3      GLU  34  -5.202  -2.880  -3.437
  275    HG2  GLU  34           HG2      GLU  34  -3.897  -3.462  -0.902
  276    HG3  GLU  34           HG3      GLU  34  -5.535  -2.875  -0.794
  277    H    ARG  35           H        ARG  35  -3.714  -4.012  -5.063
  278    HA   ARG  35           HA       ARG  35  -2.329  -6.290  -4.051
  279    HB2  ARG  35           HB2      ARG  35  -2.859  -7.425  -6.150
  280    HB3  ARG  35           HB3      ARG  35  -4.276  -6.661  -5.454
  281    HG2  ARG  35           HG2      ARG  35  -3.942  -4.770  -7.045
  282    HG3  ARG  35           HG3      ARG  35  -2.674  -5.719  -7.802
  283    HD2  ARG  35           HD2      ARG  35  -5.531  -6.513  -7.529
  284    HD3  ARG  35           HD3      ARG  35  -4.758  -5.965  -9.003
  285    HE   ARG  35           HE       ARG  35  -3.296  -8.131  -8.155
  286   HH11  ARG  35          HH11      ARG  35  -6.620  -7.540  -9.078
  287   HH12  ARG  35          HH12      ARG  35  -6.886  -9.155  -9.648
  288   HH21  ARG  35          HH21      ARG  35  -3.633 -10.261  -8.918
  289   HH22  ARG  35          HH22      ARG  35  -5.185 -10.704  -9.558
  290    H    LYS  36           H        LYS  36  -1.346  -3.618  -5.903
  291    HA   LYS  36           HA       LYS  36   0.705  -4.801  -7.441
  292    HB2  LYS  36           HB2      LYS  36   0.415  -1.995  -6.490
  293    HB3  LYS  36           HB3      LYS  36   1.607  -2.518  -7.646
  294    HG2  LYS  36           HG2      LYS  36  -0.368  -3.255  -9.045
  295    HG3  LYS  36           HG3      LYS  36  -1.356  -2.368  -7.958
  296    HD2  LYS  36           HD2      LYS  36  -0.254  -0.409  -8.542
  297    HD3  LYS  36           HD3      LYS  36   0.952  -1.242  -9.488
  298    HE2  LYS  36           HE2      LYS  36  -0.862  -2.023 -10.975
  299    HE3  LYS  36           HE3      LYS  36  -2.003  -1.048 -10.054
  300    HZ1  LYS  36           HZ1      LYS  36  -0.831   0.927 -10.707
  301    HZ2  LYS  36           HZ2      LYS  36  -1.245   0.043 -12.090
  302    HZ3  LYS  36           HZ3      LYS  36   0.346   0.017 -11.516
  303    H    VAL  37           H        VAL  37   0.464  -3.304  -4.349
  304    HA   VAL  37           HA       VAL  37   3.122  -3.125  -3.672
  305    HB   VAL  37           HB       VAL  37   2.421  -3.129  -1.341
  306   HG11  VAL  37          HG11      VAL  37   0.385  -1.567  -2.899
  307   HG12  VAL  37          HG12      VAL  37   2.093  -1.113  -2.853
  308   HG13  VAL  37          HG13      VAL  37   1.147  -1.139  -1.363
  309   HG21  VAL  37          HG21      VAL  37  -0.091  -4.208  -2.470
  310   HG22  VAL  37          HG22      VAL  37  -0.149  -3.181  -1.035
  311   HG23  VAL  37          HG23      VAL  37   0.805  -4.667  -1.012
  312    H    ILE  38           H        ILE  38   0.860  -5.704  -3.056
  313    HA   ILE  38           HA       ILE  38   2.478  -7.470  -1.623
  314    HB   ILE  38           HB       ILE  38   0.397  -8.424  -3.573
  315   HG12  ILE  38          HG12      ILE  38  -0.085  -6.893  -1.039
  316   HG13  ILE  38          HG13      ILE  38  -0.730  -6.574  -2.630
  317   HG21  ILE  38          HG21      ILE  38   1.268  -9.321  -0.846
  318   HG22  ILE  38          HG22      ILE  38   1.508 -10.150  -2.382
  319   HG23  ILE  38          HG23      ILE  38  -0.113  -9.994  -1.707
  320   HD11  ILE  38          HD11      ILE  38  -1.430  -9.083  -1.167
  321   HD12  ILE  38          HD12      ILE  38  -2.288  -8.287  -2.485
  322   HD13  ILE  38          HD13      ILE  38  -2.290  -7.574  -0.869
  323    H    SER  39           H        SER  39   1.901  -6.809  -4.940
  324    HA   SER  39           HA       SER  39   3.295  -9.075  -5.891
  325    HB2  SER  39           HB2      SER  39   1.432  -8.023  -7.152
  326    HB3  SER  39           HB3      SER  39   2.452  -6.613  -7.425
  327    HG   SER  39           HG       SER  39   3.365  -9.166  -8.173
  328    H    THR  40           H        THR  40   4.172  -6.005  -4.827
  329    HA   THR  40           HA       THR  40   6.655  -5.798  -6.281
  330    HB   THR  40           HB       THR  40   5.618  -4.220  -3.915
  331    HG1  THR  40           HG1      THR  40   4.389  -4.110  -5.941
  332   HG21  THR  40          HG21      THR  40   8.047  -4.045  -4.135
  333   HG22  THR  40          HG22      THR  40   7.259  -2.528  -4.569
  334   HG23  THR  40          HG23      THR  40   7.868  -3.598  -5.832
  335    H    SER  41           H        SER  41   5.624  -6.582  -2.976
  336    HA   SER  41           HA       SER  41   8.360  -6.758  -2.068
  337    HB2  SER  41           HB2      SER  41   7.208  -7.293   0.131
  338    HB3  SER  41           HB3      SER  41   6.849  -5.715  -0.572
  339    HG   SER  41           HG       SER  41   4.903  -6.577  -0.007
  340    H    THR  42           H        THR  42   5.650  -9.021  -2.529
  341    HA   THR  42           HA       THR  42   6.937 -11.112  -1.094
  342    HB   THR  42           HB       THR  42   5.118 -12.553  -1.879
  343    HG1  THR  42           HG1      THR  42   4.092 -10.318  -3.308
  344   HG21  THR  42          HG21      THR  42   4.720 -11.097   0.040
  345   HG22  THR  42          HG22      THR  42   3.248 -11.278  -0.914
  346   HG23  THR  42          HG23      THR  42   4.201  -9.800  -1.037
  347    H    SER  43           H        SER  43   7.402  -9.966  -4.232
  348    HA   SER  43           HA       SER  43   8.487 -12.536  -5.128
  349    HB2  SER  43           HB2      SER  43   8.652 -11.289  -7.357
  350    HB3  SER  43           HB3      SER  43   7.030 -11.651  -6.767
  351    HG   SER  43           HG       SER  43   8.401  -9.196  -6.828
  352    H    ASP  44           H        ASP  44   9.559 -10.108  -3.357
  353    HA   ASP  44           HA       ASP  44  12.298 -10.498  -4.230
  354    HB2  ASP  44           HB2      ASP  44  11.451  -8.477  -5.473
  355    HB3  ASP  44           HB3      ASP  44  11.222  -7.691  -3.915
  356    HA   PRO  45           HA       PRO  45  11.910 -10.449   0.289
  357    HB2  PRO  45           HB2      PRO  45  13.521 -12.525   0.764
  358    HB3  PRO  45           HB3      PRO  45  11.936 -12.761   0.096
  359    HG2  PRO  45           HG2      PRO  45  14.487 -12.809  -1.226
  360    HG3  PRO  45           HG3      PRO  45  13.117 -13.850  -1.488
  361    HD2  PRO  45           HD2      PRO  45  13.804 -11.689  -3.081
  362    HD3  PRO  45           HD3      PRO  45  12.194 -12.414  -2.967
  363    H    ASP  46           H        ASP  46  13.880  -8.833  -1.386
  364    HA   ASP  46           HA       ASP  46  16.366  -9.020   0.058
  365    HB2  ASP  46           HB2      ASP  46  15.972  -8.186  -2.387
  366    HB3  ASP  46           HB3      ASP  46  15.579  -6.651  -1.619
  367    H    TYR  47           H        TYR  47  17.172  -6.649   0.816
  368    HA   TYR  47           HA       TYR  47  17.240  -5.438   2.693
  369    HB2  TYR  47           HB2      TYR  47  14.456  -4.733   1.836
  370    HB3  TYR  47           HB3      TYR  47  15.512  -3.795   2.865
  371    HD1  TYR  47           HD1      TYR  47  17.781  -3.062   1.856
  372    HD2  TYR  47           HD2      TYR  47  14.444  -4.314  -0.464
  373    HE1  TYR  47           HE1      TYR  47  18.723  -1.920  -0.104
  374    HE2  TYR  47           HE2      TYR  47  15.378  -3.174  -2.433
  375    HH   TYR  47           HH       TYR  47  18.573  -2.066  -2.565
  376    H    ALA  48           H        ALA  48  17.130  -7.701   3.688
  377    HA   ALA  48           HA       ALA  48  14.885  -7.787   5.589
  378    HB1  ALA  48           HB1      ALA  48  16.625 -10.064   4.646
  379    HB2  ALA  48           HB2      ALA  48  14.970  -9.747   4.130
  380    HB3  ALA  48           HB3      ALA  48  15.303 -10.182   5.806
  381    H1   SER   0           H1       SER   0  -1.875  19.267  -3.697
  382    H2   SER   0           H2       SER   0  -1.567  18.565  -5.202
  383    H3   SER   0           H3       SER   0  -3.007  19.406  -4.941
  384    HA   SER   0           HA       SER   0  -1.523  20.738  -6.231
  385    HB2  SER   0           HB2      SER   0  -1.370  22.703  -4.616
  386    HB3  SER   0           HB3      SER   0  -2.969  21.989  -4.813
  387    HG   SER   0           HG       SER   0  -2.635  22.233  -2.639
  388    H    MET   1           H        MET   1  -0.112  19.968  -3.047
  389    HA   MET   1           HA       MET   1   2.470  20.965  -3.877
  390    HB2  MET   1           HB2      MET   1   1.573  19.586  -1.343
  391    HB3  MET   1           HB3      MET   1   3.202  20.186  -1.617
  392    HG2  MET   1           HG2      MET   1   0.675  21.812  -1.496
  393    HG3  MET   1           HG3      MET   1   1.970  21.768  -0.299
  394    HE1  MET   1           HE1      MET   1   4.544  21.700  -2.280
  395    HE2  MET   1           HE2      MET   1   4.447  22.646  -0.795
  396    HE3  MET   1           HE3      MET   1   4.930  23.422  -2.302
  397    H    ASP   2           H        ASP   2   3.002  19.625  -5.607
  398    HA   ASP   2           HA       ASP   2   3.241  16.770  -5.183
  399    HB2  ASP   2           HB2      ASP   2   2.546  17.632  -7.387
  400    HB3  ASP   2           HB3      ASP   2   4.086  18.472  -7.540
  401    H    GLU   3           H        GLU   3   4.848  16.154  -3.893
  402    HA   GLU   3           HA       GLU   3   7.563  16.826  -4.638
  403    HB2  GLU   3           HB2      GLU   3   6.847  18.581  -2.996
  404    HB3  GLU   3           HB3      GLU   3   6.640  17.298  -1.809
  405    HG2  GLU   3           HG2      GLU   3   8.786  18.486  -1.626
  406    HG3  GLU   3           HG3      GLU   3   8.969  16.757  -1.895
  407    H    THR   4           H        THR   4   9.039  15.276  -4.014
  408    HA   THR   4           HA       THR   4   8.030  13.007  -2.455
  409    HB   THR   4           HB       THR   4   9.320  11.543  -4.178
  410    HG1  THR   4           HG1      THR   4   8.597  13.742  -5.846
  411   HG21  THR   4          HG21      THR   4   6.912  11.394  -3.809
  412   HG22  THR   4          HG22      THR   4   7.283  11.277  -5.530
  413   HG23  THR   4          HG23      THR   4   6.652  12.784  -4.864
  414    H    VAL   5           H        VAL   5   9.539  12.032  -1.171
  415    HA   VAL   5           HA       VAL   5  12.084  13.423  -0.924
  416    HB   VAL   5           HB       VAL   5  10.927  11.251   0.833
  417   HG11  VAL   5          HG11      VAL   5  13.340  11.448   1.042
  418   HG12  VAL   5          HG12      VAL   5  12.545  12.065   2.491
  419   HG13  VAL   5          HG13      VAL   5  13.191  13.188   1.294
  420   HG21  VAL   5          HG21      VAL   5   9.483  13.216   0.798
  421   HG22  VAL   5          HG22      VAL   5  10.862  14.247   1.177
  422   HG23  VAL   5          HG23      VAL   5  10.297  13.061   2.354
  423    H    LYS   6           H        LYS   6  14.010  12.592  -1.461
  424    HA   LYS   6           HA       LYS   6  13.974  10.148  -3.022
  425    HB2  LYS   6           HB2      LYS   6  14.957  12.226  -3.920
  426    HB3  LYS   6           HB3      LYS   6  16.164  12.153  -2.662
  427    HG2  LYS   6           HG2      LYS   6  17.038  10.089  -3.551
  428    HG3  LYS   6           HG3      LYS   6  15.780  10.092  -4.784
  429    HD2  LYS   6           HD2      LYS   6  16.658  12.211  -5.652
  430    HD3  LYS   6           HD3      LYS   6  17.936  12.166  -4.445
  431    HE2  LYS   6           HE2      LYS   6  18.791  10.124  -5.415
  432    HE3  LYS   6           HE3      LYS   6  17.481  10.099  -6.587
  433    HZ1  LYS   6           HZ1      LYS   6  18.312  12.192  -7.482
  434    HZ2  LYS   6           HZ2      LYS   6  19.494  10.984  -7.562
  435    HZ3  LYS   6           HZ3      LYS   6  19.589  12.179  -6.371
  436    H    LEU   7           H        LEU   7  15.418  11.350  -0.047
  437    HA   LEU   7           HA       LEU   7  17.196   9.106   0.193
  438    HB2  LEU   7           HB2      LEU   7  17.839  11.250   1.110
  439    HB3  LEU   7           HB3      LEU   7  16.470  11.213   2.173
  440    HG   LEU   7           HG       LEU   7  17.452   9.134   3.215
  441   HD11  LEU   7          HD11      LEU   7  18.924   8.557   1.393
  442   HD12  LEU   7          HD12      LEU   7  19.847   8.810   2.873
  443   HD13  LEU   7          HD13      LEU   7  19.823  10.052   1.622
  444   HD21  LEU   7          HD21      LEU   7  17.557  11.297   4.316
  445   HD22  LEU   7          HD22      LEU   7  19.002  11.712   3.396
  446   HD23  LEU   7          HD23      LEU   7  19.052  10.398   4.572
  447    H    ASN   8           H        ASN   8  15.486   9.872   3.111
  448    HA   ASN   8           HA       ASN   8  14.319   7.223   3.193
  449    HB2  ASN   8           HB2      ASN   8  13.824   9.549   5.054
  450    HB3  ASN   8           HB3      ASN   8  13.417   7.889   5.368
  451   HD21  ASN   8          HD21      ASN   8  14.977   9.586   6.995
  452   HD22  ASN   8          HD22      ASN   8  16.550   8.887   7.113
  453    H    HIS   9           H        HIS   9  12.807   7.107   1.611
  454    HA   HIS   9           HA       HIS   9  11.158   9.152   0.706
  455    HB2  HIS   9           HB2      HIS   9  10.410   6.224   0.762
  456    HB3  HIS   9           HB3      HIS   9   9.843   7.444  -0.366
  457    HD1  HIS   9           HD1      HIS   9  11.935   8.502  -1.894
  458    HD2  HIS   9           HD2      HIS   9  12.441   4.740  -0.193
  459    HE1  HIS   9           HE1      HIS   9  13.788   7.407  -3.196
  460    HE2  HIS   9           HE2      HIS   9  13.989   5.093  -2.232
  461    H    THR  10           H        THR  10   9.545  10.212   1.727
  462    HA   THR  10           HA       THR  10   8.590   9.320   4.248
  463    HB   THR  10           HB       THR  10   7.446  11.446   2.392
  464    HG1  THR  10           HG1      THR  10   8.695  12.276   4.679
  465   HG21  THR  10          HG21      THR  10   5.777  10.675   4.021
  466   HG22  THR  10          HG22      THR  10   6.305  12.318   4.376
  467   HG23  THR  10          HG23      THR  10   6.918  10.971   5.333
  468    H    CYS  11           H        CYS  11   7.034   7.989   4.723
  469    HA   CYS  11           HA       CYS  11   5.755   6.476   2.728
  470    HB2  CYS  11           HB2      CYS  11   6.298   5.559   4.921
  471    HB3  CYS  11           HB3      CYS  11   5.229   6.718   5.700
  472    H    VAL  12           H        VAL  12   3.818   6.651   1.769
  473    HA   VAL  12           HA       VAL  12   2.180   8.954   2.016
  474    HB   VAL  12           HB       VAL  12   0.489   7.633   0.707
  475   HG11  VAL  12          HG11      VAL  12   3.296   7.759  -0.359
  476   HG12  VAL  12          HG12      VAL  12   2.023   8.972  -0.525
  477   HG13  VAL  12          HG13      VAL  12   1.874   7.414  -1.345
  478   HG21  VAL  12          HG21      VAL  12   2.598   5.490   0.841
  479   HG22  VAL  12          HG22      VAL  12   1.205   5.474  -0.241
  480   HG23  VAL  12          HG23      VAL  12   0.967   5.415   1.506
  481    H    ILE  13           H        ILE  13   2.371   6.025   3.748
  482    HA   ILE  13           HA       ILE  13  -0.385   6.091   4.663
  483    HB   ILE  13           HB       ILE  13   1.769   4.169   5.476
  484   HG12  ILE  13          HG12      ILE  13   1.494   4.109   3.058
  485   HG13  ILE  13          HG13      ILE  13   0.867   2.644   3.805
  486   HG21  ILE  13          HG21      ILE  13  -0.147   4.243   6.964
  487   HG22  ILE  13          HG22      ILE  13  -0.103   2.721   6.076
  488   HG23  ILE  13          HG23      ILE  13  -1.229   3.989   5.596
  489   HD11  ILE  13          HD11      ILE  13  -1.359   3.389   3.570
  490   HD12  ILE  13          HD12      ILE  13  -0.538   3.572   2.011
  491   HD13  ILE  13          HD13      ILE  13  -0.821   4.980   3.033
  492    H    CYS  14           H        CYS  14   2.822   5.932   6.092
  493    HA   CYS  14           HA       CYS  14   1.657   6.733   8.630
  494    HB2  CYS  14           HB2      CYS  14   4.425   5.724   8.285
  495    HB3  CYS  14           HB3      CYS  14   3.380   5.577   9.677
  496    H    ASP  15           H        ASP  15   2.875   8.202   6.097
  497    HA   ASP  15           HA       ASP  15   3.838  10.197   5.616
  498    HB2  ASP  15           HB2      ASP  15   2.651  10.906   8.248
  499    HB3  ASP  15           HB3      ASP  15   3.132  12.054   7.022
  500    H    GLN  16           H        GLN  16   5.785   8.561   6.611
  501    HA   GLN  16           HA       GLN  16   7.384  10.383   8.238
  502    HB2  GLN  16           HB2      GLN  16   6.219   8.432   9.456
  503    HB3  GLN  16           HB3      GLN  16   7.428   7.437   8.743
  504    HG2  GLN  16           HG2      GLN  16   8.193   7.978  10.905
  505    HG3  GLN  16           HG3      GLN  16   9.106   8.964   9.787
  506   HE21  GLN  16          HE21      GLN  16   5.847   9.717  10.472
  507   HE22  GLN  16          HE22      GLN  16   6.201  11.137  11.356
  508    H    GLU  17           H        GLU  17   9.616  10.046   8.057
  509    HA   GLU  17           HA       GLU  17  10.350   9.469   5.343
  510    HB2  GLU  17           HB2      GLU  17  11.955  10.511   7.670
  511    HB3  GLU  17           HB3      GLU  17  12.556  10.382   6.032
  512    HG2  GLU  17           HG2      GLU  17  10.914  11.933   5.260
  513    HG3  GLU  17           HG3      GLU  17  10.178  11.969   6.849
  514    H    LYS  18           H        LYS  18  10.347   7.400   4.986
  515    HA   LYS  18           HA       LYS  18  12.165   5.662   6.531
  516    HB2  LYS  18           HB2      LYS  18  10.123   4.385   4.900
  517    HB3  LYS  18           HB3      LYS  18  10.695   3.961   6.474
  518    HG2  LYS  18           HG2      LYS  18   8.724   6.127   5.869
  519    HG3  LYS  18           HG3      LYS  18   8.352   4.535   6.527
  520    HD2  LYS  18           HD2      LYS  18  10.343   6.122   7.963
  521    HD3  LYS  18           HD3      LYS  18   8.720   6.702   8.011
  522    HE2  LYS  18           HE2      LYS  18   8.986   5.345   9.915
  523    HE3  LYS  18           HE3      LYS  18   8.050   4.430   8.757
  524    HZ1  LYS  18           HZ1      LYS  18  10.924   4.083   9.356
  525    HZ2  LYS  18           HZ2      LYS  18  10.105   3.262   8.125
  526    HZ3  LYS  18           HZ3      LYS  18   9.672   3.013   9.737
  527    H    ASN  19           H        ASN  19  13.835   4.770   5.405
  528    HA   ASN  19           HA       ASN  19  13.696   4.923   2.489
  529    HB2  ASN  19           HB2      ASN  19  15.693   5.864   3.585
  530    HB3  ASN  19           HB3      ASN  19  16.056   4.278   4.215
  531   HD21  ASN  19          HD21      ASN  19  18.012   4.087   3.184
  532   HD22  ASN  19          HD22      ASN  19  18.150   3.907   1.442
  533    H    ARG  20           H        ARG  20  12.757   2.822   4.749
  534    HA   ARG  20           HA       ARG  20  13.352   0.499   3.032
  535    HB2  ARG  20           HB2      ARG  20  14.238   0.548   5.492
  536    HB3  ARG  20           HB3      ARG  20  12.569   0.207   5.904
  537    HG2  ARG  20           HG2      ARG  20  12.614  -1.834   4.656
  538    HG3  ARG  20           HG3      ARG  20  14.213  -1.456   4.044
  539    HD2  ARG  20           HD2      ARG  20  15.234  -1.730   6.095
  540    HD3  ARG  20           HD3      ARG  20  13.702  -1.634   6.930
  541    HE   ARG  20           HE       ARG  20  13.583  -3.864   5.284
  542   HH11  ARG  20          HH11      ARG  20  15.432  -2.786   8.051
  543   HH12  ARG  20          HH12      ARG  20  15.766  -4.391   8.614
  544   HH21  ARG  20          HH21      ARG  20  14.005  -5.981   6.034
  545   HH22  ARG  20          HH22      ARG  20  14.959  -6.209   7.467
  546    H    GLY  21           H        GLY  21  11.689  -0.224   1.971
  547    HA2  GLY  21           HA2      GLY  21   9.189  -0.958   2.819
  548    HA3  GLY  21           HA3      GLY  21   9.029   0.754   2.421
  549    H    ILE  22           H        ILE  22   7.639   0.255   0.551
  550    HA   ILE  22           HA       ILE  22   9.304  -0.648  -1.687
  551    HB   ILE  22           HB       ILE  22   7.584  -1.817  -2.679
  552   HG12  ILE  22          HG12      ILE  22   5.728  -0.211  -0.960
  553   HG13  ILE  22          HG13      ILE  22   5.994  -0.031  -2.655
  554   HG21  ILE  22          HG21      ILE  22   7.091  -2.132   0.280
  555   HG22  ILE  22          HG22      ILE  22   8.202  -3.068  -0.723
  556   HG23  ILE  22          HG23      ILE  22   6.458  -3.217  -0.959
  557   HD11  ILE  22          HD11      ILE  22   5.029  -2.214  -3.067
  558   HD12  ILE  22          HD12      ILE  22   3.903  -1.146  -2.228
  559   HD13  ILE  22          HD13      ILE  22   4.750  -2.409  -1.336
  560    H    HIS  23           H        HIS  23   7.861   0.027  -3.738
  561    HA   HIS  23           HA       HIS  23   6.860   2.692  -3.574
  562    HB2  HIS  23           HB2      HIS  23   8.644   3.714  -5.004
  563    HB3  HIS  23           HB3      HIS  23   9.197   3.281  -3.404
  564    HD1  HIS  23           HD1      HIS  23   9.823   2.680  -6.989
  565    HD2  HIS  23           HD2      HIS  23  10.919   1.070  -3.343
  566    HE1  HIS  23           HE1      HIS  23  11.820   1.235  -7.475
  567    HE2  HIS  23           HE2      HIS  23  12.511   0.309  -5.235
  568    H    LEU  24           H        LEU  24   5.231   2.627  -4.960
  569    HA   LEU  24           HA       LEU  24   5.248   0.674  -7.072
  570    HB2  LEU  24           HB2      LEU  24   3.141   2.604  -6.123
  571    HB3  LEU  24           HB3      LEU  24   2.912   1.392  -7.325
  572    HG   LEU  24           HG       LEU  24   3.564   0.832  -4.450
  573   HD11  LEU  24          HD11      LEU  24   1.284  -0.038  -4.338
  574   HD12  LEU  24          HD12      LEU  24   1.006   0.474  -6.001
  575   HD13  LEU  24          HD13      LEU  24   1.300   1.675  -4.746
  576   HD21  LEU  24          HD21      LEU  24   2.969  -1.009  -6.760
  577   HD22  LEU  24          HD22      LEU  24   3.053  -1.508  -5.070
  578   HD23  LEU  24          HD23      LEU  24   4.490  -0.878  -5.874
  579    H    TYR  25           H        TYR  25   4.110   4.009  -6.979
  580    HA   TYR  25           HA       TYR  25   4.945   4.307  -9.730
  581    HB2  TYR  25           HB2      TYR  25   3.262   6.126  -8.054
  582    HB3  TYR  25           HB3      TYR  25   3.564   6.323  -9.766
  583    HD1  TYR  25           HD1      TYR  25   0.906   6.407  -9.551
  584    HD2  TYR  25           HD2      TYR  25   3.260   2.898  -9.077
  585    HE1  TYR  25           HE1      TYR  25  -1.064   5.012 -10.026
  586    HE2  TYR  25           HE2      TYR  25   1.307   1.501  -9.527
  587    HH   TYR  25           HH       TYR  25  -1.751   2.911 -10.539
  588    H    THR  26           H        THR  26   4.727   7.217  -7.982
  589    HA   THR  26           HA       THR  26   7.641   7.245  -7.657
  590    HB   THR  26           HB       THR  26   6.870   9.059  -9.060
  591    HG1  THR  26           HG1      THR  26   7.871   9.627  -6.503
  592   HG21  THR  26          HG21      THR  26   4.551   9.145  -8.211
  593   HG22  THR  26          HG22      THR  26   5.302  10.735  -8.326
  594   HG23  THR  26          HG23      THR  26   5.141   9.950  -6.756
  595    H    LYS  27           H        LYS  27   5.085   6.379  -5.903
  596    HA   LYS  27           HA       LYS  27   5.734   7.983  -3.540
  597    HB2  LYS  27           HB2      LYS  27   3.646   6.115  -3.023
  598    HB3  LYS  27           HB3      LYS  27   3.591   7.862  -2.998
  599    HG2  LYS  27           HG2      LYS  27   3.172   6.112  -5.399
  600    HG3  LYS  27           HG3      LYS  27   1.926   6.938  -4.471
  601    HD2  LYS  27           HD2      LYS  27   4.162   8.312  -5.928
  602    HD3  LYS  27           HD3      LYS  27   2.544   8.097  -6.568
  603    HE2  LYS  27           HE2      LYS  27   2.338   9.192  -3.953
  604    HE3  LYS  27           HE3      LYS  27   3.539  10.126  -4.841
  605    HZ1  LYS  27           HZ1      LYS  27   0.808   9.558  -5.875
  606    HZ2  LYS  27           HZ2      LYS  27   1.958  10.594  -6.548
  607    HZ3  LYS  27           HZ3      LYS  27   1.238  10.981  -5.073
  608    H    PHE  28           H        PHE  28   5.089   6.587  -1.507
  609    HA   PHE  28           HA       PHE  28   6.586   4.114  -1.541
  610    HB2  PHE  28           HB2      PHE  28   8.333   5.703  -1.285
  611    HB3  PHE  28           HB3      PHE  28   7.427   6.604  -0.078
  612    HD1  PHE  28           HD1      PHE  28   7.520   6.071   2.164
  613    HD2  PHE  28           HD2      PHE  28   9.199   3.413  -0.677
  614    HE1  PHE  28           HE1      PHE  28   8.543   4.808   3.973
  615    HE2  PHE  28           HE2      PHE  28  10.221   2.109   1.136
  616    HZ   PHE  28           HZ       PHE  28   9.870   2.767   3.499
  617    H    ILE  29           H        ILE  29   5.140   2.827  -0.630
  618    HA   ILE  29           HA       ILE  29   3.967   3.532   1.959
  619    HB   ILE  29           HB       ILE  29   3.908   0.895   0.442
  620   HG12  ILE  29          HG12      ILE  29   1.326   1.688   0.460
  621   HG13  ILE  29          HG13      ILE  29   2.121   3.255   0.361
  622   HG21  ILE  29          HG21      ILE  29   2.223   0.171   2.017
  623   HG22  ILE  29          HG22      ILE  29   2.322   1.714   2.866
  624   HG23  ILE  29          HG23      ILE  29   3.713   0.617   2.868
  625   HD11  ILE  29          HD11      ILE  29   1.485   2.094  -1.815
  626   HD12  ILE  29          HD12      ILE  29   2.838   1.012  -1.489
  627   HD13  ILE  29          HD13      ILE  29   3.118   2.743  -1.680
  628    H    CYS  30           H        CYS  30   5.183   3.130   3.814
  629    HA   CYS  30           HA       CYS  30   7.664   1.802   3.379
  630    HB2  CYS  30           HB2      CYS  30   8.308   2.249   5.628
  631    HB3  CYS  30           HB3      CYS  30   7.597   3.673   4.920
  632    H    LEU  31           H        LEU  31   8.226   0.191   5.335
  633    HA   LEU  31           HA       LEU  31   7.325  -2.051   3.953
  634    HB2  LEU  31           HB2      LEU  31   8.993  -3.163   5.164
  635    HB3  LEU  31           HB3      LEU  31   9.595  -1.587   4.823
  636    HG   LEU  31           HG       LEU  31   8.722  -1.056   7.243
  637   HD11  LEU  31          HD11      LEU  31   9.259  -4.019   7.407
  638   HD12  LEU  31          HD12      LEU  31   7.696  -3.238   7.640
  639   HD13  LEU  31          HD13      LEU  31   9.012  -2.931   8.773
  640   HD21  LEU  31          HD21      LEU  31  11.012  -0.836   6.525
  641   HD22  LEU  31          HD22      LEU  31  11.249  -2.579   6.637
  642   HD23  LEU  31          HD23      LEU  31  10.957  -1.633   8.097
  643    H    ASP  32           H        ASP  32   6.074  -0.533   6.672
  644    HA   ASP  32           HA       ASP  32   5.195  -2.940   8.031
  645    HB2  ASP  32           HB2      ASP  32   4.568  -1.514   9.813
  646    HB3  ASP  32           HB3      ASP  32   6.036  -0.830   9.151
  647    H    CYS  33           H        CYS  33   3.812  -0.146   6.560
  648    HA   CYS  33           HA       CYS  33   1.127  -0.860   6.622
  649    HB2  CYS  33           HB2      CYS  33   1.156   0.967   4.737
  650    HB3  CYS  33           HB3      CYS  33   1.465   1.425   6.403
  651    H    GLU  34           H        GLU  34   3.754  -1.299   4.474
  652    HA   GLU  34           HA       GLU  34   2.393  -2.037   2.174
  653    HB2  GLU  34           HB2      GLU  34   4.790  -1.574   2.194
  654    HB3  GLU  34           HB3      GLU  34   5.069  -2.960   3.203
  655    HG2  GLU  34           HG2      GLU  34   3.752  -3.526   0.672
  656    HG3  GLU  34           HG3      GLU  34   5.401  -2.970   0.561
  657    H    ARG  35           H        ARG  35   3.564  -4.061   4.834
  658    HA   ARG  35           HA       ARG  35   2.137  -6.317   3.832
  659    HB2  ARG  35           HB2      ARG  35   2.650  -7.455   5.933
  660    HB3  ARG  35           HB3      ARG  35   4.078  -6.717   5.234
  661    HG2  ARG  35           HG2      ARG  35   3.780  -4.818   6.820
  662    HG3  ARG  35           HG3      ARG  35   2.495  -5.741   7.581
  663    HD2  ARG  35           HD2      ARG  35   5.334  -6.589   7.305
  664    HD3  ARG  35           HD3      ARG  35   4.577  -6.021   8.778
  665    HE   ARG  35           HE       ARG  35   3.071  -8.163   7.946
  666   HH11  ARG  35          HH11      ARG  35   6.412  -7.626   8.859
  667   HH12  ARG  35          HH12      ARG  35   6.648  -9.242   9.440
  668   HH21  ARG  35          HH21      ARG  35   3.381 -10.298   8.713
  669   HH22  ARG  35          HH22      ARG  35   4.923 -10.766   9.351
  670    H    LYS  36           H        LYS  36   1.205  -3.621   5.677
  671    HA   LYS  36           HA       LYS  36  -0.864  -4.763   7.222
  672    HB2  LYS  36           HB2      LYS  36  -0.525  -1.965   6.261
  673    HB3  LYS  36           HB3      LYS  36  -1.725  -2.463   7.420
  674    HG2  LYS  36           HG2      LYS  36   0.238  -3.232   8.818
  675    HG3  LYS  36           HG3      LYS  36   1.242  -2.367   7.728
  676    HD2  LYS  36           HD2      LYS  36   0.173  -0.387   8.307
  677    HD3  LYS  36           HD3      LYS  36  -1.042  -1.195   9.259
  678    HE2  LYS  36           HE2      LYS  36   0.759  -2.002  10.746
  679    HE3  LYS  36           HE3      LYS  36   1.917  -1.054   9.818
  680    HZ1  LYS  36           HZ1      LYS  36   0.784   0.945  10.464
  681    HZ2  LYS  36           HZ2      LYS  36   1.184   0.058  11.849
  682    HZ3  LYS  36           HZ3      LYS  36  -0.406   0.060  11.280
  683    H    VAL  37           H        VAL  37  -0.600  -3.281   4.124
  684    HA   VAL  37           HA       VAL  37  -3.256  -3.057   3.450
  685    HB   VAL  37           HB       VAL  37  -2.560  -3.082   1.119
  686   HG11  VAL  37          HG11      VAL  37  -0.494  -1.550   2.669
  687   HG12  VAL  37          HG12      VAL  37  -2.194  -1.067   2.624
  688   HG13  VAL  37          HG13      VAL  37  -1.251  -1.114   1.133
  689   HG21  VAL  37          HG21      VAL  37  -0.066  -4.200   2.247
  690   HG22  VAL  37          HG22      VAL  37   0.008  -3.180   0.809
  691   HG23  VAL  37          HG23      VAL  37  -0.971  -4.648   0.793
  692    H    ILE  38           H        ILE  38  -1.043  -5.679   2.842
  693    HA   ILE  38           HA       ILE  38  -2.694  -7.420   1.415
  694    HB   ILE  38           HB       ILE  38  -0.628  -8.404   3.365
  695   HG12  ILE  38          HG12      ILE  38  -0.121  -6.889   0.826
  696   HG13  ILE  38          HG13      ILE  38   0.531  -6.577   2.415
  697   HG21  ILE  38          HG21      ILE  38  -1.517  -9.295   0.643
  698   HG22  ILE  38          HG22      ILE  38  -1.770 -10.114   2.181
  699   HG23  ILE  38          HG23      ILE  38  -0.147  -9.989   1.504
  700   HD11  ILE  38          HD11      ILE  38   1.184  -9.103   0.959
  701   HD12  ILE  38          HD12      ILE  38   2.058  -8.318   2.274
  702   HD13  ILE  38          HD13      ILE  38   2.070  -7.610   0.655
  703    H    SER  39           H        SER  39  -2.103  -6.756   4.730
  704    HA   SER  39           HA       SER  39  -3.536  -8.996   5.687
  705    HB2  SER  39           HB2      SER  39  -1.646  -7.972   6.937
  706    HB3  SER  39           HB3      SER  39  -2.646  -6.548   7.218
  707    HG   SER  39           HG       SER  39  -3.602  -9.083   7.963
  708    H    THR  40           H        THR  40  -4.355  -5.913   4.618
  709    HA   THR  40           HA       THR  40  -6.835  -5.659   6.072
  710    HB   THR  40           HB       THR  40  -5.771  -4.105   3.702
  711    HG1  THR  40           HG1      THR  40  -4.536  -4.016   5.724
  712   HG21  THR  40          HG21      THR  40  -8.199  -3.887   3.927
  713   HG22  THR  40          HG22      THR  40  -7.382  -2.383   4.352
  714   HG23  THR  40          HG23      THR  40  -8.006  -3.437   5.622
  715    H    SER  41           H        SER  41  -5.819  -6.471   2.764
  716    HA   SER  41           HA       SER  41  -8.561  -6.600   1.865
  717    HB2  SER  41           HB2      SER  41  -7.424  -7.166  -0.337
  718    HB3  SER  41           HB3      SER  41  -7.034  -5.592   0.362
  719    HG   SER  41           HG       SER  41  -5.103  -6.493  -0.210
  720    H    THR  42           H        THR  42  -5.890  -8.910   2.327
  721    HA   THR  42           HA       THR  42  -7.218 -10.983   0.904
  722    HB   THR  42           HB       THR  42  -5.425 -12.453   1.690
  723    HG1  THR  42           HG1      THR  42  -4.359 -10.231   3.112
  724   HG21  THR  42          HG21      THR  42  -5.003 -11.010  -0.235
  725   HG22  THR  42          HG22      THR  42  -3.533 -11.214   0.719
  726   HG23  THR  42          HG23      THR  42  -4.461  -9.718   0.837
  727    H    SER  43           H        SER  43  -7.658  -9.816   4.039
  728    HA   SER  43           HA       SER  43  -8.786 -12.364   4.942
  729    HB2  SER  43           HB2      SER  43  -8.928 -11.120   7.170
  730    HB3  SER  43           HB3      SER  43  -7.311 -11.501   6.577
  731    HG   SER  43           HG       SER  43  -8.653  -9.019   6.625
  732    H    ASP  44           H        ASP  44  -9.817  -9.925   3.164
  733    HA   ASP  44           HA       ASP  44 -12.562 -10.266   4.042
  734    HB2  ASP  44           HB2      ASP  44 -11.673  -8.255   5.279
  735    HB3  ASP  44           HB3      ASP  44 -11.445  -7.476   3.716
  736    HA   PRO  45           HA       PRO  45 -12.182 -10.231  -0.478
  737    HB2  PRO  45           HB2      PRO  45 -13.813 -12.296  -0.946
  738    HB3  PRO  45           HB3      PRO  45 -12.203 -12.543  -0.279
  739    HG2  PRO  45           HG2      PRO  45 -14.851 -12.529   1.072
  740    HG3  PRO  45           HG3      PRO  45 -13.471 -13.596   1.298
  741    HD2  PRO  45           HD2      PRO  45 -14.081 -11.431   2.912
  742    HD3  PRO  45           HD3      PRO  45 -12.481 -12.188   2.793
  743    H    ASP  46           H        ASP  46 -14.119  -8.594   1.195
  744    HA   ASP  46           HA       ASP  46 -16.616  -8.729  -0.239
  745    HB2  ASP  46           HB2      ASP  46 -16.193  -7.894   2.201
  746    HB3  ASP  46           HB3      ASP  46 -15.773  -6.372   1.427
  747    H    TYR  47           H        TYR  47 -17.378  -6.342  -1.005
  748    HA   TYR  47           HA       TYR  47 -17.425  -5.138  -2.887
  749    HB2  TYR  47           HB2      TYR  47 -14.627  -4.482  -2.036
  750    HB3  TYR  47           HB3      TYR  47 -15.668  -3.528  -3.066
  751    HD1  TYR  47           HD1      TYR  47 -17.922  -2.757  -2.055
  752    HD2  TYR  47           HD2      TYR  47 -14.601  -4.055   0.261
  753    HE1  TYR  47           HE1      TYR  47 -18.840  -1.588  -0.098
  754    HE2  TYR  47           HE2      TYR  47 -15.511  -2.889   2.225
  755    HH   TYR  47           HH       TYR  47 -18.679  -1.726   2.367
  756    H    ALA  48           H        ALA  48 -17.353  -7.404  -3.875
  757    HA   ALA  48           HA       ALA  48 -15.115  -7.539  -5.780
  758    HB1  ALA  48           HB1      ALA  48 -16.896  -9.782  -4.828
  759    HB2  ALA  48           HB2      ALA  48 -15.235  -9.496  -4.314
  760    HB3  ALA  48           HB3      ALA  48 -15.577  -9.928  -5.989
  Start of MODEL   10
    1    H1   SER   0           H1       SER   0  -0.306  14.283  -1.304
    2    H2   SER   0           H2       SER   0   1.211  14.213  -2.062
    3    H3   SER   0           H3       SER   0  -0.086  13.301  -2.664
    4    HA   SER   0           HA       SER   0   0.169  16.240  -2.666
    5    HB2  SER   0           HB2      SER   0   1.441  15.017  -4.428
    6    HB3  SER   0           HB3      SER   0  -0.060  14.252  -4.948
    7    HG   SER   0           HG       SER   0   0.455  17.052  -4.923
    8    H    MET   1           H        MET   1  -1.672  17.378  -2.847
    9    HA   MET   1           HA       MET   1  -3.870  17.853  -2.627
   10    HB2  MET   1           HB2      MET   1  -4.275  15.283  -4.171
   11    HB3  MET   1           HB3      MET   1  -5.543  16.445  -3.809
   12    HG2  MET   1           HG2      MET   1  -4.395  18.135  -5.122
   13    HG3  MET   1           HG3      MET   1  -3.084  17.005  -5.453
   14    HE1  MET   1           HE1      MET   1  -4.869  14.312  -7.672
   15    HE2  MET   1           HE2      MET   1  -4.727  14.266  -5.915
   16    HE3  MET   1           HE3      MET   1  -3.363  14.801  -6.895
   17    H    ASP   2           H        ASP   2  -4.697  14.481  -2.605
   18    HA   ASP   2           HA       ASP   2  -5.806  13.260  -1.019
   19    HB2  ASP   2           HB2      ASP   2  -4.257  12.443   0.724
   20    HB3  ASP   2           HB3      ASP   2  -3.545  12.448  -0.880
   21    H    GLU   3           H        GLU   3  -6.878  15.708  -0.733
   22    HA   GLU   3           HA       GLU   3  -7.000  16.066   2.177
   23    HB2  GLU   3           HB2      GLU   3  -7.771  18.413   1.652
   24    HB3  GLU   3           HB3      GLU   3  -6.082  18.058   1.317
   25    HG2  GLU   3           HG2      GLU   3  -6.568  17.795  -1.020
   26    HG3  GLU   3           HG3      GLU   3  -8.284  18.054  -0.727
   27    H    THR   4           H        THR   4  -8.818  15.407   3.046
   28    HA   THR   4           HA       THR   4 -10.976  14.765   3.333
   29    HB   THR   4           HB       THR   4 -11.701  16.973   1.403
   30    HG1  THR   4           HG1      THR   4 -10.243  17.193   3.610
   31   HG21  THR   4          HG21      THR   4 -13.674  17.189   2.845
   32   HG22  THR   4          HG22      THR   4 -13.085  15.866   3.852
   33   HG23  THR   4          HG23      THR   4 -13.550  15.560   2.178
   34    H    VAL   5           H        VAL   5 -10.126  12.897   1.994
   35    HA   VAL   5           HA       VAL   5 -11.063  12.763  -0.729
   36    HB   VAL   5           HB       VAL   5 -10.049  10.476  -0.702
   37   HG11  VAL   5          HG11      VAL   5  -8.811  12.412  -1.499
   38   HG12  VAL   5          HG12      VAL   5  -7.738  11.296  -0.655
   39   HG13  VAL   5          HG13      VAL   5  -8.287  12.768   0.146
   40   HG21  VAL   5          HG21      VAL   5 -10.298  10.088   1.723
   41   HG22  VAL   5          HG22      VAL   5  -9.059  11.308   2.014
   42   HG23  VAL   5          HG23      VAL   5  -8.652   9.825   1.153
   43    H    LYS   6           H        LYS   6 -13.266  13.149   0.366
   44    HA   LYS   6           HA       LYS   6 -14.547  10.835   1.503
   45    HB2  LYS   6           HB2      LYS   6 -16.560  12.296   1.515
   46    HB3  LYS   6           HB3      LYS   6 -15.177  13.024   2.307
   47    HG2  LYS   6           HG2      LYS   6 -14.731  14.209   0.109
   48    HG3  LYS   6           HG3      LYS   6 -16.346  13.688  -0.350
   49    HD2  LYS   6           HD2      LYS   6 -15.705  15.316   2.096
   50    HD3  LYS   6           HD3      LYS   6 -16.290  15.984   0.579
   51    HE2  LYS   6           HE2      LYS   6 -18.331  14.689   0.801
   52    HE3  LYS   6           HE3      LYS   6 -17.741  13.981   2.298
   53    HZ1  LYS   6           HZ1      LYS   6 -17.753  16.149   3.312
   54    HZ2  LYS   6           HZ2      LYS   6 -19.284  15.828   2.670
   55    HZ3  LYS   6           HZ3      LYS   6 -18.232  16.876   1.863
   56    H    LEU   7           H        LEU   7 -16.598  10.005   0.613
   57    HA   LEU   7           HA       LEU   7 -17.727   8.867  -0.963
   58    HB2  LEU   7           HB2      LEU   7 -18.311  11.061  -1.816
   59    HB3  LEU   7           HB3      LEU   7 -16.866  11.074  -2.774
   60    HG   LEU   7           HG       LEU   7 -17.729   9.104  -4.032
   61   HD11  LEU   7          HD11      LEU   7 -20.130   8.638  -3.829
   62   HD12  LEU   7          HD12      LEU   7 -20.201   9.734  -2.448
   63   HD13  LEU   7          HD13      LEU   7 -19.237   8.263  -2.355
   64   HD21  LEU   7          HD21      LEU   7 -19.426  11.596  -4.047
   65   HD22  LEU   7          HD22      LEU   7 -19.360  10.392  -5.333
   66   HD23  LEU   7          HD23      LEU   7 -17.929  11.345  -4.945
   67    H    ASN   8           H        ASN   8 -15.475   9.946  -3.443
   68    HA   ASN   8           HA       ASN   8 -14.414   7.214  -3.549
   69    HB2  ASN   8           HB2      ASN   8 -13.889   9.440  -5.526
   70    HB3  ASN   8           HB3      ASN   8 -13.552   7.740  -5.737
   71   HD21  ASN   8          HD21      ASN   8 -15.088   9.525  -7.392
   72   HD22  ASN   8          HD22      ASN   8 -16.661   8.825  -7.511
   73    H    HIS   9           H        HIS   9 -12.784   7.024  -2.145
   74    HA   HIS   9           HA       HIS   9 -11.178   9.193  -1.302
   75    HB2  HIS   9           HB2      HIS   9 -10.578   6.249  -1.068
   76    HB3  HIS   9           HB3      HIS   9  -9.800   7.531  -0.163
   77    HD1  HIS   9           HD1      HIS   9 -10.746   7.977   2.081
   78    HD2  HIS   9           HD2      HIS   9 -13.481   6.069  -0.400
   79    HE1  HIS   9           HE1      HIS   9 -12.751   7.511   3.519
   80    HE2  HIS   9           HE2      HIS   9 -14.318   6.208   2.043
   81    H    THR  10           H        THR  10  -9.312   9.940  -2.087
   82    HA   THR  10           HA       THR  10  -8.545   9.091  -4.719
   83    HB   THR  10           HB       THR  10  -7.153  11.143  -2.973
   84    HG1  THR  10           HG1      THR  10  -8.583  12.561  -4.427
   85   HG21  THR  10          HG21      THR  10  -5.914  10.465  -4.981
   86   HG22  THR  10          HG22      THR  10  -6.479  12.130  -5.111
   87   HG23  THR  10          HG23      THR  10  -7.320  10.844  -5.976
   88    H    CYS  11           H        CYS  11  -6.897   7.838  -5.270
   89    HA   CYS  11           HA       CYS  11  -5.570   6.278  -3.299
   90    HB2  CYS  11           HB2      CYS  11  -6.113   5.667  -5.710
   91    HB3  CYS  11           HB3      CYS  11  -4.742   6.650  -6.163
   92    H    VAL  12           H        VAL  12  -3.801   6.714  -2.174
   93    HA   VAL  12           HA       VAL  12  -2.216   9.015  -2.462
   94    HB   VAL  12           HB       VAL  12  -0.566   7.847  -1.012
   95   HG11  VAL  12          HG11      VAL  12  -3.443   7.628  -0.151
   96   HG12  VAL  12          HG12      VAL  12  -2.380   9.021   0.048
   97   HG13  VAL  12          HG13      VAL  12  -2.054   7.528   0.931
   98   HG21  VAL  12          HG21      VAL  12  -0.797   5.596  -1.881
   99   HG22  VAL  12          HG22      VAL  12  -2.453   5.512  -1.285
  100   HG23  VAL  12          HG23      VAL  12  -1.111   5.612  -0.146
  101    H    ILE  13           H        ILE  13  -2.323   6.183  -4.318
  102    HA   ILE  13           HA       ILE  13   0.475   6.299  -5.077
  103    HB   ILE  13           HB       ILE  13  -1.524   4.354  -6.112
  104   HG12  ILE  13          HG12      ILE  13  -1.567   4.374  -3.637
  105   HG13  ILE  13          HG13      ILE  13  -0.960   2.874  -4.311
  106   HG21  ILE  13          HG21      ILE  13   0.416   2.976  -6.512
  107   HG22  ILE  13          HG22      ILE  13   1.450   4.166  -5.723
  108   HG23  ILE  13          HG23      ILE  13   0.657   4.562  -7.247
  109   HD11  ILE  13          HD11      ILE  13   0.262   3.788  -2.338
  110   HD12  ILE  13          HD12      ILE  13   0.835   5.068  -3.411
  111   HD13  ILE  13          HD13      ILE  13   1.238   3.386  -3.751
  112    H    CYS  14           H        CYS  14  -2.604   5.962  -6.823
  113    HA   CYS  14           HA       CYS  14  -1.272   7.044  -9.136
  114    HB2  CYS  14           HB2      CYS  14  -3.128   6.063 -10.426
  115    HB3  CYS  14           HB3      CYS  14  -2.241   4.885  -9.493
  116    H    ASP  15           H        ASP  15  -2.895   8.263  -6.702
  117    HA   ASP  15           HA       ASP  15  -4.048  10.152  -6.275
  118    HB2  ASP  15           HB2      ASP  15  -2.739  10.954  -8.826
  119    HB3  ASP  15           HB3      ASP  15  -3.568  12.079  -7.771
  120    H    GLN  16           H        GLN  16  -5.518   8.130  -7.654
  121    HA   GLN  16           HA       GLN  16  -7.429   9.728  -9.173
  122    HB2  GLN  16           HB2      GLN  16  -7.013   6.740  -9.075
  123    HB3  GLN  16           HB3      GLN  16  -8.219   7.561 -10.049
  124    HG2  GLN  16           HG2      GLN  16  -5.257   7.780 -10.308
  125    HG3  GLN  16           HG3      GLN  16  -6.341   6.939 -11.393
  126   HE21  GLN  16          HE21      GLN  16  -4.473   9.076 -11.931
  127   HE22  GLN  16          HE22      GLN  16  -5.408  10.349 -12.619
  128    H    GLU  17           H        GLU  17  -9.589   9.587  -8.643
  129    HA   GLU  17           HA       GLU  17 -10.130   9.167  -5.852
  130    HB2  GLU  17           HB2      GLU  17 -11.787  10.326  -8.087
  131    HB3  GLU  17           HB3      GLU  17 -12.372  10.139  -6.440
  132    HG2  GLU  17           HG2      GLU  17 -10.734  11.632  -5.598
  133    HG3  GLU  17           HG3      GLU  17  -9.905  11.675  -7.149
  134    H    LYS  18           H        LYS  18 -10.516   7.271  -5.250
  135    HA   LYS  18           HA       LYS  18 -12.155   5.445  -6.880
  136    HB2  LYS  18           HB2      LYS  18 -10.146   4.338  -5.063
  137    HB3  LYS  18           HB3      LYS  18 -10.726   3.711  -6.574
  138    HG2  LYS  18           HG2      LYS  18  -8.785   5.969  -6.248
  139    HG3  LYS  18           HG3      LYS  18  -8.384   4.317  -6.700
  140    HD2  LYS  18           HD2      LYS  18 -10.311   5.907  -8.303
  141    HD3  LYS  18           HD3      LYS  18  -8.602   6.112  -8.520
  142    HE2  LYS  18           HE2      LYS  18  -9.479   4.569 -10.151
  143    HE3  LYS  18           HE3      LYS  18  -8.391   3.776  -9.040
  144    HZ1  LYS  18           HZ1      LYS  18 -11.334   3.678  -8.771
  145    HZ2  LYS  18           HZ2      LYS  18 -10.199   2.745  -7.931
  146    HZ3  LYS  18           HZ3      LYS  18 -10.433   2.502  -9.582
  147    H    ASN  19           H        ASN  19 -13.847   4.506  -5.849
  148    HA   ASN  19           HA       ASN  19 -14.002   4.838  -2.943
  149    HB2  ASN  19           HB2      ASN  19 -16.345   4.329  -3.121
  150    HB3  ASN  19           HB3      ASN  19 -15.951   5.500  -4.370
  151   HD21  ASN  19          HD21      ASN  19 -18.128   3.522  -4.106
  152   HD22  ASN  19          HD22      ASN  19 -18.056   2.565  -5.579
  153    H    ARG  20           H        ARG  20 -12.407   2.812  -4.638
  154    HA   ARG  20           HA       ARG  20 -13.203   0.452  -3.097
  155    HB2  ARG  20           HB2      ARG  20 -14.010   0.573  -5.598
  156    HB3  ARG  20           HB3      ARG  20 -12.356   0.104  -5.930
  157    HG2  ARG  20           HG2      ARG  20 -12.606  -1.920  -4.706
  158    HG3  ARG  20           HG3      ARG  20 -14.173  -1.411  -4.105
  159    HD2  ARG  20           HD2      ARG  20 -15.197  -1.606  -6.166
  160    HD3  ARG  20           HD3      ARG  20 -13.655  -1.634  -6.990
  161    HE   ARG  20           HE       ARG  20 -14.001  -3.854  -5.225
  162   HH11  ARG  20          HH11      ARG  20 -14.706  -2.653  -8.435
  163   HH12  ARG  20          HH12      ARG  20 -14.898  -4.232  -9.122
  164   HH21  ARG  20          HH21      ARG  20 -14.256  -5.934  -6.122
  165   HH22  ARG  20          HH22      ARG  20 -14.652  -6.101  -7.803
  166    H    GLY  21           H        GLY  21 -11.571  -0.301  -2.016
  167    HA2  GLY  21           HA2      GLY  21  -9.105  -1.109  -2.658
  168    HA3  GLY  21           HA3      GLY  21  -8.855   0.625  -2.502
  169    H    ILE  22           H        ILE  22  -7.512   0.261  -0.494
  170    HA   ILE  22           HA       ILE  22  -9.292  -0.393   1.749
  171    HB   ILE  22           HB       ILE  22  -7.657  -1.517   2.900
  172   HG12  ILE  22          HG12      ILE  22  -5.601  -0.207   1.156
  173   HG13  ILE  22          HG13      ILE  22  -6.054   0.338   2.736
  174   HG21  ILE  22          HG21      ILE  22  -7.223  -2.020  -0.021
  175   HG22  ILE  22          HG22      ILE  22  -8.109  -2.995   1.153
  176   HG23  ILE  22          HG23      ILE  22  -6.343  -2.936   1.203
  177   HD11  ILE  22          HD11      ILE  22  -4.591  -2.136   1.977
  178   HD12  ILE  22          HD12      ILE  22  -5.364  -1.950   3.551
  179   HD13  ILE  22          HD13      ILE  22  -4.082  -0.838   3.065
  180    H    HIS  23           H        HIS  23  -7.910   0.332   3.782
  181    HA   HIS  23           HA       HIS  23  -6.920   3.010   3.590
  182    HB2  HIS  23           HB2      HIS  23  -8.710   3.898   5.169
  183    HB3  HIS  23           HB3      HIS  23  -9.212   3.641   3.514
  184    HD1  HIS  23           HD1      HIS  23  -9.844   2.507   7.003
  185    HD2  HIS  23           HD2      HIS  23 -11.027   1.576   3.150
  186    HE1  HIS  23           HE1      HIS  23 -11.894   1.079   7.263
  187    HE2  HIS  23           HE2      HIS  23 -12.567   0.465   4.912
  188    H    LEU  24           H        LEU  24  -5.174   2.721   4.821
  189    HA   LEU  24           HA       LEU  24  -5.084   0.797   6.942
  190    HB2  LEU  24           HB2      LEU  24  -3.202   2.651   5.619
  191    HB3  LEU  24           HB3      LEU  24  -2.861   2.321   7.275
  192    HG   LEU  24           HG       LEU  24  -1.831   0.447   6.737
  193   HD11  LEU  24          HD11      LEU  24  -4.251  -0.384   5.212
  194   HD12  LEU  24          HD12      LEU  24  -3.869  -0.752   6.898
  195   HD13  LEU  24          HD13      LEU  24  -2.859  -1.400   5.605
  196   HD21  LEU  24          HD21      LEU  24  -1.168   1.716   4.812
  197   HD22  LEU  24          HD22      LEU  24  -2.547   1.080   3.913
  198   HD23  LEU  24          HD23      LEU  24  -1.270  -0.009   4.463
  199    H    TYR  25           H        TYR  25  -4.415   4.239   6.828
  200    HA   TYR  25           HA       TYR  25  -5.294   4.509   9.593
  201    HB2  TYR  25           HB2      TYR  25  -3.615   6.404   8.001
  202    HB3  TYR  25           HB3      TYR  25  -3.963   6.532   9.709
  203    HD1  TYR  25           HD1      TYR  25  -3.353   3.181   8.686
  204    HD2  TYR  25           HD2      TYR  25  -1.376   6.761   9.791
  205    HE1  TYR  25           HE1      TYR  25  -1.323   1.892   9.081
  206    HE2  TYR  25           HE2      TYR  25   0.671   5.486  10.243
  207    HH   TYR  25           HH       TYR  25   1.197   2.398   9.154
  208    H    THR  26           H        THR  26  -5.017   7.389   7.928
  209    HA   THR  26           HA       THR  26  -7.898   7.466   7.397
  210    HB   THR  26           HB       THR  26  -7.398   9.208   8.884
  211    HG1  THR  26           HG1      THR  26  -7.677   9.993   6.226
  212   HG21  THR  26          HG21      THR  26  -4.995   9.896   7.201
  213   HG22  THR  26          HG22      THR  26  -4.967   9.039   8.744
  214   HG23  THR  26          HG23      THR  26  -5.504  10.722   8.675
  215    H    LYS  27           H        LYS  27  -5.503   6.402   5.745
  216    HA   LYS  27           HA       LYS  27  -5.767   8.192   3.420
  217    HB2  LYS  27           HB2      LYS  27  -3.684   6.200   3.138
  218    HB3  LYS  27           HB3      LYS  27  -3.604   7.941   2.941
  219    HG2  LYS  27           HG2      LYS  27  -3.485   6.546   5.579
  220    HG3  LYS  27           HG3      LYS  27  -2.083   7.010   4.638
  221    HD2  LYS  27           HD2      LYS  27  -4.178   8.915   5.629
  222    HD3  LYS  27           HD3      LYS  27  -2.622   8.643   6.404
  223    HE2  LYS  27           HE2      LYS  27  -2.213   9.169   3.629
  224    HE3  LYS  27           HE3      LYS  27  -3.237  10.429   4.312
  225    HZ1  LYS  27           HZ1      LYS  27  -0.582   9.572   5.361
  226    HZ2  LYS  27           HZ2      LYS  27  -1.554  10.776   6.040
  227    HZ3  LYS  27           HZ3      LYS  27  -0.888  10.995   4.502
  228    H    PHE  28           H        PHE  28  -5.003   6.718   1.418
  229    HA   PHE  28           HA       PHE  28  -6.664   4.335   1.317
  230    HB2  PHE  28           HB2      PHE  28  -8.248   6.133   0.892
  231    HB3  PHE  28           HB3      PHE  28  -7.198   6.797  -0.353
  232    HD1  PHE  28           HD1      PHE  28  -9.281   3.859   0.505
  233    HD2  PHE  28           HD2      PHE  28  -7.263   6.017  -2.557
  234    HE1  PHE  28           HE1      PHE  28 -10.343   2.435  -1.199
  235    HE2  PHE  28           HE2      PHE  28  -8.316   4.602  -4.257
  236    HZ   PHE  28           HZ       PHE  28  -9.852   2.794  -3.594
  237    H    ILE  29           H        ILE  29  -5.392   2.887   0.348
  238    HA   ILE  29           HA       ILE  29  -4.076   3.697  -2.162
  239    HB   ILE  29           HB       ILE  29  -3.882   1.026  -0.740
  240   HG12  ILE  29          HG12      ILE  29  -1.370   1.856  -0.627
  241   HG13  ILE  29          HG13      ILE  29  -2.123   3.445  -0.680
  242   HG21  ILE  29          HG21      ILE  29  -2.157   0.507  -2.381
  243   HG22  ILE  29          HG22      ILE  29  -2.392   2.082  -3.137
  244   HG23  ILE  29          HG23      ILE  29  -3.695   0.885  -3.173
  245   HD11  ILE  29          HD11      ILE  29  -1.659   2.640   1.602
  246   HD12  ILE  29          HD12      ILE  29  -2.788   1.314   1.333
  247   HD13  ILE  29          HD13      ILE  29  -3.364   2.982   1.318
  248    H    CYS  30           H        CYS  30  -5.133   3.184  -4.038
  249    HA   CYS  30           HA       CYS  30  -7.712   1.992  -3.815
  250    HB2  CYS  30           HB2      CYS  30  -8.029   2.429  -6.067
  251    HB3  CYS  30           HB3      CYS  30  -6.874   3.671  -5.612
  252    H    LEU  31           H        LEU  31  -8.394   0.166  -4.864
  253    HA   LEU  31           HA       LEU  31  -7.308  -2.063  -3.789
  254    HB2  LEU  31           HB2      LEU  31  -9.091  -3.153  -4.750
  255    HB3  LEU  31           HB3      LEU  31  -9.631  -1.505  -4.737
  256    HG   LEU  31           HG       LEU  31  -8.606  -1.524  -7.191
  257   HD11  LEU  31          HD11      LEU  31  -7.832  -3.834  -7.094
  258   HD12  LEU  31          HD12      LEU  31  -9.080  -3.627  -8.323
  259   HD13  LEU  31          HD13      LEU  31  -9.480  -4.379  -6.779
  260   HD21  LEU  31          HD21      LEU  31 -10.859  -0.893  -6.673
  261   HD22  LEU  31          HD22      LEU  31 -11.308  -2.574  -6.393
  262   HD23  LEU  31          HD23      LEU  31 -10.875  -2.036  -8.014
  263    H    ASP  32           H        ASP  32  -6.370  -0.559  -6.681
  264    HA   ASP  32           HA       ASP  32  -5.386  -2.955  -7.979
  265    HB2  ASP  32           HB2      ASP  32  -6.395  -0.923  -9.167
  266    HB3  ASP  32           HB3      ASP  32  -4.857  -0.157  -8.843
  267    H    CYS  33           H        CYS  33  -4.175   0.037  -6.684
  268    HA   CYS  33           HA       CYS  33  -1.425  -0.618  -6.851
  269    HB2  CYS  33           HB2      CYS  33  -2.815   1.471  -5.185
  270    HB3  CYS  33           HB3      CYS  33  -1.098   1.344  -5.434
  271    H    GLU  34           H        GLU  34  -3.937  -0.915  -4.531
  272    HA   GLU  34           HA       GLU  34  -2.454  -1.676  -2.333
  273    HB2  GLU  34           HB2      GLU  34  -4.798  -1.102  -2.165
  274    HB3  GLU  34           HB3      GLU  34  -5.242  -2.456  -3.188
  275    HG2  GLU  34           HG2      GLU  34  -3.806  -3.060  -0.669
  276    HG3  GLU  34           HG3      GLU  34  -5.468  -2.510  -0.556
  277    H    ARG  35           H        ARG  35  -3.651  -3.563  -5.054
  278    HA   ARG  35           HA       ARG  35  -2.387  -5.950  -4.094
  279    HB2  ARG  35           HB2      ARG  35  -3.607  -5.255  -6.762
  280    HB3  ARG  35           HB3      ARG  35  -2.842  -6.806  -6.443
  281    HG2  ARG  35           HG2      ARG  35  -4.442  -7.265  -4.696
  282    HG3  ARG  35           HG3      ARG  35  -5.180  -5.686  -4.914
  283    HD2  ARG  35           HD2      ARG  35  -5.931  -6.285  -7.071
  284    HD3  ARG  35           HD3      ARG  35  -5.000  -7.774  -7.067
  285    HE   ARG  35           HE       ARG  35  -6.656  -7.979  -4.904
  286   HH11  ARG  35          HH11      ARG  35  -7.151  -7.437  -8.320
  287   HH12  ARG  35          HH12      ARG  35  -8.690  -8.234  -8.350
  288   HH21  ARG  35          HH21      ARG  35  -8.652  -9.060  -4.945
  289   HH22  ARG  35          HH22      ARG  35  -9.542  -9.167  -6.432
  290    H    LYS  36           H        LYS  36  -1.400  -3.277  -5.985
  291    HA   LYS  36           HA       LYS  36   0.633  -4.408  -7.523
  292    HB2  LYS  36           HB2      LYS  36   0.183  -1.655  -6.403
  293    HB3  LYS  36           HB3      LYS  36   1.521  -2.040  -7.443
  294    HG2  LYS  36           HG2      LYS  36  -0.158  -2.751  -9.174
  295    HG3  LYS  36           HG3      LYS  36  -1.364  -2.088  -8.115
  296    HD2  LYS  36           HD2      LYS  36  -0.666   0.047  -8.334
  297    HD3  LYS  36           HD3      LYS  36   0.893  -0.470  -8.894
  298    HE2  LYS  36           HE2      LYS  36  -1.684  -0.787 -10.386
  299    HE3  LYS  36           HE3      LYS  36  -0.491   0.457 -10.693
  300    HZ1  LYS  36           HZ1      LYS  36   1.105  -1.307 -11.250
  301    HZ2  LYS  36           HZ2      LYS  36  -0.241  -1.311 -12.274
  302    HZ3  LYS  36           HZ3      LYS  36  -0.116  -2.460 -11.040
  303    H    VAL  37           H        VAL  37   0.435  -2.999  -4.376
  304    HA   VAL  37           HA       VAL  37   3.096  -2.849  -3.748
  305    HB   VAL  37           HB       VAL  37   2.426  -2.857  -1.405
  306   HG11  VAL  37          HG11      VAL  37   2.101  -0.834  -2.889
  307   HG12  VAL  37          HG12      VAL  37   1.104  -0.873  -1.434
  308   HG13  VAL  37          HG13      VAL  37   0.400  -1.299  -2.997
  309   HG21  VAL  37          HG21      VAL  37  -0.125  -2.943  -1.036
  310   HG22  VAL  37          HG22      VAL  37   0.814  -4.432  -1.100
  311   HG23  VAL  37          HG23      VAL  37  -0.114  -3.915  -2.513
  312    H    ILE  38           H        ILE  38   0.844  -5.424  -3.166
  313    HA   ILE  38           HA       ILE  38   2.456  -7.191  -1.728
  314    HB   ILE  38           HB       ILE  38   0.310  -8.142  -3.598
  315   HG12  ILE  38          HG12      ILE  38  -0.101  -6.531  -1.092
  316   HG13  ILE  38          HG13      ILE  38  -0.784  -6.263  -2.678
  317   HG21  ILE  38          HG21      ILE  38  -0.187  -9.647  -1.664
  318   HG22  ILE  38          HG22      ILE  38   1.253  -8.995  -0.887
  319   HG23  ILE  38          HG23      ILE  38   1.395  -9.870  -2.407
  320   HD11  ILE  38          HD11      ILE  38  -2.343  -7.961  -2.430
  321   HD12  ILE  38          HD12      ILE  38  -2.294  -7.197  -0.835
  322   HD13  ILE  38          HD13      ILE  38  -1.449  -8.717  -1.116
  323    H    SER  39           H        SER  39   2.059  -6.432  -5.049
  324    HA   SER  39           HA       SER  39   3.363  -8.803  -5.931
  325    HB2  SER  39           HB2      SER  39   1.498  -7.922  -7.239
  326    HB3  SER  39           HB3      SER  39   2.369  -6.412  -7.483
  327    HG   SER  39           HG       SER  39   3.443  -8.891  -8.311
  328    H    THR  40           H        THR  40   4.102  -5.455  -5.451
  329    HA   THR  40           HA       THR  40   6.587  -5.492  -6.906
  330    HB   THR  40           HB       THR  40   5.387  -3.431  -5.052
  331    HG1  THR  40           HG1      THR  40   4.174  -3.868  -6.970
  332   HG21  THR  40          HG21      THR  40   7.831  -3.172  -5.302
  333   HG22  THR  40          HG22      THR  40   6.930  -1.840  -6.023
  334   HG23  THR  40          HG23      THR  40   7.623  -3.095  -7.053
  335    H    SER  41           H        SER  41   5.539  -6.032  -3.649
  336    HA   SER  41           HA       SER  41   7.985  -5.455  -2.350
  337    HB2  SER  41           HB2      SER  41   5.742  -5.429  -1.277
  338    HB3  SER  41           HB3      SER  41   5.794  -7.177  -1.349
  339    HG   SER  41           HG       SER  41   6.676  -5.783   0.593
  340    H    THR  42           H        THR  42   7.137  -8.022  -4.320
  341    HA   THR  42           HA       THR  42   8.268 -10.165  -2.800
  342    HB   THR  42           HB       THR  42   7.864 -11.535  -4.789
  343    HG1  THR  42           HG1      THR  42   8.269 -10.246  -6.517
  344   HG21  THR  42          HG21      THR  42   5.999 -11.092  -3.278
  345   HG22  THR  42          HG22      THR  42   5.432 -11.195  -4.944
  346   HG23  THR  42          HG23      THR  42   5.610  -9.619  -4.169
  347    H    SER  43           H        SER  43  10.171  -8.158  -3.024
  348    HA   SER  43           HA       SER  43  12.385  -9.660  -4.026
  349    HB2  SER  43           HB2      SER  43  11.572  -8.523  -6.111
  350    HB3  SER  43           HB3      SER  43  11.847  -6.971  -5.320
  351    HG   SER  43           HG       SER  43  13.811  -8.963  -5.842
  352    H    ASP  44           H        ASP  44  13.227  -9.533  -1.986
  353    HA   ASP  44           HA       ASP  44  14.168  -6.879  -1.182
  354    HB2  ASP  44           HB2      ASP  44  13.601  -7.220   1.127
  355    HB3  ASP  44           HB3      ASP  44  12.149  -7.503   0.178
  356    HA   PRO  45           HA       PRO  45  17.938  -9.198  -0.892
  357    HB2  PRO  45           HB2      PRO  45  19.502  -7.154  -0.001
  358    HB3  PRO  45           HB3      PRO  45  19.006  -7.339  -1.682
  359    HG2  PRO  45           HG2      PRO  45  18.031  -5.466   0.374
  360    HG3  PRO  45           HG3      PRO  45  18.094  -5.281  -1.378
  361    HD2  PRO  45           HD2      PRO  45  15.837  -5.889   0.149
  362    HD3  PRO  45           HD3      PRO  45  15.990  -6.036  -1.605
  363    H    ASP  46           H        ASP  46  19.653  -9.626   0.735
  364    HA   ASP  46           HA       ASP  46  18.462 -10.078   3.321
  365    HB2  ASP  46           HB2      ASP  46  21.189 -10.747   2.204
  366    HB3  ASP  46           HB3      ASP  46  20.684 -11.156   3.839
  367    H    TYR  47           H        TYR  47  20.655  -7.853   1.867
  368    HA   TYR  47           HA       TYR  47  21.094  -6.576   4.477
  369    HB2  TYR  47           HB2      TYR  47  22.750  -6.529   1.978
  370    HB3  TYR  47           HB3      TYR  47  23.001  -5.399   3.297
  371    HD1  TYR  47           HD1      TYR  47  24.144  -6.056   5.271
  372    HD2  TYR  47           HD2      TYR  47  23.145  -8.966   2.335
  373    HE1  TYR  47           HE1      TYR  47  25.601  -7.682   6.397
  374    HE2  TYR  47           HE2      TYR  47  24.595 -10.601   3.456
  375    HH   TYR  47           HH       TYR  47  25.902 -10.066   6.576
  376    H    ALA  48           H        ALA  48  19.385  -5.222   4.633
  377    HA   ALA  48           HA       ALA  48  18.649  -3.556   2.362
  378    HB1  ALA  48           HB1      ALA  48  17.431  -3.756   5.115
  379    HB2  ALA  48           HB2      ALA  48  16.854  -4.571   3.662
  380    HB3  ALA  48           HB3      ALA  48  16.788  -2.812   3.771
  381    H1   SER   0           H1       SER   0   0.471  14.279   1.013
  382    H2   SER   0           H2       SER   0  -1.046  14.234   1.775
  383    H3   SER   0           H3       SER   0   0.237  13.304   2.377
  384    HA   SER   0           HA       SER   0   0.033  16.245   2.369
  385    HB2  SER   0           HB2      SER   0  -1.261  15.047   4.133
  386    HB3  SER   0           HB3      SER   0   0.228  14.265   4.659
  387    HG   SER   0           HG       SER   0  -0.227  17.077   4.613
  388    H    MET   1           H        MET   1   1.890  17.349   2.552
  389    HA   MET   1           HA       MET   1   4.095  17.790   2.321
  390    HB2  MET   1           HB2      MET   1   4.459  15.217   3.872
  391    HB3  MET   1           HB3      MET   1   5.747  16.355   3.506
  392    HG2  MET   1           HG2      MET   1   4.628  18.069   4.814
  393    HG3  MET   1           HG3      MET   1   3.299  16.961   5.149
  394    HE1  MET   1           HE1      MET   1   5.036  14.246   7.376
  395    HE2  MET   1           HE2      MET   1   4.889  14.198   5.621
  396    HE3  MET   1           HE3      MET   1   3.538  14.762   6.601
  397    H    ASP   2           H        ASP   2   4.860  14.406   2.308
  398    HA   ASP   2           HA       ASP   2   5.950  13.158   0.730
  399    HB2  ASP   2           HB2      ASP   2   4.387  12.359  -1.012
  400    HB3  ASP   2           HB3      ASP   2   3.675  12.382   0.594
  401    H    GLU   3           H        GLU   3   7.068  15.584   0.434
  402    HA   GLU   3           HA       GLU   3   7.189  15.934  -2.478
  403    HB2  GLU   3           HB2      GLU   3   7.999  18.270  -1.963
  404    HB3  GLU   3           HB3      GLU   3   6.304  17.945  -1.618
  405    HG2  GLU   3           HG2      GLU   3   6.797  17.680   0.715
  406    HG3  GLU   3           HG3      GLU   3   8.518  17.902   0.415
  407    H    THR   4           H        THR   4   8.994  15.239  -3.352
  408    HA   THR   4           HA       THR   4  11.147  14.559  -3.635
  409    HB   THR   4           HB       THR   4  11.906  16.760  -1.707
  410    HG1  THR   4           HG1      THR   4  10.448  17.001  -3.906
  411   HG21  THR   4          HG21      THR   4  13.883  16.940  -3.151
  412   HG22  THR   4          HG22      THR   4  13.271  15.623  -4.151
  413   HG23  THR   4          HG23      THR   4  13.732  15.315  -2.477
  414    H    VAL   5           H        VAL   5  10.263  12.710  -2.286
  415    HA   VAL   5           HA       VAL   5  11.200  12.573   0.435
  416    HB   VAL   5           HB       VAL   5  10.147  10.302   0.421
  417   HG11  VAL   5          HG11      VAL   5   8.941  12.260   1.210
  418   HG12  VAL   5          HG12      VAL   5   7.849  11.159   0.369
  419   HG13  VAL   5          HG13      VAL   5   8.423  12.619  -0.437
  420   HG21  VAL   5          HG21      VAL   5  10.389   9.899  -2.003
  421   HG22  VAL   5          HG22      VAL   5   9.167  11.134  -2.298
  422   HG23  VAL   5          HG23      VAL   5   8.739   9.662  -1.428
  423    H    LYS   6           H        LYS   6  13.409  12.916  -0.657
  424    HA   LYS   6           HA       LYS   6  14.648  10.574  -1.789
  425    HB2  LYS   6           HB2      LYS   6  16.687  11.998  -1.807
  426    HB3  LYS   6           HB3      LYS   6  15.317  12.746  -2.602
  427    HG2  LYS   6           HG2      LYS   6  14.892  13.949  -0.409
  428    HG3  LYS   6           HG3      LYS   6  16.500  13.403   0.051
  429    HD2  LYS   6           HD2      LYS   6  15.878  15.029  -2.407
  430    HD3  LYS   6           HD3      LYS   6  16.481  15.687  -0.892
  431    HE2  LYS   6           HE2      LYS   6  18.504  14.358  -1.099
  432    HE3  LYS   6           HE3      LYS   6  17.895  13.665  -2.595
  433    HZ1  LYS   6           HZ1      LYS   6  17.945  15.831  -3.615
  434    HZ2  LYS   6           HZ2      LYS   6  19.470  15.479  -2.977
  435    HZ3  LYS   6           HZ3      LYS   6  18.441  16.547  -2.165
  436    H    LEU   7           H        LEU   7  16.684   9.714  -0.895
  437    HA   LEU   7           HA       LEU   7  17.796   8.562   0.683
  438    HB2  LEU   7           HB2      LEU   7  18.416  10.748   1.527
  439    HB3  LEU   7           HB3      LEU   7  16.972  10.789   2.486
  440    HG   LEU   7           HG       LEU   7  17.803   8.809   3.750
  441   HD11  LEU   7          HD11      LEU   7  20.194   8.303   3.548
  442   HD12  LEU   7          HD12      LEU   7  20.284   9.396   2.166
  443   HD13  LEU   7          HD13      LEU   7  19.297   7.941   2.076
  444   HD21  LEU   7          HD21      LEU   7  19.542  11.271   3.758
  445   HD22  LEU   7          HD22      LEU   7  19.455  10.073   5.049
  446   HD23  LEU   7          HD23      LEU   7  18.041  11.050   4.656
  447    H    ASN   8           H        ASN   8  15.568   9.682   3.165
  448    HA   ASN   8           HA       ASN   8  14.458   6.971   3.278
  449    HB2  ASN   8           HB2      ASN   8  13.974   9.217   5.243
  450    HB3  ASN   8           HB3      ASN   8  13.601   7.525   5.463
  451   HD21  ASN   8          HD21      ASN   8  15.179   9.289   7.103
  452   HD22  ASN   8          HD22      ASN   8  16.732   8.554   7.230
  453    H    HIS   9           H        HIS   9  12.824   6.804   1.873
  454    HA   HIS   9           HA       HIS   9  11.255   8.997   1.024
  455    HB2  HIS   9           HB2      HIS   9  10.603   6.062   0.801
  456    HB3  HIS   9           HB3      HIS   9   9.847   7.355  -0.109
  457    HD1  HIS   9           HD1      HIS   9  10.802   7.776  -2.355
  458    HD2  HIS   9           HD2      HIS   9  13.503   5.832   0.132
  459    HE1  HIS   9           HE1      HIS   9  12.798   7.274  -3.791
  460    HE2  HIS   9           HE2      HIS   9  14.330   5.925  -2.318
  461    H    THR  10           H        THR  10   9.401   9.780   1.805
  462    HA   THR  10           HA       THR  10   8.620   8.955   4.444
  463    HB   THR  10           HB       THR  10   7.264  11.024   2.689
  464    HG1  THR  10           HG1      THR  10   8.715  12.425   4.133
  465   HG21  THR  10          HG21      THR  10   6.013  10.374   4.699
  466   HG22  THR  10          HG22      THR  10   6.604  12.030   4.823
  467   HG23  THR  10          HG23      THR  10   7.423  10.734   5.695
  468    H    CYS  11           H        CYS  11   6.950   7.729   5.000
  469    HA   CYS  11           HA       CYS  11   5.594   6.187   3.036
  470    HB2  CYS  11           HB2      CYS  11   6.127   5.580   5.454
  471    HB3  CYS  11           HB3      CYS  11   4.768   6.585   5.901
  472    H    VAL  12           H        VAL  12   3.832   6.650   1.908
  473    HA   VAL  12           HA       VAL  12   2.290   8.979   2.189
  474    HB   VAL  12           HB       VAL  12   0.620   7.835   0.743
  475   HG11  VAL  12          HG11      VAL  12   3.493   7.564  -0.119
  476   HG12  VAL  12          HG12      VAL  12   2.454   8.975  -0.324
  477   HG13  VAL  12          HG13      VAL  12   2.103   7.484  -1.201
  478   HG21  VAL  12          HG21      VAL  12   0.813   5.584   1.622
  479   HG22  VAL  12          HG22      VAL  12   2.467   5.470   1.023
  480   HG23  VAL  12          HG23      VAL  12   1.125   5.587  -0.114
  481    H    ILE  13           H        ILE  13   2.348   6.151   4.052
  482    HA   ILE  13           HA       ILE  13  -0.448   6.324   4.814
  483    HB   ILE  13           HB       ILE  13   1.518   4.349   5.858
  484   HG12  ILE  13          HG12      ILE  13   1.562   4.359   3.383
  485   HG13  ILE  13          HG13      ILE  13   0.928   2.871   4.060
  486   HG21  ILE  13          HG21      ILE  13  -0.442   3.006   6.262
  487   HG22  ILE  13          HG22      ILE  13  -1.458   4.207   5.466
  488   HG23  ILE  13          HG23      ILE  13  -0.660   4.598   6.989
  489   HD11  ILE  13          HD11      ILE  13  -0.277   3.795   2.086
  490   HD12  ILE  13          HD12      ILE  13  -0.829   5.091   3.151
  491   HD13  ILE  13          HD13      ILE  13  -1.259   3.418   3.499
  492    H    CYS  14           H        CYS  14   2.625   5.932   6.563
  493    HA   CYS  14           HA       CYS  14   1.314   7.050   8.873
  494    HB2  CYS  14           HB2      CYS  14   3.153   6.042  10.165
  495    HB3  CYS  14           HB3      CYS  14   2.247   4.875   9.234
  496    H    ASP  15           H        ASP  15   2.954   8.231   6.433
  497    HA   ASP  15           HA       ASP  15   4.141  10.097   5.995
  498    HB2  ASP  15           HB2      ASP  15   2.846  10.934   8.542
  499    HB3  ASP  15           HB3      ASP  15   3.692  12.040   7.481
  500    H    GLN  16           H        GLN  16   5.577   8.056   7.383
  501    HA   GLN  16           HA       GLN  16   7.517   9.628   8.894
  502    HB2  GLN  16           HB2      GLN  16   7.052   6.646   8.809
  503    HB3  GLN  16           HB3      GLN  16   8.272   7.452   9.779
  504    HG2  GLN  16           HG2      GLN  16   5.312   7.718  10.039
  505    HG3  GLN  16           HG3      GLN  16   6.385   6.866  11.127
  506   HE21  GLN  16          HE21      GLN  16   4.547   9.038  11.655
  507   HE22  GLN  16          HE22      GLN  16   5.503  10.296  12.341
  508    H    GLU  17           H        GLU  17   9.674   9.451   8.365
  509    HA   GLU  17           HA       GLU  17  10.207   9.010   5.575
  510    HB2  GLU  17           HB2      GLU  17  11.886  10.151   7.805
  511    HB3  GLU  17           HB3      GLU  17  12.466   9.948   6.157
  512    HG2  GLU  17           HG2      GLU  17  10.855  11.468   5.313
  513    HG3  GLU  17           HG3      GLU  17  10.021  11.524   6.859
  514    H    LYS  18           H        LYS  18  10.564   7.105   4.979
  515    HA   LYS  18           HA       LYS  18  12.173   5.257   6.618
  516    HB2  LYS  18           HB2      LYS  18  10.144   4.176   4.806
  517    HB3  LYS  18           HB3      LYS  18  10.713   3.546   6.319
  518    HG2  LYS  18           HG2      LYS  18   8.808   5.836   5.981
  519    HG3  LYS  18           HG3      LYS  18   8.380   4.192   6.440
  520    HD2  LYS  18           HD2      LYS  18  10.334   5.756   8.038
  521    HD3  LYS  18           HD3      LYS  18   8.628   5.993   8.252
  522    HE2  LYS  18           HE2      LYS  18   9.479   4.444   9.889
  523    HE3  LYS  18           HE3      LYS  18   8.374   3.663   8.785
  524    HZ1  LYS  18           HZ1      LYS  18  11.313   3.511   8.507
  525    HZ2  LYS  18           HZ2      LYS  18  10.159   2.596   7.677
  526    HZ3  LYS  18           HZ3      LYS  18  10.393   2.357   9.331
  527    H    ASN  19           H        ASN  19  13.843   4.273   5.585
  528    HA   ASN  19           HA       ASN  19  14.001   4.600   2.679
  529    HB2  ASN  19           HB2      ASN  19  16.339   4.051   2.856
  530    HB3  ASN  19           HB3      ASN  19  15.964   5.241   4.097
  531   HD21  ASN  19          HD21      ASN  19  18.101   3.214   3.846
  532   HD22  ASN  19          HD22      ASN  19  18.019   2.275   5.330
  533    H    ARG  20           H        ARG  20  12.372   2.611   4.376
  534    HA   ARG  20           HA       ARG  20  13.127   0.231   2.848
  535    HB2  ARG  20           HB2      ARG  20  13.938   0.348   5.350
  536    HB3  ARG  20           HB3      ARG  20  12.276  -0.092   5.684
  537    HG2  ARG  20           HG2      ARG  20  12.490  -2.124   4.469
  538    HG3  ARG  20           HG3      ARG  20  14.064  -1.644   3.862
  539    HD2  ARG  20           HD2      ARG  20  15.090  -1.848   5.919
  540    HD3  ARG  20           HD3      ARG  20  13.549  -1.850   6.747
  541    HE   ARG  20           HE       ARG  20  13.857  -4.075   4.985
  542   HH11  ARG  20          HH11      ARG  20  14.592  -2.878   8.190
  543   HH12  ARG  20          HH12      ARG  20  14.744  -4.460   8.885
  544   HH21  ARG  20          HH21      ARG  20  14.075  -6.163   5.892
  545   HH22  ARG  20          HH22      ARG  20  14.460  -6.329   7.574
  546    H    GLY  21           H        GLY  21  11.482  -0.501   1.774
  547    HA2  GLY  21           HA2      GLY  21   9.003  -1.262   2.417
  548    HA3  GLY  21           HA3      GLY  21   8.783   0.476   2.258
  549    H    ILE  22           H        ILE  22   7.432   0.129   0.251
  550    HA   ILE  22           HA       ILE  22   9.200  -0.562  -1.989
  551    HB   ILE  22           HB       ILE  22   7.546  -1.662  -3.136
  552   HG12  ILE  22          HG12      ILE  22   5.513  -0.311  -1.397
  553   HG13  ILE  22          HG13      ILE  22   5.976   0.221  -2.980
  554   HG21  ILE  22          HG21      ILE  22   7.106  -2.149  -0.213
  555   HG22  ILE  22          HG22      ILE  22   7.973  -3.143  -1.385
  556   HG23  ILE  22          HG23      ILE  22   6.209  -3.052  -1.433
  557   HD11  ILE  22          HD11      ILE  22   4.472  -2.226  -2.211
  558   HD12  ILE  22          HD12      ILE  22   5.246  -2.057  -3.786
  559   HD13  ILE  22          HD13      ILE  22   3.984  -0.922  -3.304
  560    H    HIS  23           H        HIS  23   7.837   0.177  -4.024
  561    HA   HIS  23           HA       HIS  23   6.888   2.873  -3.843
  562    HB2  HIS  23           HB2      HIS  23   8.691   3.725  -5.425
  563    HB3  HIS  23           HB3      HIS  23   9.191   3.464  -3.770
  564    HD1  HIS  23           HD1      HIS  23   9.808   2.319  -7.261
  565    HD2  HIS  23           HD2      HIS  23  10.968   1.367  -3.401
  566    HE1  HIS  23           HE1      HIS  23  11.823   0.833  -7.514
  567    HE2  HIS  23           HE2      HIS  23  12.513   0.257  -5.159
  568    H    LEU  24           H        LEU  24   5.138   2.610  -5.073
  569    HA   LEU  24           HA       LEU  24   5.012   0.680  -7.187
  570    HB2  LEU  24           HB2      LEU  24   3.163   2.568  -5.867
  571    HB3  LEU  24           HB3      LEU  24   2.818   2.243  -7.524
  572    HG   LEU  24           HG       LEU  24   1.760   0.384  -6.989
  573   HD11  LEU  24          HD11      LEU  24   4.160  -0.478  -5.454
  574   HD12  LEU  24          HD12      LEU  24   3.776  -0.849  -7.139
  575   HD13  LEU  24          HD13      LEU  24   2.753  -1.474  -5.843
  576   HD21  LEU  24          HD21      LEU  24   1.108   1.667  -5.077
  577   HD22  LEU  24          HD22      LEU  24   2.471   1.011  -4.164
  578   HD23  LEU  24          HD23      LEU  24   1.179  -0.056  -4.725
  579    H    TYR  25           H        TYR  25   4.402   4.134  -7.086
  580    HA   TYR  25           HA       TYR  25   5.286   4.378  -9.854
  581    HB2  TYR  25           HB2      TYR  25   3.639   6.306  -8.267
  582    HB3  TYR  25           HB3      TYR  25   3.988   6.423  -9.975
  583    HD1  TYR  25           HD1      TYR  25   3.323   3.085  -8.942
  584    HD2  TYR  25           HD2      TYR  25   1.408   6.697 -10.060
  585    HE1  TYR  25           HE1      TYR  25   1.270   1.833  -9.330
  586    HE2  TYR  25           HE2      TYR  25  -0.660   5.456 -10.506
  587    HH   TYR  25           HH       TYR  25  -1.233   2.377  -9.394
  588    H    THR  26           H        THR  26   5.063   7.270  -8.202
  589    HA   THR  26           HA       THR  26   7.941   7.297  -7.668
  590    HB   THR  26           HB       THR  26   7.467   9.035  -9.164
  591    HG1  THR  26           HG1      THR  26   7.758   9.843  -6.511
  592   HG21  THR  26          HG21      THR  26   5.083   9.774  -7.476
  593   HG22  THR  26          HG22      THR  26   5.036   8.917  -9.019
  594   HG23  THR  26          HG23      THR  26   5.603  10.589  -8.952
  595    H    LYS  27           H        LYS  27   5.529   6.283  -6.012
  596    HA   LYS  27           HA       LYS  27   5.824   8.078  -3.693
  597    HB2  LYS  27           HB2      LYS  27   3.710   6.122  -3.405
  598    HB3  LYS  27           HB3      LYS  27   3.658   7.864  -3.213
  599    HG2  LYS  27           HG2      LYS  27   3.516   6.460  -5.848
  600    HG3  LYS  27           HG3      LYS  27   2.121   6.952  -4.908
  601    HD2  LYS  27           HD2      LYS  27   4.247   8.815  -5.910
  602    HD3  LYS  27           HD3      LYS  27   2.685   8.568  -6.682
  603    HE2  LYS  27           HE2      LYS  27   2.290   9.112  -3.908
  604    HE3  LYS  27           HE3      LYS  27   3.337  10.351  -4.596
  605    HZ1  LYS  27           HZ1      LYS  27   0.666   9.539  -5.640
  606    HZ2  LYS  27           HZ2      LYS  27   1.660  10.719  -6.329
  607    HZ3  LYS  27           HZ3      LYS  27   1.001  10.962  -4.792
  608    H    PHE  28           H        PHE  28   5.035   6.621  -1.685
  609    HA   PHE  28           HA       PHE  28   6.653   4.210  -1.577
  610    HB2  PHE  28           HB2      PHE  28   8.271   5.979  -1.160
  611    HB3  PHE  28           HB3      PHE  28   7.236   6.668   0.082
  612    HD1  PHE  28           HD1      PHE  28   9.266   3.693  -0.762
  613    HD2  PHE  28           HD2      PHE  28   7.288   5.896   2.285
  614    HE1  PHE  28           HE1      PHE  28  10.302   2.257   0.945
  615    HE2  PHE  28           HE2      PHE  28   8.312   4.470   3.996
  616    HZ   PHE  28           HZ       PHE  28   9.816   2.632   3.341
  617    H    ILE  29           H        ILE  29   5.357   2.789  -0.601
  618    HA   ILE  29           HA       ILE  29   4.057   3.630   1.906
  619    HB   ILE  29           HB       ILE  29   3.816   0.957   0.495
  620   HG12  ILE  29          HG12      ILE  29   1.319   1.833   0.378
  621   HG13  ILE  29          HG13      ILE  29   2.101   3.407   0.426
  622   HG21  ILE  29          HG21      ILE  29   2.085   0.473   2.138
  623   HG22  ILE  29          HG22      ILE  29   2.344   2.047   2.887
  624   HG23  ILE  29          HG23      ILE  29   3.628   0.831   2.929
  625   HD11  ILE  29          HD11      ILE  29   1.623   2.600  -1.853
  626   HD12  ILE  29          HD12      ILE  29   2.730   1.257  -1.579
  627   HD13  ILE  29          HD13      ILE  29   3.333   2.915  -1.570
  628    H    CYS  30           H        CYS  30   5.105   3.106   3.784
  629    HA   CYS  30           HA       CYS  30   7.662   1.871   3.563
  630    HB2  CYS  30           HB2      CYS  30   7.993   2.312   5.810
  631    HB3  CYS  30           HB3      CYS  30   6.855   3.570   5.357
  632    H    LEU  31           H        LEU  31   8.316   0.038   4.613
  633    HA   LEU  31           HA       LEU  31   7.191  -2.176   3.553
  634    HB2  LEU  31           HB2      LEU  31   8.938  -3.292   4.527
  635    HB3  LEU  31           HB3      LEU  31   9.522  -1.662   4.496
  636    HG   LEU  31           HG       LEU  31   8.499  -1.646   6.955
  637   HD11  LEU  31          HD11      LEU  31   7.685  -3.945   6.866
  638   HD12  LEU  31          HD12      LEU  31   8.938  -3.754   8.092
  639   HD13  LEU  31          HD13      LEU  31   9.324  -4.518   6.550
  640   HD21  LEU  31          HD21      LEU  31  10.764  -1.058   6.432
  641   HD22  LEU  31          HD22      LEU  31  11.182  -2.748   6.157
  642   HD23  LEU  31          HD23      LEU  31  10.761  -2.195   7.778
  643    H    ASP  32           H        ASP  32   6.270  -0.649   6.436
  644    HA   ASP  32           HA       ASP  32   5.261  -3.027   7.748
  645    HB2  ASP  32           HB2      ASP  32   6.302  -1.006   8.927
  646    HB3  ASP  32           HB3      ASP  32   4.776  -0.217   8.602
  647    H    CYS  33           H        CYS  33   4.070  -0.041   6.474
  648    HA   CYS  33           HA       CYS  33   1.324  -0.626   6.611
  649    HB2  CYS  33           HB2      CYS  33   2.761   1.430   4.942
  650    HB3  CYS  33           HB3      CYS  33   1.041   1.340   5.195
  651    H    GLU  34           H        GLU  34   3.838  -0.971   4.295
  652    HA   GLU  34           HA       GLU  34   2.345  -1.714   2.099
  653    HB2  GLU  34           HB2      GLU  34   4.698  -1.181   1.928
  654    HB3  GLU  34           HB3      GLU  34   5.120  -2.538   2.955
  655    HG2  GLU  34           HG2      GLU  34   3.673  -3.125   0.438
  656    HG3  GLU  34           HG3      GLU  34   5.343  -2.605   0.325
  657    H    ARG  35           H        ARG  35   3.508  -3.611   4.826
  658    HA   ARG  35           HA       ARG  35   2.205  -5.981   3.876
  659    HB2  ARG  35           HB2      ARG  35   3.437  -5.296   6.541
  660    HB3  ARG  35           HB3      ARG  35   2.645  -6.836   6.229
  661    HG2  ARG  35           HG2      ARG  35   4.237  -7.328   4.482
  662    HG3  ARG  35           HG3      ARG  35   5.002  -5.761   4.696
  663    HD2  ARG  35           HD2      ARG  35   5.743  -6.365   6.853
  664    HD3  ARG  35           HD3      ARG  35   4.784  -7.837   6.855
  665    HE   ARG  35           HE       ARG  35   6.434  -8.083   4.694
  666   HH11  ARG  35          HH11      ARG  35   6.947  -7.529   8.109
  667   HH12  ARG  35          HH12      ARG  35   8.464  -8.366   8.140
  668   HH21  ARG  35          HH21      ARG  35   8.416  -9.195   4.738
  669   HH22  ARG  35          HH22      ARG  35   9.300  -9.314   6.227
  670    H    LYS  36           H        LYS  36   1.266  -3.284   5.754
  671    HA   LYS  36           HA       LYS  36  -0.782  -4.370   7.304
  672    HB2  LYS  36           HB2      LYS  36  -0.297  -1.636   6.156
  673    HB3  LYS  36           HB3      LYS  36  -1.626  -1.986   7.217
  674    HG2  LYS  36           HG2      LYS  36   0.099  -2.675   8.906
  675    HG3  LYS  36           HG3      LYS  36   1.300  -2.064   7.841
  676    HD2  LYS  36           HD2      LYS  36   0.570   0.036   8.115
  677    HD3  LYS  36           HD3      LYS  36  -1.009  -0.414   8.695
  678    HE2  LYS  36           HE2      LYS  36   1.601  -0.794  10.145
  679    HE3  LYS  36           HE3      LYS  36   0.437   0.483  10.460
  680    HZ1  LYS  36           HZ1      LYS  36  -1.200  -1.249  11.010
  681    HZ2  LYS  36           HZ2      LYS  36   0.142  -1.275  12.038
  682    HZ3  LYS  36           HZ3      LYS  36  -0.003  -2.427  10.810
  683    H    VAL  37           H        VAL  37  -0.564  -2.978   4.149
  684    HA   VAL  37           HA       VAL  37  -3.223  -2.785   3.520
  685    HB   VAL  37           HB       VAL  37  -2.554  -2.814   1.176
  686   HG11  VAL  37          HG11      VAL  37  -2.197  -0.791   2.649
  687   HG12  VAL  37          HG12      VAL  37  -1.198  -0.855   1.197
  688   HG13  VAL  37          HG13      VAL  37  -0.504  -1.284   2.763
  689   HG21  VAL  37          HG21      VAL  37  -0.006  -2.944   0.807
  690   HG22  VAL  37          HG22      VAL  37  -0.970  -4.417   0.878
  691   HG23  VAL  37          HG23      VAL  37  -0.032  -3.910   2.287
  692    H    ILE  38           H        ILE  38  -1.014  -5.399   2.945
  693    HA   ILE  38           HA       ILE  38  -2.659  -7.146   1.516
  694    HB   ILE  38           HB       ILE  38  -0.528  -8.128   3.387
  695   HG12  ILE  38          HG12      ILE  38  -0.091  -6.532   0.876
  696   HG13  ILE  38          HG13      ILE  38   0.598  -6.271   2.460
  697   HG21  ILE  38          HG21      ILE  38  -0.059  -9.646   1.456
  698   HG22  ILE  38          HG22      ILE  38  -1.489  -8.972   0.678
  699   HG23  ILE  38          HG23      ILE  38  -1.644  -9.837   2.202
  700   HD11  ILE  38          HD11      ILE  38   2.126  -7.997   2.217
  701   HD12  ILE  38          HD12      ILE  38   2.088  -7.240   0.619
  702   HD13  ILE  38          HD13      ILE  38   1.217  -8.744   0.908
  703    H    SER  39           H        SER  39  -2.249  -6.380   4.833
  704    HA   SER  39           HA       SER  39  -3.591  -8.727   5.718
  705    HB2  SER  39           HB2      SER  39  -1.717  -7.879   7.033
  706    HB3  SER  39           HB3      SER  39  -2.558  -6.350   7.269
  707    HG   SER  39           HG       SER  39  -3.674  -8.814   8.098
  708    H    THR  40           H        THR  40  -4.273  -5.366   5.233
  709    HA   THR  40           HA       THR  40  -6.758  -5.358   6.689
  710    HB   THR  40           HB       THR  40  -5.523  -3.321   4.828
  711    HG1  THR  40           HG1      THR  40  -4.324  -3.770   6.756
  712   HG21  THR  40          HG21      THR  40  -7.964  -3.023   5.074
  713   HG22  THR  40          HG22      THR  40  -7.041  -1.703   5.791
  714   HG23  THR  40          HG23      THR  40  -7.755  -2.943   6.824
  715    H    SER  41           H        SER  41  -5.722  -5.932   3.435
  716    HA   SER  41           HA       SER  41  -8.160  -5.314   2.133
  717    HB2  SER  41           HB2      SER  41  -5.912  -5.330   1.063
  718    HB3  SER  41           HB3      SER  41  -6.000  -7.076   1.137
  719    HG   SER  41           HG       SER  41  -6.841  -5.681  -0.808
  720    H    THR  42           H        THR  42  -7.353  -7.889   4.110
  721    HA   THR  42           HA       THR  42  -8.519 -10.020   2.600
  722    HB   THR  42           HB       THR  42  -8.144 -11.381   4.603
  723    HG1  THR  42           HG1      THR  42  -8.512 -10.093   6.332
  724   HG21  THR  42          HG21      THR  42  -6.273 -10.979   3.085
  725   HG22  THR  42          HG22      THR  42  -5.707 -11.086   4.751
  726   HG23  THR  42          HG23      THR  42  -5.855  -9.510   3.971
  727    H    SER  43           H        SER  43 -10.389  -7.977   2.813
  728    HA   SER  43           HA       SER  43 -12.624  -9.434   3.826
  729    HB2  SER  43           HB2      SER  43 -11.794  -8.305   5.904
  730    HB3  SER  43           HB3      SER  43 -12.038  -6.751   5.111
  731    HG   SER  43           HG       SER  43 -14.040  -8.702   5.646
  732    H    ASP  44           H        ASP  44 -13.480  -9.305   1.795
  733    HA   ASP  44           HA       ASP  44 -14.365  -6.639   0.968
  734    HB2  ASP  44           HB2      ASP  44 -13.805  -7.001  -1.339
  735    HB3  ASP  44           HB3      ASP  44 -12.357  -7.299  -0.388
  736    HA   PRO  45           HA       PRO  45 -18.178  -8.886   0.699
  737    HB2  PRO  45           HB2      PRO  45 -19.691  -6.808  -0.214
  738    HB3  PRO  45           HB3      PRO  45 -19.206  -6.980   1.444
  739    HG2  PRO  45           HG2      PRO  45 -18.231  -5.188  -0.546
  740    HG3  PRO  45           HG3      PRO  45 -18.266  -4.981   1.183
  741    HD2  PRO  45           HD2      PRO  45 -16.018  -5.618  -0.361
  742    HD3  PRO  45           HD3      PRO  45 -16.169  -5.764   1.394
  743    H    ASP  46           H        ASP  46 -19.894  -9.299  -0.935
  744    HA   ASP  46           HA       ASP  46 -18.709  -9.778  -3.518
  745    HB2  ASP  46           HB2      ASP  46 -21.451 -10.391  -2.400
  746    HB3  ASP  46           HB3      ASP  46 -20.950 -10.818  -4.032
  747    H    TYR  47           H        TYR  47 -20.870  -7.512  -2.067
  748    HA   TYR  47           HA       TYR  47 -21.286  -6.235  -4.683
  749    HB2  TYR  47           HB2      TYR  47 -22.939  -6.151  -2.183
  750    HB3  TYR  47           HB3      TYR  47 -23.172  -5.022  -3.507
  751    HD1  TYR  47           HD1      TYR  47 -24.329  -5.665  -5.477
  752    HD2  TYR  47           HD2      TYR  47 -23.376  -8.581  -2.532
  753    HE1  TYR  47           HE1      TYR  47 -25.814  -7.272  -6.596
  754    HE2  TYR  47           HE2      TYR  47 -24.859 -10.197  -3.644
  755    HH   TYR  47           HH       TYR  47 -26.163  -9.635  -6.771
  756    H    ALA  48           H        ALA  48 -19.549  -4.917  -4.845
  757    HA   ALA  48           HA       ALA  48 -18.792  -3.247  -2.584
  758    HB1  ALA  48           HB1      ALA  48 -17.579  -3.469  -5.339
  759    HB2  ALA  48           HB2      ALA  48 -17.014  -4.290  -3.886
  760    HB3  ALA  48           HB3      ALA  48 -16.922  -2.534  -3.996
  Start of MODEL   11
    1    H1   SER   0           H1       SER   0   1.793  16.257   8.313
    2    H2   SER   0           H2       SER   0   1.715  17.416   7.088
    3    H3   SER   0           H3       SER   0   1.425  15.789   6.732
    4    HA   SER   0           HA       SER   0  -0.543  15.803   8.096
    5    HB2  SER   0           HB2      SER   0  -1.347  18.125   8.823
    6    HB3  SER   0           HB3      SER   0  -0.019  17.424   9.748
    7    HG   SER   0           HG       SER   0   0.054  19.490   7.816
    8    H    MET   1           H        MET   1  -1.204  15.176   6.035
    9    HA   MET   1           HA       MET   1  -2.331  17.360   4.408
   10    HB2  MET   1           HB2      MET   1  -0.946  14.862   3.411
   11    HB3  MET   1           HB3      MET   1  -1.884  15.939   2.388
   12    HG2  MET   1           HG2      MET   1   0.597  16.688   3.919
   13    HG3  MET   1           HG3      MET   1   0.512  16.342   2.193
   14    HE1  MET   1           HE1      MET   1  -2.270  17.729   1.413
   15    HE2  MET   1           HE2      MET   1  -0.805  17.863   0.444
   16    HE3  MET   1           HE3      MET   1  -1.700  19.314   0.893
   17    H    ASP   2           H        ASP   2  -3.576  15.887   6.470
   18    HA   ASP   2           HA       ASP   2  -5.236  13.871   5.169
   19    HB2  ASP   2           HB2      ASP   2  -5.348  14.803   8.046
   20    HB3  ASP   2           HB3      ASP   2  -6.010  13.316   7.380
   21    H    GLU   3           H        GLU   3  -6.138  15.639   3.771
   22    HA   GLU   3           HA       GLU   3  -8.522  16.797   4.970
   23    HB2  GLU   3           HB2      GLU   3  -6.670  18.418   5.367
   24    HB3  GLU   3           HB3      GLU   3  -6.470  18.546   3.627
   25    HG2  GLU   3           HG2      GLU   3  -7.772  20.373   4.636
   26    HG3  GLU   3           HG3      GLU   3  -8.634  19.506   3.375
   27    H    THR   4           H        THR   4  -9.949  17.749   3.363
   28    HA   THR   4           HA       THR   4 -11.158  17.683   1.469
   29    HB   THR   4           HB       THR   4  -9.848  18.025  -0.698
   30    HG1  THR   4           HG1      THR   4  -7.833  17.254   0.746
   31   HG21  THR   4          HG21      THR   4  -9.326  20.352  -0.119
   32   HG22  THR   4          HG22      THR   4  -9.478  19.953   1.592
   33   HG23  THR   4          HG23      THR   4 -10.885  19.848   0.534
   34    H    VAL   5           H        VAL   5 -11.789  15.497   1.960
   35    HA   VAL   5           HA       VAL   5 -11.486  13.899  -0.407
   36    HB   VAL   5           HB       VAL   5  -9.612  13.015   0.828
   37   HG11  VAL   5          HG11      VAL   5 -10.245  13.688   3.061
   38   HG12  VAL   5          HG12      VAL   5  -9.877  11.963   3.021
   39   HG13  VAL   5          HG13      VAL   5 -11.553  12.508   3.068
   40   HG21  VAL   5          HG21      VAL   5 -11.956  11.124   0.923
   41   HG22  VAL   5          HG22      VAL   5 -10.258  10.656   0.984
   42   HG23  VAL   5          HG23      VAL   5 -10.912  11.422  -0.464
   43    H    LYS   6           H        LYS   6 -13.478  13.273  -0.944
   44    HA   LYS   6           HA       LYS   6 -15.397  12.552   1.117
   45    HB2  LYS   6           HB2      LYS   6 -15.607  14.985   0.922
   46    HB3  LYS   6           HB3      LYS   6 -15.893  14.805  -0.792
   47    HG2  LYS   6           HG2      LYS   6 -17.933  13.556  -0.329
   48    HG3  LYS   6           HG3      LYS   6 -17.647  13.780   1.390
   49    HD2  LYS   6           HD2      LYS   6 -17.806  16.186   1.135
   50    HD3  LYS   6           HD3      LYS   6 -18.026  15.998  -0.601
   51    HE2  LYS   6           HE2      LYS   6 -20.099  14.793  -0.228
   52    HE3  LYS   6           HE3      LYS   6 -19.868  14.935   1.509
   53    HZ1  LYS   6           HZ1      LYS   6 -20.235  17.195  -0.370
   54    HZ2  LYS   6           HZ2      LYS   6 -20.001  17.337   1.298
   55    HZ3  LYS   6           HZ3      LYS   6 -21.402  16.602   0.700
   56    H    LEU   7           H        LEU   7 -16.951  11.164   0.449
   57    HA   LEU   7           HA       LEU   7 -18.025   9.628  -0.804
   58    HB2  LEU   7           HB2      LEU   7 -17.297  11.394  -3.094
   59    HB3  LEU   7           HB3      LEU   7 -18.353  10.018  -3.229
   60    HG   LEU   7           HG       LEU   7 -18.868  12.508  -1.606
   61   HD11  LEU   7          HD11      LEU   7 -20.649  12.914  -3.226
   62   HD12  LEU   7          HD12      LEU   7 -20.142  11.493  -4.141
   63   HD13  LEU   7          HD13      LEU   7 -19.066  12.882  -4.002
   64   HD21  LEU   7          HD21      LEU   7 -20.549  10.054  -2.046
   65   HD22  LEU   7          HD22      LEU   7 -21.092  11.533  -1.254
   66   HD23  LEU   7          HD23      LEU   7 -19.810  10.564  -0.531
   67    H    ASN   8           H        ASN   8 -15.654  10.404  -3.295
   68    HA   ASN   8           HA       ASN   8 -14.548   7.744  -3.270
   69    HB2  ASN   8           HB2      ASN   8 -12.802   8.762  -4.773
   70    HB3  ASN   8           HB3      ASN   8 -14.416   9.008  -5.377
   71   HD21  ASN   8          HD21      ASN   8 -15.069  11.012  -5.727
   72   HD22  ASN   8          HD22      ASN   8 -14.109  12.395  -5.386
   73    H    HIS   9           H        HIS   9 -12.463   7.195  -2.542
   74    HA   HIS   9           HA       HIS   9 -11.074   9.271  -0.986
   75    HB2  HIS   9           HB2      HIS   9 -10.543   6.302  -0.946
   76    HB3  HIS   9           HB3      HIS   9  -9.812   7.508   0.093
   77    HD1  HIS   9           HD1      HIS   9 -12.626   5.185  -0.064
   78    HD2  HIS   9           HD2      HIS   9 -11.722   8.711   1.948
   79    HE1  HIS   9           HE1      HIS   9 -14.254   5.315   1.842
   80    HE2  HIS   9           HE2      HIS   9 -13.793   7.526   2.947
   81    H    THR  10           H        THR  10  -9.274  10.047  -1.868
   82    HA   THR  10           HA       THR  10  -8.662   9.213  -4.555
   83    HB   THR  10           HB       THR  10  -7.283  11.312  -2.851
   84    HG1  THR  10           HG1      THR  10  -9.719  11.296  -3.971
   85   HG21  THR  10          HG21      THR  10  -5.905  10.574  -4.744
   86   HG22  THR  10          HG22      THR  10  -6.496  12.216  -5.004
   87   HG23  THR  10          HG23      THR  10  -7.251  10.864  -5.845
   88    H    CYS  11           H        CYS  11  -7.023   7.981  -5.214
   89    HA   CYS  11           HA       CYS  11  -5.643   6.418  -3.319
   90    HB2  CYS  11           HB2      CYS  11  -6.128   5.550  -5.515
   91    HB3  CYS  11           HB3      CYS  11  -5.202   6.841  -6.272
   92    H    VAL  12           H        VAL  12  -3.791   6.699  -2.299
   93    HA   VAL  12           HA       VAL  12  -2.190   9.020  -2.488
   94    HB   VAL  12           HB       VAL  12  -0.561   7.788  -1.081
   95   HG11  VAL  12          HG11      VAL  12  -2.379   8.892   0.048
   96   HG12  VAL  12          HG12      VAL  12  -2.040   7.352   0.844
   97   HG13  VAL  12          HG13      VAL  12  -3.433   7.506  -0.228
   98   HG21  VAL  12          HG21      VAL  12  -1.122   5.516  -0.306
   99   HG22  VAL  12          HG22      VAL  12  -0.753   5.583  -2.028
  100   HG23  VAL  12          HG23      VAL  12  -2.428   5.461  -1.491
  101    H    ILE  13           H        ILE  13  -2.260   6.146  -4.328
  102    HA   ILE  13           HA       ILE  13   0.531   6.316  -5.186
  103    HB   ILE  13           HB       ILE  13  -1.502   4.278  -5.988
  104   HG12  ILE  13          HG12      ILE  13  -1.377   4.422  -3.538
  105   HG13  ILE  13          HG13      ILE  13  -0.755   2.904  -4.162
  106   HG21  ILE  13          HG21      ILE  13   1.499   4.234  -5.883
  107   HG22  ILE  13          HG22      ILE  13   0.502   4.318  -7.336
  108   HG23  ILE  13          HG23      ILE  13   0.476   2.869  -6.330
  109   HD11  ILE  13          HD11      ILE  13   0.966   5.234  -3.448
  110   HD12  ILE  13          HD12      ILE  13   1.474   3.589  -3.835
  111   HD13  ILE  13          HD13      ILE  13   0.578   3.913  -2.347
  112    H    CYS  14           H        CYS  14  -2.623   5.853  -6.692
  113    HA   CYS  14           HA       CYS  14  -1.452   6.601  -9.233
  114    HB2  CYS  14           HB2      CYS  14  -4.216   5.566  -8.958
  115    HB3  CYS  14           HB3      CYS  14  -3.090   5.328 -10.261
  116    H    ASP  15           H        ASP  15  -3.121   8.015  -6.765
  117    HA   ASP  15           HA       ASP  15  -4.054  10.051  -6.418
  118    HB2  ASP  15           HB2      ASP  15  -1.939  10.563  -7.660
  119    HB3  ASP  15           HB3      ASP  15  -2.933  10.870  -9.072
  120    H    GLN  16           H        GLN  16  -5.737   8.282  -7.409
  121    HA   GLN  16           HA       GLN  16  -7.484   9.820  -9.178
  122    HB2  GLN  16           HB2      GLN  16  -7.126   6.830  -9.013
  123    HB3  GLN  16           HB3      GLN  16  -8.352   7.633  -9.976
  124    HG2  GLN  16           HG2      GLN  16  -5.398   7.841 -10.312
  125    HG3  GLN  16           HG3      GLN  16  -6.508   6.971 -11.344
  126   HE21  GLN  16          HE21      GLN  16  -4.669   9.038 -12.053
  127   HE22  GLN  16          HE22      GLN  16  -5.601  10.328 -12.716
  128    H    GLU  17           H        GLU  17  -9.687   9.719  -8.741
  129    HA   GLU  17           HA       GLU  17 -10.334   9.407  -5.954
  130    HB2  GLU  17           HB2      GLU  17 -12.047  10.352  -8.252
  131    HB3  GLU  17           HB3      GLU  17 -12.497  10.387  -6.556
  132    HG2  GLU  17           HG2      GLU  17 -10.840  11.966  -6.034
  133    HG3  GLU  17           HG3      GLU  17 -10.072  11.772  -7.605
  134    H    LYS  18           H        LYS  18 -10.664   7.507  -5.330
  135    HA   LYS  18           HA       LYS  18 -12.268   5.636  -6.939
  136    HB2  LYS  18           HB2      LYS  18 -10.313   4.605  -5.004
  137    HB3  LYS  18           HB3      LYS  18 -10.886   3.883  -6.474
  138    HG2  LYS  18           HG2      LYS  18  -8.881   6.096  -6.231
  139    HG3  LYS  18           HG3      LYS  18  -8.567   4.426  -6.696
  140    HD2  LYS  18           HD2      LYS  18 -10.460   6.098  -8.253
  141    HD3  LYS  18           HD3      LYS  18  -8.750   6.250  -8.501
  142    HE2  LYS  18           HE2      LYS  18  -9.673   4.752 -10.127
  143    HE3  LYS  18           HE3      LYS  18  -8.638   3.894  -9.013
  144    HZ1  LYS  18           HZ1      LYS  18 -10.500   2.953  -7.923
  145    HZ2  LYS  18           HZ2      LYS  18 -10.751   2.740  -9.580
  146    HZ3  LYS  18           HZ3      LYS  18 -11.578   3.957  -8.752
  147    H    ASN  19           H        ASN  19 -13.957   4.671  -5.937
  148    HA   ASN  19           HA       ASN  19 -14.239   5.220  -3.080
  149    HB2  ASN  19           HB2      ASN  19 -16.567   4.830  -3.307
  150    HB3  ASN  19           HB3      ASN  19 -16.099   5.796  -4.696
  151   HD21  ASN  19          HD21      ASN  19 -18.374   4.008  -4.262
  152   HD22  ASN  19          HD22      ASN  19 -18.316   2.849  -5.582
  153    H    ARG  20           H        ARG  20 -12.916   2.916  -4.960
  154    HA   ARG  20           HA       ARG  20 -13.417   0.841  -2.946
  155    HB2  ARG  20           HB2      ARG  20 -13.372   0.470  -5.929
  156    HB3  ARG  20           HB3      ARG  20 -13.041  -0.844  -4.834
  157    HG2  ARG  20           HG2      ARG  20 -15.245  -0.511  -3.821
  158    HG3  ARG  20           HG3      ARG  20 -15.556   0.758  -5.000
  159    HD2  ARG  20           HD2      ARG  20 -15.307  -0.734  -6.804
  160    HD3  ARG  20           HD3      ARG  20 -14.768  -1.975  -5.712
  161    HE   ARG  20           HE       ARG  20 -17.414  -1.025  -5.135
  162   HH11  ARG  20          HH11      ARG  20 -15.558  -3.303  -7.039
  163   HH12  ARG  20          HH12      ARG  20 -16.907  -4.351  -7.333
  164   HH21  ARG  20          HH21      ARG  20 -19.190  -2.415  -5.519
  165   HH22  ARG  20          HH22      ARG  20 -18.965  -3.849  -6.469
  166    H    GLY  21           H        GLY  21 -11.766  -0.343  -2.284
  167    HA2  GLY  21           HA2      GLY  21  -9.348  -1.030  -2.991
  168    HA3  GLY  21           HA3      GLY  21  -9.065   0.699  -2.805
  169    H    ILE  22           H        ILE  22  -7.688   0.372  -0.842
  170    HA   ILE  22           HA       ILE  22  -9.331  -0.444   1.456
  171    HB   ILE  22           HB       ILE  22  -7.617  -1.620   2.456
  172   HG12  ILE  22          HG12      ILE  22  -5.756  -0.184   0.603
  173   HG13  ILE  22          HG13      ILE  22  -5.984   0.135   2.288
  174   HG21  ILE  22          HG21      ILE  22  -8.330  -2.941   0.595
  175   HG22  ILE  22          HG22      ILE  22  -6.576  -3.108   0.739
  176   HG23  ILE  22          HG23      ILE  22  -7.266  -2.060  -0.502
  177   HD11  ILE  22          HD11      ILE  22  -4.870  -2.389   1.142
  178   HD12  ILE  22          HD12      ILE  22  -5.079  -2.023   2.856
  179   HD13  ILE  22          HD13      ILE  22  -3.943  -1.088   1.883
  180    H    HIS  23           H        HIS  23  -7.780   0.232   3.467
  181    HA   HIS  23           HA       HIS  23  -6.839   2.906   3.190
  182    HB2  HIS  23           HB2      HIS  23  -8.586   3.909   4.702
  183    HB3  HIS  23           HB3      HIS  23  -9.146   3.498   3.096
  184    HD1  HIS  23           HD1      HIS  23  -9.590   2.615   6.700
  185    HD2  HIS  23           HD2      HIS  23 -11.019   1.477   2.987
  186    HE1  HIS  23           HE1      HIS  23 -11.637   1.232   7.167
  187    HE2  HIS  23           HE2      HIS  23 -12.387   0.411   4.908
  188    H    LEU  24           H        LEU  24  -5.102   2.784   4.427
  189    HA   LEU  24           HA       LEU  24  -5.327   1.684   7.110
  190    HB2  LEU  24           HB2      LEU  24  -2.874   2.512   5.567
  191    HB3  LEU  24           HB3      LEU  24  -2.944   1.673   7.067
  192    HG   LEU  24           HG       LEU  24  -3.988   0.497   4.524
  193   HD11  LEU  24          HD11      LEU  24  -1.292   0.221   5.836
  194   HD12  LEU  24          HD12      LEU  24  -1.643   0.851   4.226
  195   HD13  LEU  24          HD13      LEU  24  -1.901  -0.856   4.582
  196   HD21  LEU  24          HD21      LEU  24  -4.940  -0.464   6.540
  197   HD22  LEU  24          HD22      LEU  24  -3.326  -0.707   7.210
  198   HD23  LEU  24          HD23      LEU  24  -3.832  -1.607   5.780
  199    H    TYR  25           H        TYR  25  -4.928   3.017   8.844
  200    HA   TYR  25           HA       TYR  25  -4.811   4.949  10.023
  201    HB2  TYR  25           HB2      TYR  25  -3.170   5.956   7.727
  202    HB3  TYR  25           HB3      TYR  25  -3.227   6.665   9.327
  203    HD1  TYR  25           HD1      TYR  25  -0.968   6.453  10.049
  204    HD2  TYR  25           HD2      TYR  25  -2.965   3.068   8.439
  205    HE1  TYR  25           HE1      TYR  25   0.918   5.017  10.714
  206    HE2  TYR  25           HE2      TYR  25  -1.107   1.633   9.083
  207    HH   TYR  25           HH       TYR  25   1.489   2.038   9.554
  208    H    THR  26           H        THR  26  -4.479   7.297   7.665
  209    HA   THR  26           HA       THR  26  -7.393   7.685   7.593
  210    HB   THR  26           HB       THR  26  -7.073  10.006   7.492
  211    HG1  THR  26           HG1      THR  26  -4.748  10.774   7.224
  212   HG21  THR  26          HG21      THR  26  -5.572  10.549   9.335
  213   HG22  THR  26          HG22      THR  26  -4.787   8.976   9.171
  214   HG23  THR  26          HG23      THR  26  -6.471   9.074   9.692
  215    H    LYS  27           H        LYS  27  -5.087   6.365   5.681
  216    HA   LYS  27           HA       LYS  27  -5.620   8.080   3.358
  217    HB2  LYS  27           HB2      LYS  27  -3.516   6.074   3.055
  218    HB3  LYS  27           HB3      LYS  27  -3.534   7.762   2.594
  219    HG2  LYS  27           HG2      LYS  27  -2.956   6.643   5.307
  220    HG3  LYS  27           HG3      LYS  27  -1.802   7.346   4.180
  221    HD2  LYS  27           HD2      LYS  27  -4.094   8.827   5.439
  222    HD3  LYS  27           HD3      LYS  27  -2.426   8.878   6.006
  223    HE2  LYS  27           HE2      LYS  27  -2.771   9.442   3.149
  224    HE3  LYS  27           HE3      LYS  27  -3.496  10.632   4.227
  225    HZ1  LYS  27           HZ1      LYS  27  -0.650   9.768   4.144
  226    HZ2  LYS  27           HZ2      LYS  27  -1.293  10.740   5.370
  227    HZ3  LYS  27           HZ3      LYS  27  -1.271  11.300   3.774
  228    H    PHE  28           H        PHE  28  -4.951   6.633   1.334
  229    HA   PHE  28           HA       PHE  28  -6.595   4.235   1.289
  230    HB2  PHE  28           HB2      PHE  28  -8.221   6.001   0.966
  231    HB3  PHE  28           HB3      PHE  28  -7.232   6.738  -0.288
  232    HD1  PHE  28           HD1      PHE  28  -7.337   6.021  -2.507
  233    HD2  PHE  28           HD2      PHE  28  -9.300   3.781   0.521
  234    HE1  PHE  28           HE1      PHE  28  -8.491   4.712  -4.226
  235    HE2  PHE  28           HE2      PHE  28 -10.448   2.451  -1.201
  236    HZ   PHE  28           HZ       PHE  28 -10.029   2.900  -3.597
  237    H    ILE  29           H        ILE  29  -5.165   2.876   0.420
  238    HA   ILE  29           HA       ILE  29  -3.824   3.571  -2.101
  239    HB   ILE  29           HB       ILE  29  -3.883   0.937  -0.590
  240   HG12  ILE  29          HG12      ILE  29  -1.300   1.655  -0.472
  241   HG13  ILE  29          HG13      ILE  29  -2.035   3.256  -0.500
  242   HG21  ILE  29          HG21      ILE  29  -2.214   1.716  -2.990
  243   HG22  ILE  29          HG22      ILE  29  -3.620   0.640  -3.010
  244   HG23  ILE  29          HG23      ILE  29  -2.157   0.178  -2.124
  245   HD11  ILE  29          HD11      ILE  29  -1.626   2.368   1.772
  246   HD12  ILE  29          HD12      ILE  29  -2.788   1.087   1.440
  247   HD13  ILE  29          HD13      ILE  29  -3.313   2.771   1.462
  248    H    CYS  30           H        CYS  30  -5.011   3.257  -3.978
  249    HA   CYS  30           HA       CYS  30  -7.559   2.028  -3.620
  250    HB2  CYS  30           HB2      CYS  30  -8.178   2.680  -5.773
  251    HB3  CYS  30           HB3      CYS  30  -7.173   3.968  -5.166
  252    H    LEU  31           H        LEU  31  -8.318   0.393  -5.122
  253    HA   LEU  31           HA       LEU  31  -7.300  -1.907  -4.092
  254    HB2  LEU  31           HB2      LEU  31  -9.035  -2.951  -5.182
  255    HB3  LEU  31           HB3      LEU  31  -9.603  -1.337  -4.949
  256    HG   LEU  31           HG       LEU  31  -8.686  -1.032  -7.415
  257   HD11  LEU  31          HD11      LEU  31  -7.817  -3.302  -7.628
  258   HD12  LEU  31          HD12      LEU  31  -9.130  -3.013  -8.770
  259   HD13  LEU  31          HD13      LEU  31  -9.425  -3.954  -7.309
  260   HD21  LEU  31          HD21      LEU  31 -10.962  -1.447  -8.198
  261   HD22  LEU  31          HD22      LEU  31 -10.962  -0.609  -6.648
  262   HD23  LEU  31          HD23      LEU  31 -11.312  -2.335  -6.715
  263    H    ASP  32           H        ASP  32  -6.125  -0.269  -6.799
  264    HA   ASP  32           HA       ASP  32  -5.334  -2.546  -8.319
  265    HB2  ASP  32           HB2      ASP  32  -4.913  -1.008  -9.889
  266    HB3  ASP  32           HB3      ASP  32  -6.061  -0.097  -8.997
  267    H    CYS  33           H        CYS  33  -3.803   0.047  -6.670
  268    HA   CYS  33           HA       CYS  33  -1.170  -0.832  -6.792
  269    HB2  CYS  33           HB2      CYS  33  -1.008   0.984  -4.917
  270    HB3  CYS  33           HB3      CYS  33  -1.313   1.462  -6.571
  271    H    GLU  34           H        GLU  34  -3.786  -1.118  -4.649
  272    HA   GLU  34           HA       GLU  34  -2.478  -1.959  -2.354
  273    HB2  GLU  34           HB2      GLU  34  -4.802  -1.401  -2.263
  274    HB3  GLU  34           HB3      GLU  34  -5.211  -2.637  -3.439
  275    HG2  GLU  34           HG2      GLU  34  -3.933  -3.557  -0.943
  276    HG3  GLU  34           HG3      GLU  34  -5.564  -2.944  -0.821
  277    H    ARG  35           H        ARG  35  -3.629  -3.895  -5.098
  278    HA   ARG  35           HA       ARG  35  -2.365  -6.223  -4.044
  279    HB2  ARG  35           HB2      ARG  35  -2.827  -7.271  -6.253
  280    HB3  ARG  35           HB3      ARG  35  -4.248  -6.616  -5.458
  281    HG2  ARG  35           HG2      ARG  35  -4.176  -4.666  -6.909
  282    HG3  ARG  35           HG3      ARG  35  -2.735  -5.301  -7.687
  283    HD2  ARG  35           HD2      ARG  35  -5.398  -6.627  -7.634
  284    HD3  ARG  35           HD3      ARG  35  -4.735  -5.748  -9.001
  285    HE   ARG  35           HE       ARG  35  -2.871  -7.489  -8.842
  286   HH11  ARG  35          HH11      ARG  35  -6.214  -8.142  -8.014
  287   HH12  ARG  35          HH12      ARG  35  -6.113  -9.826  -8.415
  288   HH21  ARG  35          HH21      ARG  35  -2.731  -9.696  -9.344
  289   HH22  ARG  35          HH22      ARG  35  -4.125 -10.717  -9.169
  290    H    LYS  36           H        LYS  36  -1.280  -3.599  -5.945
  291    HA   LYS  36           HA       LYS  36   0.744  -4.804  -7.437
  292    HB2  LYS  36           HB2      LYS  36   0.456  -2.028  -6.337
  293    HB3  LYS  36           HB3      LYS  36   1.689  -2.513  -7.460
  294    HG2  LYS  36           HG2      LYS  36  -0.272  -3.172  -8.960
  295    HG3  LYS  36           HG3      LYS  36  -1.234  -2.263  -7.890
  296    HD2  LYS  36           HD2      LYS  36  -0.319  -0.384  -8.543
  297    HD3  LYS  36           HD3      LYS  36   1.208  -1.071  -9.018
  298    HE2  LYS  36           HE2      LYS  36  -0.157  -0.277 -10.913
  299    HE3  LYS  36           HE3      LYS  36   0.190  -1.997 -10.994
  300    HZ1  LYS  36           HZ1      LYS  36  -2.096  -1.577 -11.558
  301    HZ2  LYS  36           HZ2      LYS  36  -2.354  -0.735 -10.112
  302    HZ3  LYS  36           HZ3      LYS  36  -2.040  -2.405 -10.083
  303    H    VAL  37           H        VAL  37   0.527  -3.326  -4.337
  304    HA   VAL  37           HA       VAL  37   3.160  -3.141  -3.634
  305    HB   VAL  37           HB       VAL  37   2.428  -3.153  -1.308
  306   HG11  VAL  37          HG11      VAL  37   1.158  -1.159  -1.356
  307   HG12  VAL  37          HG12      VAL  37   0.403  -1.598  -2.888
  308   HG13  VAL  37          HG13      VAL  37   2.107  -1.135  -2.844
  309   HG21  VAL  37          HG21      VAL  37  -0.147  -3.218  -1.048
  310   HG22  VAL  37          HG22      VAL  37   0.819  -4.693  -1.009
  311   HG23  VAL  37          HG23      VAL  37  -0.050  -4.246  -2.485
  312    H    ILE  38           H        ILE  38   0.943  -5.762  -3.058
  313    HA   ILE  38           HA       ILE  38   2.521  -7.461  -1.509
  314    HB   ILE  38           HB       ILE  38   0.570  -8.496  -3.545
  315   HG12  ILE  38          HG12      ILE  38  -0.082  -6.923  -1.072
  316   HG13  ILE  38          HG13      ILE  38  -0.644  -6.652  -2.705
  317   HG21  ILE  38          HG21      ILE  38  -0.007 -10.044  -1.674
  318   HG22  ILE  38          HG22      ILE  38   1.324  -9.329  -0.766
  319   HG23  ILE  38          HG23      ILE  38   1.645 -10.180  -2.272
  320   HD11  ILE  38          HD11      ILE  38  -1.370  -9.151  -1.244
  321   HD12  ILE  38          HD12      ILE  38  -2.185  -8.374  -2.601
  322   HD13  ILE  38          HD13      ILE  38  -2.265  -7.654  -0.991
  323    H    SER  39           H        SER  39   2.086  -6.908  -4.868
  324    HA   SER  39           HA       SER  39   3.547  -9.181  -5.693
  325    HB2  SER  39           HB2      SER  39   1.735  -8.243  -7.074
  326    HB3  SER  39           HB3      SER  39   2.678  -6.772  -7.298
  327    HG   SER  39           HG       SER  39   3.462  -9.376  -8.127
  328    H    THR  40           H        THR  40   4.261  -5.972  -4.867
  329    HA   THR  40           HA       THR  40   6.768  -5.760  -6.255
  330    HB   THR  40           HB       THR  40   5.519  -4.035  -4.106
  331    HG1  THR  40           HG1      THR  40   4.371  -4.223  -6.153
  332   HG21  THR  40          HG21      THR  40   7.781  -3.383  -5.994
  333   HG22  THR  40          HG22      THR  40   7.957  -3.721  -4.273
  334   HG23  THR  40          HG23      THR  40   7.059  -2.298  -4.804
  335    H    SER  41           H        SER  41   5.717  -6.195  -2.890
  336    HA   SER  41           HA       SER  41   8.411  -6.189  -1.913
  337    HB2  SER  41           HB2      SER  41   6.586  -5.192  -0.645
  338    HB3  SER  41           HB3      SER  41   5.882  -6.784  -0.496
  339    HG   SER  41           HG       SER  41   7.188  -6.023   1.321
  340    H    THR  42           H        THR  42   5.796  -8.613  -1.819
  341    HA   THR  42           HA       THR  42   7.572 -10.537  -0.661
  342    HB   THR  42           HB       THR  42   5.684 -12.078  -0.685
  343    HG1  THR  42           HG1      THR  42   4.433 -10.050  -2.258
  344   HG21  THR  42          HG21      THR  42   4.116 -10.766   0.681
  345   HG22  THR  42          HG22      THR  42   4.897  -9.281   0.136
  346   HG23  THR  42          HG23      THR  42   5.795 -10.440   1.115
  347    H    SER  43           H        SER  43   7.955  -9.496  -3.503
  348    HA   SER  43           HA       SER  43   7.828 -11.877  -5.111
  349    HB2  SER  43           HB2      SER  43   7.650  -9.554  -6.056
  350    HB3  SER  43           HB3      SER  43   9.344  -9.307  -5.641
  351    HG   SER  43           HG       SER  43   8.575 -11.515  -7.208
  352    H    ASP  44           H        ASP  44  10.170 -10.162  -3.150
  353    HA   ASP  44           HA       ASP  44  11.785 -12.410  -2.732
  354    HB2  ASP  44           HB2      ASP  44  12.510 -12.094  -5.047
  355    HB3  ASP  44           HB3      ASP  44  12.973 -10.434  -4.692
  356    HA   PRO  45           HA       PRO  45  14.152  -8.576  -1.027
  357    HB2  PRO  45           HB2      PRO  45  12.374  -6.298  -1.287
  358    HB3  PRO  45           HB3      PRO  45  14.029  -6.458  -1.787
  359    HG2  PRO  45           HG2      PRO  45  11.942  -6.290  -3.462
  360    HG3  PRO  45           HG3      PRO  45  13.426  -7.135  -3.797
  361    HD2  PRO  45           HD2      PRO  45  10.808  -8.228  -3.034
  362    HD3  PRO  45           HD3      PRO  45  11.995  -8.881  -4.164
  363    H    ASP  46           H        ASP  46  14.138  -7.592   0.996
  364    HA   ASP  46           HA       ASP  46  11.738  -7.309   2.549
  365    HB2  ASP  46           HB2      ASP  46  11.983  -9.700   2.812
  366    HB3  ASP  46           HB3      ASP  46  13.699  -9.531   3.167
  367    H    TYR  47           H        TYR  47  15.233  -7.832   2.799
  368    HA   TYR  47           HA       TYR  47  15.412  -5.442   4.503
  369    HB2  TYR  47           HB2      TYR  47  17.595  -6.446   5.276
  370    HB3  TYR  47           HB3      TYR  47  16.154  -7.333   5.753
  371    HD1  TYR  47           HD1      TYR  47  15.659  -9.510   4.795
  372    HD2  TYR  47           HD2      TYR  47  19.163  -7.381   3.684
  373    HE1  TYR  47           HE1      TYR  47  16.589 -11.568   3.818
  374    HE2  TYR  47           HE2      TYR  47  20.104  -9.428   2.699
  375    HH   TYR  47           HH       TYR  47  19.836 -11.879   2.973
  376    H    ALA  48           H        ALA  48  15.273  -5.474   1.651
  377    HA   ALA  48           HA       ALA  48  16.207  -4.562  -0.192
  378    HB1  ALA  48           HB1      ALA  48  17.936  -2.863   0.081
  379    HB2  ALA  48           HB2      ALA  48  18.203  -3.388   1.744
  380    HB3  ALA  48           HB3      ALA  48  16.660  -2.665   1.284
  381    H1   SER   0           H1       SER   0  -1.592  16.251  -8.616
  382    H2   SER   0           H2       SER   0  -1.499  17.419  -7.403
  383    H3   SER   0           H3       SER   0  -1.240  15.793  -7.029
  384    HA   SER   0           HA       SER   0   0.733  15.763  -8.394
  385    HB2  SER   0           HB2      SER   0   1.571  18.069  -9.129
  386    HB3  SER   0           HB3      SER   0   0.234  17.386 -10.052
  387    HG   SER   0           HG       SER   0   0.205  19.470  -8.149
  388    H    MET   1           H        MET   1   1.384  15.133  -6.329
  389    HA   MET   1           HA       MET   1   2.545  17.302  -4.712
  390    HB2  MET   1           HB2      MET   1   1.122  14.830  -3.706
  391    HB3  MET   1           HB3      MET   1   2.079  15.893  -2.686
  392    HG2  MET   1           HG2      MET   1  -0.391  16.680  -4.217
  393    HG3  MET   1           HG3      MET   1  -0.310  16.339  -2.489
  394    HE1  MET   1           HE1      MET   1   2.498  17.683  -1.715
  395    HE2  MET   1           HE2      MET   1   1.033  17.843  -0.747
  396    HE3  MET   1           HE3      MET   1   1.953  19.278  -1.200
  397    H    ASP   2           H        ASP   2   3.763  15.795  -6.774
  398    HA   ASP   2           HA       ASP   2   5.391  13.759  -5.460
  399    HB2  ASP   2           HB2      ASP   2   5.514  14.676  -8.342
  400    HB3  ASP   2           HB3      ASP   2   6.155  13.183  -7.670
  401    H    GLU   3           H        GLU   3   6.334  15.506  -4.070
  402    HA   GLU   3           HA       GLU   3   8.729  16.629  -5.275
  403    HB2  GLU   3           HB2      GLU   3   6.903  18.281  -5.676
  404    HB3  GLU   3           HB3      GLU   3   6.705  18.415  -3.935
  405    HG2  GLU   3           HG2      GLU   3   8.043  20.217  -4.953
  406    HG3  GLU   3           HG3      GLU   3   8.883  19.341  -3.685
  407    H    THR   4           H        THR   4  10.181  17.550  -3.676
  408    HA   THR   4           HA       THR   4  11.384  17.480  -1.778
  409    HB   THR   4           HB       THR   4  10.075  17.851   0.388
  410    HG1  THR   4           HG1      THR   4   8.053  17.102  -1.043
  411   HG21  THR   4          HG21      THR   4   9.599  20.185  -0.197
  412   HG22  THR   4          HG22      THR   4   9.746  19.780  -1.906
  413   HG23  THR   4          HG23      THR   4  11.148  19.650  -0.848
  414    H    VAL   5           H        VAL   5  11.964  15.274  -2.264
  415    HA   VAL   5           HA       VAL   5  11.643  13.696   0.113
  416    HB   VAL   5           HB       VAL   5   9.754  12.838  -1.116
  417   HG11  VAL   5          HG11      VAL   5  10.397  13.495  -3.352
  418   HG12  VAL   5          HG12      VAL   5  10.000  11.777  -3.308
  419   HG13  VAL   5          HG13      VAL   5  11.685  12.293  -3.356
  420   HG21  VAL   5          HG21      VAL   5  12.068  10.909  -1.208
  421   HG22  VAL   5          HG22      VAL   5  10.361  10.468  -1.266
  422   HG23  VAL   5          HG23      VAL   5  11.029  11.228   0.179
  423    H    LYS   6           H        LYS   6  13.624  13.031   0.650
  424    HA   LYS   6           HA       LYS   6  15.531  12.276  -1.408
  425    HB2  LYS   6           HB2      LYS   6  15.782  14.706  -1.222
  426    HB3  LYS   6           HB3      LYS   6  16.065  14.528   0.492
  427    HG2  LYS   6           HG2      LYS   6  18.085  13.244   0.035
  428    HG3  LYS   6           HG3      LYS   6  17.800  13.464  -1.686
  429    HD2  LYS   6           HD2      LYS   6  18.005  15.871  -1.441
  430    HD3  LYS   6           HD3      LYS   6  18.222  15.685   0.296
  431    HE2  LYS   6           HE2      LYS   6  20.271  14.438  -0.071
  432    HE3  LYS   6           HE3      LYS   6  20.045  14.579  -1.810
  433    HZ1  LYS   6           HZ1      LYS   6  20.457  16.836   0.064
  434    HZ2  LYS   6           HZ2      LYS   6  20.230  16.977  -1.604
  435    HZ3  LYS   6           HZ3      LYS   6  21.613  16.216  -1.000
  436    H    LEU   7           H        LEU   7  17.061  10.867  -0.733
  437    HA   LEU   7           HA       LEU   7  18.108   9.317   0.526
  438    HB2  LEU   7           HB2      LEU   7  17.409  11.103   2.810
  439    HB3  LEU   7           HB3      LEU   7  18.441   9.708   2.950
  440    HG   LEU   7           HG       LEU   7  18.999  12.182   1.319
  441   HD11  LEU   7          HD11      LEU   7  20.786  12.562   2.936
  442   HD12  LEU   7          HD12      LEU   7  20.258  11.153   3.854
  443   HD13  LEU   7          HD13      LEU   7  19.204  12.560   3.713
  444   HD21  LEU   7          HD21      LEU   7  20.635   9.701   1.763
  445   HD22  LEU   7          HD22      LEU   7  21.203  11.166   0.965
  446   HD23  LEU   7          HD23      LEU   7  19.903  10.217   0.248
  447    H    ASN   8           H        ASN   8  15.752  10.140   3.013
  448    HA   ASN   8           HA       ASN   8  14.599   7.500   2.997
  449    HB2  ASN   8           HB2      ASN   8  12.871   8.555   4.495
  450    HB3  ASN   8           HB3      ASN   8  14.488   8.770   5.099
  451   HD21  ASN   8          HD21      ASN   8  15.183  10.762   5.444
  452   HD22  ASN   8          HD22      ASN   8  14.246  12.163   5.107
  453    H    HIS   9           H        HIS   9  12.504   6.987   2.274
  454    HA   HIS   9           HA       HIS   9  11.151   9.080   0.709
  455    HB2  HIS   9           HB2      HIS   9  10.570   6.120   0.679
  456    HB3  HIS   9           HB3      HIS   9   9.859   7.336  -0.364
  457    HD1  HIS   9           HD1      HIS   9  12.625   4.965  -0.204
  458    HD2  HIS   9           HD2      HIS   9  11.793   8.505  -2.218
  459    HE1  HIS   9           HE1      HIS   9  14.261   5.064  -2.106
  460    HE2  HIS   9           HE2      HIS   9  13.828   7.274  -3.230
  461    H    THR  10           H        THR  10   9.365   9.890   1.590
  462    HA   THR  10           HA       THR  10   8.739   9.072   4.279
  463    HB   THR  10           HB       THR  10   7.403  11.194   2.569
  464    HG1  THR  10           HG1      THR  10   9.835  11.133   3.665
  465   HG21  THR  10          HG21      THR  10   6.004  10.482   4.462
  466   HG22  THR  10          HG22      THR  10   6.623  12.112   4.717
  467   HG23  THR  10          HG23      THR  10   7.354  10.752   5.564
  468    H    CYS  11           H        CYS  11   7.082   7.874   4.942
  469    HA   CYS  11           HA       CYS  11   5.674   6.330   3.052
  470    HB2  CYS  11           HB2      CYS  11   6.145   5.458   5.250
  471    HB3  CYS  11           HB3      CYS  11   5.241   6.767   6.003
  472    H    VAL  12           H        VAL  12   3.825   6.638   2.034
  473    HA   VAL  12           HA       VAL  12   2.267   8.988   2.215
  474    HB   VAL  12           HB       VAL  12   0.616   7.779   0.813
  475   HG11  VAL  12          HG11      VAL  12   2.451   8.848  -0.318
  476   HG12  VAL  12          HG12      VAL  12   2.087   7.313  -1.111
  477   HG13  VAL  12          HG13      VAL  12   3.484   7.446  -0.040
  478   HG21  VAL  12          HG21      VAL  12   1.135   5.495   0.046
  479   HG22  VAL  12          HG22      VAL  12   0.768   5.574   1.768
  480   HG23  VAL  12          HG23      VAL  12   2.440   5.420   1.231
  481    H    ILE  13           H        ILE  13   2.286   6.118   4.065
  482    HA   ILE  13           HA       ILE  13  -0.501   6.343   4.926
  483    HB   ILE  13           HB       ILE  13   1.496   4.269   5.732
  484   HG12  ILE  13          HG12      ILE  13   1.372   4.408   3.281
  485   HG13  ILE  13          HG13      ILE  13   0.725   2.904   3.911
  486   HG21  ILE  13          HG21      ILE  13  -1.506   4.280   5.629
  487   HG22  ILE  13          HG22      ILE  13  -0.507   4.352   7.080
  488   HG23  ILE  13          HG23      ILE  13  -0.507   2.899   6.080
  489   HD11  ILE  13          HD11      ILE  13  -0.956   5.261   3.190
  490   HD12  ILE  13          HD12      ILE  13  -1.493   3.626   3.582
  491   HD13  ILE  13          HD13      ILE  13  -0.592   3.929   2.093
  492    H    CYS  14           H        CYS  14   2.648   5.825   6.437
  493    HA   CYS  14           HA       CYS  14   1.511   6.593   8.975
  494    HB2  CYS  14           HB2      CYS  14   4.260   5.532   8.653
  495    HB3  CYS  14           HB3      CYS  14   3.143   5.319   9.976
  496    H    ASP  15           H        ASP  15   3.180   7.984   6.500
  497    HA   ASP  15           HA       ASP  15   4.147  10.004   6.144
  498    HB2  ASP  15           HB2      ASP  15   2.042  10.553   7.386
  499    HB3  ASP  15           HB3      ASP  15   3.040  10.845   8.794
  500    H    GLN  16           H        GLN  16   5.799   8.208   7.138
  501    HA   GLN  16           HA       GLN  16   7.576   9.717   8.903
  502    HB2  GLN  16           HB2      GLN  16   7.163   6.734   8.745
  503    HB3  GLN  16           HB3      GLN  16   8.401   7.517   9.707
  504    HG2  GLN  16           HG2      GLN  16   5.451   7.777  10.039
  505    HG3  GLN  16           HG3      GLN  16   6.546   6.892  11.077
  506   HE21  GLN  16          HE21      GLN  16   4.740   9.002  11.773
  507   HE22  GLN  16          HE22      GLN  16   5.698  10.269  12.438
  508    H    GLU  17           H        GLU  17   9.775   9.579   8.467
  509    HA   GLU  17           HA       GLU  17  10.416   9.246   5.681
  510    HB2  GLU  17           HB2      GLU  17  12.148  10.168   7.971
  511    HB3  GLU  17           HB3      GLU  17  12.596  10.190   6.275
  512    HG2  GLU  17           HG2      GLU  17  10.965  11.795   5.750
  513    HG3  GLU  17           HG3      GLU  17  10.196  11.620   7.323
  514    H    LYS  18           H        LYS  18  10.710   7.338   5.059
  515    HA   LYS  18           HA       LYS  18  12.284   5.445   6.673
  516    HB2  LYS  18           HB2      LYS  18  10.309   4.442   4.742
  517    HB3  LYS  18           HB3      LYS  18  10.872   3.714   6.214
  518    HG2  LYS  18           HG2      LYS  18   8.906   5.960   5.966
  519    HG3  LYS  18           HG3      LYS  18   8.563   4.298   6.439
  520    HD2  LYS  18           HD2      LYS  18  10.488   5.944   7.987
  521    HD3  LYS  18           HD3      LYS  18   8.780   6.125   8.237
  522    HE2  LYS  18           HE2      LYS  18   9.678   4.617   9.867
  523    HE3  LYS  18           HE3      LYS  18   8.630   3.772   8.755
  524    HZ1  LYS  18           HZ1      LYS  18  10.477   2.798   7.671
  525    HZ2  LYS  18           HZ2      LYS  18  10.723   2.589   9.328
  526    HZ3  LYS  18           HZ3      LYS  18  11.573   3.786   8.495
  527    H    ASN  19           H        ASN  19  13.954   4.447   5.675
  528    HA   ASN  19           HA       ASN  19  14.247   4.980   2.813
  529    HB2  ASN  19           HB2      ASN  19  16.567   4.553   3.045
  530    HB3  ASN  19           HB3      ASN  19  16.115   5.531   4.429
  531   HD21  ASN  19          HD21      ASN  19  18.360   3.696   3.996
  532   HD22  ASN  19          HD22      ASN  19  18.279   2.542   5.321
  533    H    ARG  20           H        ARG  20  12.876   2.713   4.700
  534    HA   ARG  20           HA       ARG  20  13.365   0.604   2.716
  535    HB2  ARG  20           HB2      ARG  20  13.328   0.350   5.699
  536    HB3  ARG  20           HB3      ARG  20  12.950  -1.021   4.693
  537    HG2  ARG  20           HG2      ARG  20  15.123  -0.757   3.584
  538    HG3  ARG  20           HG3      ARG  20  15.510   0.501   4.749
  539    HD2  ARG  20           HD2      ARG  20  15.129  -1.041   6.505
  540    HD3  ARG  20           HD3      ARG  20  14.672  -2.295   5.400
  541    HE   ARG  20           HE       ARG  20  17.314  -1.291   4.916
  542   HH11  ARG  20          HH11      ARG  20  15.419  -3.546   6.799
  543   HH12  ARG  20          HH12      ARG  20  16.749  -4.620   7.100
  544   HH21  ARG  20          HH21      ARG  20  19.074  -2.720   5.289
  545   HH22  ARG  20          HH22      ARG  20  18.822  -4.152   6.238
  546    H    GLY  21           H        GLY  21  11.682  -0.551   2.044
  547    HA2  GLY  21           HA2      GLY  21   9.245  -1.179   2.753
  548    HA3  GLY  21           HA3      GLY  21   9.000   0.556   2.555
  549    H    ILE  22           H        ILE  22   7.612   0.242   0.599
  550    HA   ILE  22           HA       ILE  22   9.238  -0.613  -1.697
  551    HB   ILE  22           HB       ILE  22   7.504  -1.765  -2.691
  552   HG12  ILE  22          HG12      ILE  22   5.669  -0.287  -0.845
  553   HG13  ILE  22          HG13      ILE  22   5.902   0.020  -2.531
  554   HG21  ILE  22          HG21      ILE  22   8.191  -3.088  -0.822
  555   HG22  ILE  22          HG22      ILE  22   6.435  -3.225  -0.967
  556   HG23  ILE  22          HG23      ILE  22   7.141  -2.185   0.271
  557   HD11  ILE  22          HD11      ILE  22   4.745  -2.479  -1.375
  558   HD12  ILE  22          HD12      ILE  22   4.959  -2.122  -3.090
  559   HD13  ILE  22          HD13      ILE  22   3.840  -1.164  -2.119
  560    H    HIS  23           H        HIS  23   7.706   0.082  -3.708
  561    HA   HIS  23           HA       HIS  23   6.804   2.774  -3.443
  562    HB2  HIS  23           HB2      HIS  23   8.569   3.740  -4.959
  563    HB3  HIS  23           HB3      HIS  23   9.122   3.326  -3.353
  564    HD1  HIS  23           HD1      HIS  23   9.550   2.417  -6.954
  565    HD2  HIS  23           HD2      HIS  23  10.959   1.275  -3.236
  566    HE1  HIS  23           HE1      HIS  23  11.567   0.991  -7.418
  567    HE2  HIS  23           HE2      HIS  23  12.303   0.169  -5.153
  568    H    LEU  24           H        LEU  24   5.064   2.678  -4.679
  569    HA   LEU  24           HA       LEU  24   5.270   1.566  -7.359
  570    HB2  LEU  24           HB2      LEU  24   2.831   2.440  -5.819
  571    HB3  LEU  24           HB3      LEU  24   2.887   1.593  -7.316
  572    HG   LEU  24           HG       LEU  24   3.911   0.412  -4.768
  573   HD11  LEU  24          HD11      LEU  24   1.213   0.177  -6.079
  574   HD12  LEU  24          HD12      LEU  24   1.575   0.807  -4.471
  575   HD13  LEU  24          HD13      LEU  24   1.802  -0.907  -4.821
  576   HD21  LEU  24          HD21      LEU  24   4.846  -0.576  -6.780
  577   HD22  LEU  24          HD22      LEU  24   3.228  -0.790  -7.448
  578   HD23  LEU  24          HD23      LEU  24   3.718  -1.695  -6.015
  579    H    TYR  25           H        TYR  25   4.897   2.902  -9.095
  580    HA   TYR  25           HA       TYR  25   4.809   4.830 -10.281
  581    HB2  TYR  25           HB2      TYR  25   3.185   5.872  -7.987
  582    HB3  TYR  25           HB3      TYR  25   3.252   6.574  -9.587
  583    HD1  TYR  25           HD1      TYR  25   0.959   6.400 -10.287
  584    HD2  TYR  25           HD2      TYR  25   2.936   2.984  -8.706
  585    HE1  TYR  25           HE1      TYR  25  -0.958   4.990 -10.931
  586    HE2  TYR  25           HE2      TYR  25   1.055   1.576  -9.338
  587    HH   TYR  25           HH       TYR  25  -1.549   2.025  -9.790
  588    H    THR  26           H        THR  26   4.520   7.194  -7.935
  589    HA   THR  26           HA       THR  26   7.440   7.524  -7.860
  590    HB   THR  26           HB       THR  26   7.173   9.849  -7.774
  591    HG1  THR  26           HG1      THR  26   4.843  10.656  -7.514
  592   HG21  THR  26          HG21      THR  26   5.672  10.415  -9.613
  593   HG22  THR  26          HG22      THR  26   4.862   8.857  -9.441
  594   HG23  THR  26          HG23      THR  26   6.547   8.926  -9.966
  595    H    LYS  27           H        LYS  27   5.109   6.255  -5.948
  596    HA   LYS  27           HA       LYS  27   5.675   7.968  -3.629
  597    HB2  LYS  27           HB2      LYS  27   3.539   5.998  -3.318
  598    HB3  LYS  27           HB3      LYS  27   3.585   7.687  -2.863
  599    HG2  LYS  27           HG2      LYS  27   2.986   6.568  -5.570
  600    HG3  LYS  27           HG3      LYS  27   1.848   7.296  -4.444
  601    HD2  LYS  27           HD2      LYS  27   4.165   8.735  -5.708
  602    HD3  LYS  27           HD3      LYS  27   2.499   8.810  -6.279
  603    HE2  LYS  27           HE2      LYS  27   2.846   9.384  -3.423
  604    HE3  LYS  27           HE3      LYS  27   3.592  10.557  -4.506
  605    HZ1  LYS  27           HZ1      LYS  27   0.734   9.732  -4.424
  606    HZ2  LYS  27           HZ2      LYS  27   1.390  10.685  -5.656
  607    HZ3  LYS  27           HZ3      LYS  27   1.372  11.258  -4.066
  608    H    PHE  28           H        PHE  28   4.975   6.531  -1.600
  609    HA   PHE  28           HA       PHE  28   6.584   4.113  -1.546
  610    HB2  PHE  28           HB2      PHE  28   8.239   5.852  -1.232
  611    HB3  PHE  28           HB3      PHE  28   7.264   6.610   0.019
  612    HD1  PHE  28           HD1      PHE  28   7.359   5.899   2.243
  613    HD2  PHE  28           HD2      PHE  28   9.282   3.616  -0.778
  614    HE1  PHE  28           HE1      PHE  28   8.491   4.577   3.966
  615    HE2  PHE  28           HE2      PHE  28  10.406   2.271   0.949
  616    HZ   PHE  28           HZ       PHE  28   9.996   2.736   3.342
  617    H    ILE  29           H        ILE  29   5.131   2.783  -0.671
  618    HA   ILE  29           HA       ILE  29   3.805   3.511   1.846
  619    HB   ILE  29           HB       ILE  29   3.815   0.869   0.345
  620   HG12  ILE  29          HG12      ILE  29   1.246   1.632   0.225
  621   HG13  ILE  29          HG13      ILE  29   2.008   3.221   0.247
  622   HG21  ILE  29          HG21      ILE  29   2.161   1.684   2.744
  623   HG22  ILE  29          HG22      ILE  29   3.548   0.584   2.766
  624   HG23  ILE  29          HG23      ILE  29   2.076   0.144   1.882
  625   HD11  ILE  29          HD11      ILE  29   1.583   2.331  -2.022
  626   HD12  ILE  29          HD12      ILE  29   2.723   1.031  -1.684
  627   HD13  ILE  29          HD13      ILE  29   3.278   2.706  -1.713
  628    H    CYS  30           H        CYS  30   4.987   3.184   3.722
  629    HA   CYS  30           HA       CYS  30   7.513   1.908   3.367
  630    HB2  CYS  30           HB2      CYS  30   8.144   2.556   5.520
  631    HB3  CYS  30           HB3      CYS  30   7.161   3.859   4.909
  632    H    LEU  31           H        LEU  31   8.242   0.264   4.876
  633    HA   LEU  31           HA       LEU  31   7.180  -2.020   3.853
  634    HB2  LEU  31           HB2      LEU  31   8.897  -3.091   4.947
  635    HB3  LEU  31           HB3      LEU  31   9.496  -1.490   4.707
  636    HG   LEU  31           HG       LEU  31   8.588  -1.158   7.173
  637   HD11  LEU  31          HD11      LEU  31   7.678  -3.412   7.398
  638   HD12  LEU  31          HD12      LEU  31   8.995  -3.141   8.539
  639   HD13  LEU  31          HD13      LEU  31   9.274  -4.093   7.082
  640   HD21  LEU  31          HD21      LEU  31  10.855  -1.611   7.955
  641   HD22  LEU  31          HD22      LEU  31  10.869  -0.778   6.402
  642   HD23  LEU  31          HD23      LEU  31  11.189  -2.511   6.477
  643    H    ASP  32           H        ASP  32   6.039  -0.354   6.557
  644    HA   ASP  32           HA       ASP  32   5.208  -2.611   8.084
  645    HB2  ASP  32           HB2      ASP  32   4.816  -1.063   9.651
  646    HB3  ASP  32           HB3      ASP  32   5.980  -0.173   8.756
  647    H    CYS  33           H        CYS  33   3.720   0.005   6.434
  648    HA   CYS  33           HA       CYS  33   1.075  -0.830   6.554
  649    HB2  CYS  33           HB2      CYS  33   0.945   0.984   4.674
  650    HB3  CYS  33           HB3      CYS  33   1.260   1.461   6.326
  651    H    GLU  34           H        GLU  34   3.684  -1.172   4.413
  652    HA   GLU  34           HA       GLU  34   2.365  -1.996   2.115
  653    HB2  GLU  34           HB2      GLU  34   4.709  -1.500   2.060
  654    HB3  GLU  34           HB3      GLU  34   5.068  -2.752   3.208
  655    HG2  GLU  34           HG2      GLU  34   3.790  -3.622   0.728
  656    HG3  GLU  34           HG3      GLU  34   5.426  -3.033   0.593
  657    H    ARG  35           H        ARG  35   3.497  -3.930   4.842
  658    HA   ARG  35           HA       ARG  35   2.176  -6.249   3.824
  659    HB2  ARG  35           HB2      ARG  35   2.618  -7.295   6.036
  660    HB3  ARG  35           HB3      ARG  35   4.053  -6.671   5.240
  661    HG2  ARG  35           HG2      ARG  35   4.014  -4.714   6.685
  662    HG3  ARG  35           HG3      ARG  35   2.563  -5.323   7.464
  663    HD2  ARG  35           HD2      ARG  35   5.201  -6.696   7.415
  664    HD3  ARG  35           HD3      ARG  35   4.555  -5.799   8.778
  665    HE   ARG  35           HE       ARG  35   2.660  -7.506   8.627
  666   HH11  ARG  35          HH11      ARG  35   5.991  -8.224   7.797
  667   HH12  ARG  35          HH12      ARG  35   5.857  -9.904   8.203
  668   HH21  ARG  35          HH21      ARG  35   2.481  -9.717   9.144
  669   HH22  ARG  35          HH22      ARG  35   3.862 -10.755   8.968
  670    H    LYS  36           H        LYS  36   1.137  -3.597   5.719
  671    HA   LYS  36           HA       LYS  36  -0.907  -4.766   7.215
  672    HB2  LYS  36           HB2      LYS  36  -0.571  -1.998   6.102
  673    HB3  LYS  36           HB3      LYS  36  -1.814  -2.457   7.227
  674    HG2  LYS  36           HG2      LYS  36   0.133  -3.146   8.730
  675    HG3  LYS  36           HG3      LYS  36   1.113  -2.258   7.656
  676    HD2  LYS  36           HD2      LYS  36   0.228  -0.359   8.302
  677    HD3  LYS  36           HD3      LYS  36  -1.308  -1.019   8.781
  678    HE2  LYS  36           HE2      LYS  36   0.075  -0.243  10.673
  679    HE3  LYS  36           HE3      LYS  36  -0.304  -1.957  10.758
  680    HZ1  LYS  36           HZ1      LYS  36   1.990  -1.581  11.317
  681    HZ2  LYS  36           HZ2      LYS  36   2.263  -0.751   9.869
  682    HZ3  LYS  36           HZ3      LYS  36   1.913  -2.411   9.844
  683    H    VAL  37           H        VAL  37  -0.667  -3.302   4.110
  684    HA   VAL  37           HA       VAL  37  -3.295  -3.073   3.407
  685    HB   VAL  37           HB       VAL  37  -2.565  -3.108   1.080
  686   HG11  VAL  37          HG11      VAL  37  -1.260  -1.136   1.120
  687   HG12  VAL  37          HG12      VAL  37  -0.510  -1.583   2.652
  688   HG13  VAL  37          HG13      VAL  37  -2.206  -1.089   2.609
  689   HG21  VAL  37          HG21      VAL  37   0.009  -3.218   0.820
  690   HG22  VAL  37          HG22      VAL  37  -0.983  -4.676   0.784
  691   HG23  VAL  37          HG23      VAL  37  -0.106  -4.239   2.259
  692    H    ILE  38           H        ILE  38  -1.125  -5.736   2.838
  693    HA   ILE  38           HA       ILE  38  -2.734  -7.413   1.296
  694    HB   ILE  38           HB       ILE  38  -0.799  -8.474   3.335
  695   HG12  ILE  38          HG12      ILE  38  -0.119  -6.919   0.857
  696   HG13  ILE  38          HG13      ILE  38   0.446  -6.655   2.489
  697   HG21  ILE  38          HG21      ILE  38  -0.249 -10.038   1.469
  698   HG22  ILE  38          HG22      ILE  38  -1.567  -9.303   0.556
  699   HG23  ILE  38          HG23      ILE  38  -1.904 -10.143   2.065
  700   HD11  ILE  38          HD11      ILE  38   1.129  -9.171   1.036
  701   HD12  ILE  38          HD12      ILE  38   1.958  -8.403   2.390
  702   HD13  ILE  38          HD13      ILE  38   2.050  -7.691   0.777
  703    H    SER  39           H        SER  39  -2.286  -6.856   4.653
  704    HA   SER  39           HA       SER  39  -3.788  -9.098   5.485
  705    HB2  SER  39           HB2      SER  39  -1.951  -8.187   6.855
  706    HB3  SER  39           HB3      SER  39  -2.873  -6.703   7.084
  707    HG   SER  39           HG       SER  39  -3.710  -9.291   7.907
  708    H    THR  40           H        THR  40  -4.443  -5.880   4.650
  709    HA   THR  40           HA       THR  40  -6.948  -5.621   6.037
  710    HB   THR  40           HB       THR  40  -5.669  -3.925   3.882
  711    HG1  THR  40           HG1      THR  40  -4.530  -4.117   5.936
  712   HG21  THR  40          HG21      THR  40  -7.926  -3.231   5.766
  713   HG22  THR  40          HG22      THR  40  -8.106  -3.572   4.045
  714   HG23  THR  40          HG23      THR  40  -7.186  -2.162   4.572
  715    H    SER  41           H        SER  41  -5.904  -6.081   2.671
  716    HA   SER  41           HA       SER  41  -8.598  -6.037   1.697
  717    HB2  SER  41           HB2      SER  41  -6.763  -5.077   0.417
  718    HB3  SER  41           HB3      SER  41  -6.081  -6.680   0.281
  719    HG   SER  41           HG       SER  41  -7.395  -5.898  -1.540
  720    H    THR  42           H        THR  42  -6.026  -8.508   1.604
  721    HA   THR  42           HA       THR  42  -7.837 -10.405   0.457
  722    HB   THR  42           HB       THR  42  -5.975 -11.977   0.492
  723    HG1  THR  42           HG1      THR  42  -4.689  -9.955   2.048
  724   HG21  THR  42          HG21      THR  42  -4.386 -10.698  -0.882
  725   HG22  THR  42          HG22      THR  42  -5.141  -9.197  -0.343
  726   HG23  THR  42          HG23      THR  42  -6.059 -10.345  -1.317
  727    H    SER  43           H        SER  43  -8.198  -9.344   3.300
  728    HA   SER  43           HA       SER  43  -8.112 -11.722   4.915
  729    HB2  SER  43           HB2      SER  43  -7.895  -9.403   5.858
  730    HB3  SER  43           HB3      SER  43  -9.585  -9.126   5.440
  731    HG   SER  43           HG       SER  43  -8.830 -11.335   7.019
  732    H    ASP  44           H        ASP  44 -10.427  -9.973   2.948
  733    HA   ASP  44           HA       ASP  44 -12.080 -12.195   2.540
  734    HB2  ASP  44           HB2      ASP  44 -12.798 -11.857   4.850
  735    HB3  ASP  44           HB3      ASP  44 -13.231 -10.192   4.487
  736    HA   PRO  45           HA       PRO  45 -14.383  -8.327   0.823
  737    HB2  PRO  45           HB2      PRO  45 -12.529  -6.084   1.031
  738    HB3  PRO  45           HB3      PRO  45 -14.198  -6.192   1.549
  739    HG2  PRO  45           HG2      PRO  45 -12.177  -6.070   3.233
  740    HG3  PRO  45           HG3      PRO  45 -13.670  -6.915   3.617
  741    HD2  PRO  45           HD2      PRO  45 -11.018  -8.023   2.809
  742    HD3  PRO  45           HD3      PRO  45 -12.207  -8.665   3.957
  743    H    ASP  46           H        ASP  46 -14.338  -7.330  -1.185
  744    HA   ASP  46           HA       ASP  46 -11.947  -7.114  -2.762
  745    HB2  ASP  46           HB2      ASP  46 -12.237  -9.503  -3.013
  746    HB3  ASP  46           HB3      ASP  46 -13.951  -9.304  -3.368
  747    H    TYR  47           H        TYR  47 -15.451  -7.581  -3.012
  748    HA   TYR  47           HA       TYR  47 -15.589  -5.190  -4.719
  749    HB2  TYR  47           HB2      TYR  47 -17.790  -6.158  -5.491
  750    HB3  TYR  47           HB3      TYR  47 -16.364  -7.072  -5.967
  751    HD1  TYR  47           HD1      TYR  47 -15.909  -9.253  -4.999
  752    HD2  TYR  47           HD2      TYR  47 -19.374  -7.060  -3.893
  753    HE1  TYR  47           HE1      TYR  47 -16.872 -11.290  -4.011
  754    HE2  TYR  47           HE2      TYR  47 -20.350  -9.085  -2.899
  755    HH   TYR  47           HH       TYR  47 -20.123 -11.548  -3.157
  756    H    ALA  48           H        ALA  48 -15.455  -5.222  -1.865
  757    HA   ALA  48           HA       ALA  48 -16.365  -4.277  -0.028
  758    HB1  ALA  48           HB1      ALA  48 -18.063  -2.549  -0.308
  759    HB2  ALA  48           HB2      ALA  48 -18.338  -3.075  -1.968
  760    HB3  ALA  48           HB3      ALA  48 -16.785  -2.378  -1.510
  Start of MODEL   12
    1    H1   SER   0           H1       SER   0   3.210  17.388  -9.384
    2    H2   SER   0           H2       SER   0   3.157  15.922  -8.547
    3    H3   SER   0           H3       SER   0   3.493  17.355  -7.718
    4    HA   SER   0           HA       SER   0   1.302  18.185  -8.164
    5    HB2  SER   0           HB2      SER   0   0.830  15.480  -9.440
    6    HB3  SER   0           HB3      SER   0  -0.344  16.786  -9.282
    7    HG   SER   0           HG       SER   0   0.394  17.481 -11.115
    8    H    MET   1           H        MET   1  -0.188  17.934  -6.524
    9    HA   MET   1           HA       MET   1   0.051  15.525  -4.858
   10    HB2  MET   1           HB2      MET   1  -0.051  18.378  -3.856
   11    HB3  MET   1           HB3      MET   1  -0.129  16.947  -2.840
   12    HG2  MET   1           HG2      MET   1   2.120  16.309  -3.603
   13    HG3  MET   1           HG3      MET   1   2.193  17.787  -4.560
   14    HE1  MET   1           HE1      MET   1   0.719  17.172  -0.938
   15    HE2  MET   1           HE2      MET   1   2.115  17.608   0.046
   16    HE3  MET   1           HE3      MET   1   2.187  16.200  -1.013
   17    H    ASP   2           H        ASP   2  -1.841  14.912  -3.778
   18    HA   ASP   2           HA       ASP   2  -4.254  15.896  -5.074
   19    HB2  ASP   2           HB2      ASP   2  -5.328  13.906  -4.324
   20    HB3  ASP   2           HB3      ASP   2  -3.727  13.423  -4.875
   21    H    GLU   3           H        GLU   3  -6.161  16.399  -3.881
   22    HA   GLU   3           HA       GLU   3  -6.138  16.718  -1.068
   23    HB2  GLU   3           HB2      GLU   3  -6.414  19.199  -1.064
   24    HB3  GLU   3           HB3      GLU   3  -4.791  18.647  -1.456
   25    HG2  GLU   3           HG2      GLU   3  -5.253  18.974  -3.815
   26    HG3  GLU   3           HG3      GLU   3  -6.871  19.553  -3.428
   27    H    THR   4           H        THR   4  -8.159  17.580  -0.252
   28    HA   THR   4           HA       THR   4 -10.416  17.750  -0.187
   29    HB   THR   4           HB       THR   4 -10.306  18.463  -3.117
   30    HG1  THR   4           HG1      THR   4  -9.161  19.718  -1.055
   31   HG21  THR   4          HG21      THR   4 -12.549  18.065  -2.239
   32   HG22  THR   4          HG22      THR   4 -12.312  19.781  -2.569
   33   HG23  THR   4          HG23      THR   4 -12.239  19.183  -0.911
   34    H    VAL   5           H        VAL   5 -10.642  15.522   0.179
   35    HA   VAL   5           HA       VAL   5 -11.189  13.772  -2.072
   36    HB   VAL   5           HB       VAL   5 -11.239  13.261   0.910
   37   HG11  VAL   5          HG11      VAL   5 -11.597  11.341  -1.385
   38   HG12  VAL   5          HG12      VAL   5 -12.806  11.778  -0.180
   39   HG13  VAL   5          HG13      VAL   5 -11.371  10.872   0.301
   40   HG21  VAL   5          HG21      VAL   5  -9.005  13.666   0.012
   41   HG22  VAL   5          HG22      VAL   5  -9.267  12.429  -1.218
   42   HG23  VAL   5          HG23      VAL   5  -9.199  11.977   0.485
   43    H    LYS   6           H        LYS   6 -13.162  13.406  -2.868
   44    HA   LYS   6           HA       LYS   6 -15.479  14.019  -1.170
   45    HB2  LYS   6           HB2      LYS   6 -15.134  15.827  -2.814
   46    HB3  LYS   6           HB3      LYS   6 -15.244  14.651  -4.108
   47    HG2  LYS   6           HG2      LYS   6 -17.323  15.855  -3.858
   48    HG3  LYS   6           HG3      LYS   6 -17.530  14.158  -3.446
   49    HD2  LYS   6           HD2      LYS   6 -17.336  14.729  -1.061
   50    HD3  LYS   6           HD3      LYS   6 -17.194  16.426  -1.500
   51    HE2  LYS   6           HE2      LYS   6 -19.409  16.336  -2.528
   52    HE3  LYS   6           HE3      LYS   6 -19.545  14.650  -2.049
   53    HZ1  LYS   6           HZ1      LYS   6 -20.688  16.084  -0.496
   54    HZ2  LYS   6           HZ2      LYS   6 -19.270  16.956  -0.206
   55    HZ3  LYS   6           HZ3      LYS   6 -19.376  15.335   0.265
   56    H    LEU   7           H        LEU   7 -16.335  12.111  -0.742
   57    HA   LEU   7           HA       LEU   7 -17.409  10.141  -1.001
   58    HB2  LEU   7           HB2      LEU   7 -17.393  10.813  -3.905
   59    HB3  LEU   7           HB3      LEU   7 -18.274   9.483  -3.212
   60    HG   LEU   7           HG       LEU   7 -18.752  12.401  -2.605
   61   HD11  LEU   7          HD11      LEU   7 -20.347  10.459  -4.274
   62   HD12  LEU   7          HD12      LEU   7 -19.402  11.816  -4.886
   63   HD13  LEU   7          HD13      LEU   7 -20.816  12.112  -3.875
   64   HD21  LEU   7          HD21      LEU   7 -19.285  10.968  -0.732
   65   HD22  LEU   7          HD22      LEU   7 -20.223   9.910  -1.781
   66   HD23  LEU   7          HD23      LEU   7 -20.766  11.560  -1.481
   67    H    ASN   8           H        ASN   8 -15.532  10.117  -4.010
   68    HA   ASN   8           HA       ASN   8 -14.403   7.539  -3.379
   69    HB2  ASN   8           HB2      ASN   8 -13.611   9.474  -5.571
   70    HB3  ASN   8           HB3      ASN   8 -13.179   7.781  -5.480
   71   HD21  ASN   8          HD21      ASN   8 -14.520   9.181  -7.581
   72   HD22  ASN   8          HD22      ASN   8 -16.040   8.394  -7.795
   73    H    HIS   9           H        HIS   9 -12.514   7.170  -2.363
   74    HA   HIS   9           HA       HIS   9 -11.039   9.463  -1.374
   75    HB2  HIS   9           HB2      HIS   9 -10.940   6.516  -0.765
   76    HB3  HIS   9           HB3      HIS   9  -9.721   7.630  -0.157
   77    HD1  HIS   9           HD1      HIS   9 -10.197   8.392   2.135
   78    HD2  HIS   9           HD2      HIS   9 -13.698   7.592   0.031
   79    HE1  HIS   9           HE1      HIS   9 -12.075   8.822   3.752
   80    HE2  HIS   9           HE2      HIS   9 -14.180   8.264   2.482
   81    H    THR  10           H        THR  10  -9.080  10.090  -2.059
   82    HA   THR  10           HA       THR  10  -8.206   9.197  -4.602
   83    HB   THR  10           HB       THR  10  -6.648  10.910  -2.653
   84    HG1  THR  10           HG1      THR  10  -7.759  12.669  -3.735
   85   HG21  THR  10          HG21      THR  10  -6.678  10.830  -5.678
   86   HG22  THR  10          HG22      THR  10  -5.405  10.184  -4.646
   87   HG23  THR  10          HG23      THR  10  -5.714  11.919  -4.682
   88    H    CYS  11           H        CYS  11  -6.761   7.730  -5.170
   89    HA   CYS  11           HA       CYS  11  -5.491   6.043  -3.271
   90    HB2  CYS  11           HB2      CYS  11  -6.038   5.232  -5.532
   91    HB3  CYS  11           HB3      CYS  11  -4.935   6.407  -6.230
   92    H    VAL  12           H        VAL  12  -3.805   6.623  -2.052
   93    HA   VAL  12           HA       VAL  12  -2.190   8.861  -2.350
   94    HB   VAL  12           HB       VAL  12  -0.516   7.638  -0.932
   95   HG11  VAL  12          HG11      VAL  12  -2.282   8.918   0.118
   96   HG12  VAL  12          HG12      VAL  12  -1.969   7.443   1.036
   97   HG13  VAL  12          HG13      VAL  12  -3.383   7.546  -0.015
   98   HG21  VAL  12          HG21      VAL  12  -0.916   5.391  -1.802
   99   HG22  VAL  12          HG22      VAL  12  -2.533   5.405  -1.098
  100   HG23  VAL  12          HG23      VAL  12  -1.115   5.446  -0.050
  101    H    ILE  13           H        ILE  13  -2.244   6.058  -4.193
  102    HA   ILE  13           HA       ILE  13   0.525   6.207  -5.053
  103    HB   ILE  13           HB       ILE  13  -1.493   4.254  -6.026
  104   HG12  ILE  13          HG12      ILE  13  -1.571   4.231  -3.584
  105   HG13  ILE  13          HG13      ILE  13  -0.840   2.770  -4.222
  106   HG21  ILE  13          HG21      ILE  13   0.442   2.855  -6.384
  107   HG22  ILE  13          HG22      ILE  13   1.482   4.083  -5.660
  108   HG23  ILE  13          HG23      ILE  13   0.655   4.413  -7.183
  109   HD11  ILE  13          HD11      ILE  13   0.726   5.114  -3.251
  110   HD12  ILE  13          HD12      ILE  13   1.316   3.500  -3.661
  111   HD13  ILE  13          HD13      ILE  13   0.278   3.731  -2.250
  112    H    CYS  14           H        CYS  14  -2.667   5.927  -6.515
  113    HA   CYS  14           HA       CYS  14  -1.698   6.650  -9.113
  114    HB2  CYS  14           HB2      CYS  14  -4.477   6.204  -8.095
  115    HB3  CYS  14           HB3      CYS  14  -4.088   6.463  -9.772
  116    H    ASP  15           H        ASP  15  -2.829   8.352  -6.417
  117    HA   ASP  15           HA       ASP  15  -3.590  10.430  -6.002
  118    HB2  ASP  15           HB2      ASP  15  -2.134  10.926  -8.542
  119    HB3  ASP  15           HB3      ASP  15  -2.901  12.226  -7.663
  120    H    GLN  16           H        GLN  16  -5.360   8.632  -7.159
  121    HA   GLN  16           HA       GLN  16  -7.143  10.379  -8.697
  122    HB2  GLN  16           HB2      GLN  16  -6.786   7.402  -9.076
  123    HB3  GLN  16           HB3      GLN  16  -7.903   8.425  -9.954
  124    HG2  GLN  16           HG2      GLN  16  -4.926   8.593 -10.050
  125    HG3  GLN  16           HG3      GLN  16  -5.957   7.898 -11.284
  126   HE21  GLN  16          HE21      GLN  16  -4.054  10.068 -11.455
  127   HE22  GLN  16          HE22      GLN  16  -4.942  11.424 -12.038
  128    H    GLU  17           H        GLU  17  -9.274  10.305  -8.083
  129    HA   GLU  17           HA       GLU  17  -9.831   9.374  -5.454
  130    HB2  GLU  17           HB2      GLU  17 -11.573  10.750  -7.487
  131    HB3  GLU  17           HB3      GLU  17 -12.049  10.405  -5.833
  132    HG2  GLU  17           HG2      GLU  17 -10.458  11.881  -4.949
  133    HG3  GLU  17           HG3      GLU  17  -9.625  12.017  -6.493
  134    H    LYS  18           H        LYS  18 -10.193   7.415  -5.127
  135    HA   LYS  18           HA       LYS  18 -11.858   5.815  -6.959
  136    HB2  LYS  18           HB2      LYS  18  -9.936   4.475  -5.187
  137    HB3  LYS  18           HB3      LYS  18 -10.521   3.985  -6.745
  138    HG2  LYS  18           HG2      LYS  18  -8.442   6.067  -6.187
  139    HG3  LYS  18           HG3      LYS  18  -8.188   4.470  -6.892
  140    HD2  LYS  18           HD2      LYS  18 -10.080   6.305  -8.223
  141    HD3  LYS  18           HD3      LYS  18  -8.378   6.639  -8.363
  142    HE2  LYS  18           HE2      LYS  18  -9.130   5.359 -10.249
  143    HE3  LYS  18           HE3      LYS  18  -8.051   4.415  -9.250
  144    HZ1  LYS  18           HZ1      LYS  18  -9.940   3.250  -8.321
  145    HZ2  LYS  18           HZ2      LYS  18  -9.967   3.129 -10.007
  146    HZ3  LYS  18           HZ3      LYS  18 -11.005   4.208  -9.223
  147    H    ASN  19           H        ASN  19 -13.498   4.607  -6.064
  148    HA   ASN  19           HA       ASN  19 -13.955   5.090  -3.216
  149    HB2  ASN  19           HB2      ASN  19 -16.232   4.534  -3.572
  150    HB3  ASN  19           HB3      ASN  19 -15.758   5.517  -4.949
  151   HD21  ASN  19          HD21      ASN  19 -15.541   4.577  -6.974
  152   HD22  ASN  19          HD22      ASN  19 -16.233   3.001  -7.333
  153    H    ARG  20           H        ARG  20 -12.532   2.774  -5.108
  154    HA   ARG  20           HA       ARG  20 -13.146   0.698  -3.123
  155    HB2  ARG  20           HB2      ARG  20 -12.804   0.363  -6.092
  156    HB3  ARG  20           HB3      ARG  20 -12.656  -0.967  -4.974
  157    HG2  ARG  20           HG2      ARG  20 -14.930  -0.577  -4.226
  158    HG3  ARG  20           HG3      ARG  20 -15.059   0.763  -5.358
  159    HD2  ARG  20           HD2      ARG  20 -14.644  -0.677  -7.202
  160    HD3  ARG  20           HD3      ARG  20 -14.379  -1.991  -6.098
  161    HE   ARG  20           HE       ARG  20 -16.990  -0.702  -6.054
  162   HH11  ARG  20          HH11      ARG  20 -15.071  -3.475  -6.997
  163   HH12  ARG  20          HH12      ARG  20 -16.451  -4.486  -7.281
  164   HH21  ARG  20          HH21      ARG  20 -18.801  -2.024  -6.436
  165   HH22  ARG  20          HH22      ARG  20 -18.570  -3.656  -6.974
  166    H    GLY  21           H        GLY  21 -11.576   0.045  -1.990
  167    HA2  GLY  21           HA2      GLY  21  -9.120  -0.878  -2.550
  168    HA3  GLY  21           HA3      GLY  21  -8.839   0.858  -2.474
  169    H    ILE  22           H        ILE  22  -7.547   0.535  -0.441
  170    HA   ILE  22           HA       ILE  22  -9.281  -0.264   1.784
  171    HB   ILE  22           HB       ILE  22  -7.611  -1.439   2.783
  172   HG12  ILE  22          HG12      ILE  22  -5.627   0.171   1.216
  173   HG13  ILE  22          HG13      ILE  22  -6.111   0.508   2.845
  174   HG21  ILE  22          HG21      ILE  22  -6.536  -2.832   1.174
  175   HG22  ILE  22          HG22      ILE  22  -6.649  -1.584  -0.068
  176   HG23  ILE  22          HG23      ILE  22  -8.110  -2.381   0.518
  177   HD11  ILE  22          HD11      ILE  22  -4.659  -1.906   1.860
  178   HD12  ILE  22          HD12      ILE  22  -5.276  -1.704   3.509
  179   HD13  ILE  22          HD13      ILE  22  -4.025  -0.618   2.891
  180    H    HIS  23           H        HIS  23  -7.965   0.386   3.862
  181    HA   HIS  23           HA       HIS  23  -7.138   3.169   3.837
  182    HB2  HIS  23           HB2      HIS  23  -9.523   2.257   5.475
  183    HB3  HIS  23           HB3      HIS  23  -8.822   3.855   5.477
  184    HD1  HIS  23           HD1      HIS  23  -9.529   5.467   3.615
  185    HD2  HIS  23           HD2      HIS  23 -11.065   1.639   3.259
  186    HE1  HIS  23           HE1      HIS  23 -11.297   5.619   1.832
  187    HE2  HIS  23           HE2      HIS  23 -12.337   3.323   1.757
  188    H    LEU  24           H        LEU  24  -5.204   2.791   4.906
  189    HA   LEU  24           HA       LEU  24  -5.065   0.913   7.087
  190    HB2  LEU  24           HB2      LEU  24  -3.155   2.673   5.652
  191    HB3  LEU  24           HB3      LEU  24  -2.769   2.265   7.274
  192    HG   LEU  24           HG       LEU  24  -1.841   0.375   6.618
  193   HD11  LEU  24          HD11      LEU  24  -4.403  -0.309   5.237
  194   HD12  LEU  24          HD12      LEU  24  -3.921  -0.757   6.877
  195   HD13  LEU  24          HD13      LEU  24  -3.035  -1.397   5.492
  196   HD21  LEU  24          HD21      LEU  24  -1.429  -0.021   4.308
  197   HD22  LEU  24          HD22      LEU  24  -1.280   1.693   4.687
  198   HD23  LEU  24          HD23      LEU  24  -2.719   1.096   3.858
  199    H    TYR  25           H        TYR  25  -4.090   4.279   6.823
  200    HA   TYR  25           HA       TYR  25  -4.767   4.663   9.611
  201    HB2  TYR  25           HB2      TYR  25  -3.083   6.401   7.857
  202    HB3  TYR  25           HB3      TYR  25  -3.294   6.597   9.582
  203    HD1  TYR  25           HD1      TYR  25  -3.125   3.181   8.750
  204    HD2  TYR  25           HD2      TYR  25  -0.618   6.563   9.349
  205    HE1  TYR  25           HE1      TYR  25  -1.232   1.688   9.053
  206    HE2  TYR  25           HE2      TYR  25   1.318   5.066   9.687
  207    HH   TYR  25           HH       TYR  25   1.673   2.717  10.433
  208    H    THR  26           H        THR  26  -4.538   7.523   7.850
  209    HA   THR  26           HA       THR  26  -7.462   7.664   7.629
  210    HB   THR  26           HB       THR  26  -6.720   9.420   9.027
  211    HG1  THR  26           HG1      THR  26  -7.330  10.216   6.399
  212   HG21  THR  26          HG21      THR  26  -4.654  10.157   6.965
  213   HG22  THR  26          HG22      THR  26  -4.332   9.241   8.438
  214   HG23  THR  26          HG23      THR  26  -4.895  10.913   8.541
  215    H    LYS  27           H        LYS  27  -5.322   6.467   5.798
  216    HA   LYS  27           HA       LYS  27  -5.597   8.239   3.467
  217    HB2  LYS  27           HB2      LYS  27  -3.672   6.021   3.330
  218    HB3  LYS  27           HB3      LYS  27  -3.545   7.651   2.709
  219    HG2  LYS  27           HG2      LYS  27  -3.125   6.763   5.525
  220    HG3  LYS  27           HG3      LYS  27  -1.893   7.272   4.385
  221    HD2  LYS  27           HD2      LYS  27  -4.109   9.012   5.410
  222    HD3  LYS  27           HD3      LYS  27  -2.453   9.023   6.018
  223    HE2  LYS  27           HE2      LYS  27  -2.683   9.283   3.108
  224    HE3  LYS  27           HE3      LYS  27  -3.359  10.636   4.014
  225    HZ1  LYS  27           HZ1      LYS  27  -0.576   9.613   4.024
  226    HZ2  LYS  27           HZ2      LYS  27  -1.142  10.629   5.250
  227    HZ3  LYS  27           HZ3      LYS  27  -1.115  11.170   3.648
  228    H    PHE  28           H        PHE  28  -5.040   6.763   1.468
  229    HA   PHE  28           HA       PHE  28  -6.699   4.383   1.429
  230    HB2  PHE  28           HB2      PHE  28  -8.355   6.077   0.986
  231    HB3  PHE  28           HB3      PHE  28  -7.318   6.852  -0.202
  232    HD1  PHE  28           HD1      PHE  28  -7.111   6.021  -2.410
  233    HD2  PHE  28           HD2      PHE  28  -9.479   3.948   0.436
  234    HE1  PHE  28           HE1      PHE  28  -8.059   4.655  -4.216
  235    HE2  PHE  28           HE2      PHE  28 -10.444   2.575  -1.363
  236    HZ   PHE  28           HZ       PHE  28  -9.721   2.915  -3.708
  237    H    ILE  29           H        ILE  29  -5.486   2.912   0.424
  238    HA   ILE  29           HA       ILE  29  -4.058   3.689  -2.038
  239    HB   ILE  29           HB       ILE  29  -3.983   1.048  -0.535
  240   HG12  ILE  29          HG12      ILE  29  -1.451   1.759  -0.444
  241   HG13  ILE  29          HG13      ILE  29  -2.106   3.380  -0.626
  242   HG21  ILE  29          HG21      ILE  29  -2.449   1.912  -2.972
  243   HG22  ILE  29          HG22      ILE  29  -3.776   0.747  -2.943
  244   HG23  ILE  29          HG23      ILE  29  -2.258   0.383  -2.116
  245   HD11  ILE  29          HD11      ILE  29  -3.002   1.466   1.502
  246   HD12  ILE  29          HD12      ILE  29  -3.332   3.197   1.390
  247   HD13  ILE  29          HD13      ILE  29  -1.695   2.625   1.711
  248    H    CYS  30           H        CYS  30  -5.013   3.146  -3.988
  249    HA   CYS  30           HA       CYS  30  -7.627   2.055  -3.926
  250    HB2  CYS  30           HB2      CYS  30  -7.730   2.292  -6.232
  251    HB3  CYS  30           HB3      CYS  30  -6.585   3.529  -5.780
  252    H    LEU  31           H        LEU  31  -8.326   0.124  -4.815
  253    HA   LEU  31           HA       LEU  31  -7.309  -1.958  -3.392
  254    HB2  LEU  31           HB2      LEU  31  -9.068  -3.158  -4.269
  255    HB3  LEU  31           HB3      LEU  31  -9.613  -1.520  -4.369
  256    HG   LEU  31           HG       LEU  31  -8.630  -1.711  -6.827
  257   HD11  LEU  31          HD11      LEU  31  -9.103  -3.908  -7.791
  258   HD12  LEU  31          HD12      LEU  31  -9.467  -4.542  -6.186
  259   HD13  LEU  31          HD13      LEU  31  -7.831  -4.010  -6.573
  260   HD21  LEU  31          HD21      LEU  31 -11.308  -2.761  -5.928
  261   HD22  LEU  31          HD22      LEU  31 -10.903  -2.288  -7.577
  262   HD23  LEU  31          HD23      LEU  31 -10.898  -1.085  -6.288
  263    H    ASP  32           H        ASP  32  -6.263  -0.865  -6.424
  264    HA   ASP  32           HA       ASP  32  -5.330  -3.459  -7.352
  265    HB2  ASP  32           HB2      ASP  32  -6.202  -1.433  -8.780
  266    HB3  ASP  32           HB3      ASP  32  -4.528  -0.931  -8.652
  267    H    CYS  33           H        CYS  33  -4.074  -0.421  -6.252
  268    HA   CYS  33           HA       CYS  33  -1.339  -1.059  -6.355
  269    HB2  CYS  33           HB2      CYS  33  -2.790   1.079  -4.802
  270    HB3  CYS  33           HB3      CYS  33  -1.057   0.876  -4.814
  271    H    GLU  34           H        GLU  34  -3.883  -1.416  -4.080
  272    HA   GLU  34           HA       GLU  34  -2.518  -2.123  -1.818
  273    HB2  GLU  34           HB2      GLU  34  -4.941  -1.848  -1.900
  274    HB3  GLU  34           HB3      GLU  34  -5.096  -3.244  -2.939
  275    HG2  GLU  34           HG2      GLU  34  -3.781  -3.915  -0.453
  276    HG3  GLU  34           HG3      GLU  34  -5.348  -3.177  -0.192
  277    H    ARG  35           H        ARG  35  -3.405  -4.111  -4.568
  278    HA   ARG  35           HA       ARG  35  -1.960  -6.399  -3.602
  279    HB2  ARG  35           HB2      ARG  35  -2.994  -5.849  -6.388
  280    HB3  ARG  35           HB3      ARG  35  -2.508  -7.416  -5.747
  281    HG2  ARG  35           HG2      ARG  35  -4.329  -7.425  -4.206
  282    HG3  ARG  35           HG3      ARG  35  -4.741  -5.772  -4.617
  283    HD2  ARG  35           HD2      ARG  35  -5.275  -6.483  -6.899
  284    HD3  ARG  35           HD3      ARG  35  -4.931  -8.137  -6.414
  285    HE   ARG  35           HE       ARG  35  -6.771  -7.155  -4.607
  286   HH11  ARG  35          HH11      ARG  35  -6.677  -7.783  -8.048
  287   HH12  ARG  35          HH12      ARG  35  -8.372  -8.114  -8.157
  288   HH21  ARG  35          HH21      ARG  35  -8.985  -7.582  -4.742
  289   HH22  ARG  35          HH22      ARG  35  -9.696  -8.020  -6.260
  290    H    LYS  36           H        LYS  36  -1.171  -3.677  -5.552
  291    HA   LYS  36           HA       LYS  36   0.863  -4.680  -7.158
  292    HB2  LYS  36           HB2      LYS  36   0.321  -1.976  -5.975
  293    HB3  LYS  36           HB3      LYS  36   1.617  -2.268  -7.094
  294    HG2  LYS  36           HG2      LYS  36  -0.189  -3.030  -8.701
  295    HG3  LYS  36           HG3      LYS  36  -1.327  -2.389  -7.594
  296    HD2  LYS  36           HD2      LYS  36  -0.682  -0.346  -7.995
  297    HD3  LYS  36           HD3      LYS  36   0.943  -0.744  -8.472
  298    HE2  LYS  36           HE2      LYS  36  -0.171  -0.036 -10.390
  299    HE3  LYS  36           HE3      LYS  36  -0.095  -1.778 -10.519
  300    HZ1  LYS  36           HZ1      LYS  36  -2.387  -1.910  -9.838
  301    HZ2  LYS  36           HZ2      LYS  36  -2.259  -0.855 -11.154
  302    HZ3  LYS  36           HZ3      LYS  36  -2.454  -0.233  -9.595
  303    H    VAL  37           H        VAL  37   0.693  -3.387  -4.006
  304    HA   VAL  37           HA       VAL  37   3.294  -2.740  -3.520
  305    HB   VAL  37           HB       VAL  37   2.669  -2.888  -1.107
  306   HG11  VAL  37          HG11      VAL  37   0.330  -1.563  -2.332
  307   HG12  VAL  37          HG12      VAL  37   1.903  -1.064  -2.971
  308   HG13  VAL  37          HG13      VAL  37   1.560  -0.901  -1.243
  309   HG21  VAL  37          HG21      VAL  37   0.434  -4.379  -2.264
  310   HG22  VAL  37          HG22      VAL  37   0.008  -3.199  -1.021
  311   HG23  VAL  37          HG23      VAL  37   1.173  -4.479  -0.661
  312    H    ILE  38           H        ILE  38   1.655  -5.721  -2.626
  313    HA   ILE  38           HA       ILE  38   3.882  -6.982  -1.365
  314    HB   ILE  38           HB       ILE  38   1.494  -8.357  -2.616
  315   HG12  ILE  38          HG12      ILE  38   0.945  -6.357  -1.207
  316   HG13  ILE  38          HG13      ILE  38   0.237  -7.889  -0.824
  317   HG21  ILE  38          HG21      ILE  38   3.304  -9.026  -0.329
  318   HG22  ILE  38          HG22      ILE  38   2.943 -10.001  -1.758
  319   HG23  ILE  38          HG23      ILE  38   1.704  -9.740  -0.511
  320   HD11  ILE  38          HD11      ILE  38   1.003  -6.591   1.175
  321   HD12  ILE  38          HD12      ILE  38   2.658  -6.790   0.589
  322   HD13  ILE  38          HD13      ILE  38   1.710  -8.204   1.050
  323    H    SER  39           H        SER  39   2.446  -6.853  -4.475
  324    HA   SER  39           HA       SER  39   3.745  -9.038  -5.617
  325    HB2  SER  39           HB2      SER  39   1.754  -7.911  -6.598
  326    HB3  SER  39           HB3      SER  39   2.779  -6.546  -7.034
  327    HG   SER  39           HG       SER  39   3.754  -8.962  -7.888
  328    H    THR  40           H        THR  40   4.758  -5.870  -4.857
  329    HA   THR  40           HA       THR  40   6.877  -5.662  -6.792
  330    HB   THR  40           HB       THR  40   5.967  -3.929  -4.498
  331    HG1  THR  40           HG1      THR  40   4.505  -3.960  -6.190
  332   HG21  THR  40          HG21      THR  40   7.920  -3.145  -6.654
  333   HG22  THR  40          HG22      THR  40   8.382  -3.576  -5.007
  334   HG23  THR  40          HG23      THR  40   7.357  -2.167  -5.294
  335    H    SER  41           H        SER  41   6.912  -5.483  -3.198
  336    HA   SER  41           HA       SER  41   9.792  -5.651  -3.357
  337    HB2  SER  41           HB2      SER  41   7.949  -4.548  -1.385
  338    HB3  SER  41           HB3      SER  41   9.580  -4.955  -0.879
  339    HG   SER  41           HG       SER  41  10.077  -3.093  -1.717
  340    H    THR  42           H        THR  42   7.579  -8.048  -2.791
  341    HA   THR  42           HA       THR  42   8.335  -8.879  -0.186
  342    HB   THR  42           HB       THR  42   7.085 -11.019  -0.819
  343    HG1  THR  42           HG1      THR  42   5.879  -9.550  -2.860
  344   HG21  THR  42          HG21      THR  42   6.179  -9.171   0.525
  345   HG22  THR  42          HG22      THR  42   4.955  -9.918  -0.499
  346   HG23  THR  42          HG23      THR  42   5.658  -8.367  -0.955
  347    H    SER  43           H        SER  43  10.722  -8.813  -1.688
  348    HA   SER  43           HA       SER  43  11.545 -11.623  -1.477
  349    HB2  SER  43           HB2      SER  43  13.244  -9.218  -2.202
  350    HB3  SER  43           HB3      SER  43  13.643 -10.919  -2.439
  351    HG   SER  43           HG       SER  43  11.562 -10.836  -3.771
  352    H    ASP  44           H        ASP  44  10.731 -11.141   0.845
  353    HA   ASP  44           HA       ASP  44  11.959  -9.192   2.454
  354    HB2  ASP  44           HB2      ASP  44   9.776 -10.022   3.021
  355    HB3  ASP  44           HB3      ASP  44  10.392 -11.661   3.198
  356    HA   PRO  45           HA       PRO  45  15.606 -11.519   3.647
  357    HB2  PRO  45           HB2      PRO  45  17.073  -9.393   4.304
  358    HB3  PRO  45           HB3      PRO  45  16.726  -9.749   2.618
  359    HG2  PRO  45           HG2      PRO  45  15.538  -7.733   4.436
  360    HG3  PRO  45           HG3      PRO  45  15.944  -7.625   2.728
  361    HD2  PRO  45           HD2      PRO  45  13.401  -8.135   3.780
  362    HD3  PRO  45           HD3      PRO  45  13.897  -8.394   2.096
  363    H    ASP  46           H        ASP  46  16.858 -11.566   5.718
  364    HA   ASP  46           HA       ASP  46  15.172 -10.746   7.988
  365    HB2  ASP  46           HB2      ASP  46  16.932 -13.195   7.807
  366    HB3  ASP  46           HB3      ASP  46  15.936 -12.735   9.172
  367    H    TYR  47           H        TYR  47  16.674 -10.994  10.088
  368    HA   TYR  47           HA       TYR  47  19.174  -9.585   9.524
  369    HB2  TYR  47           HB2      TYR  47  18.694  -8.108  11.439
  370    HB3  TYR  47           HB3      TYR  47  17.520  -7.919  10.149
  371    HD1  TYR  47           HD1      TYR  47  17.900  -8.149  13.593
  372    HD2  TYR  47           HD2      TYR  47  15.378  -9.545  10.460
  373    HE1  TYR  47           HE1      TYR  47  16.091  -8.508  15.215
  374    HE2  TYR  47           HE2      TYR  47  13.562  -9.899  12.080
  375    HH   TYR  47           HH       TYR  47  13.322 -10.305  14.516
  376    H    ALA  48           H        ALA  48  20.869 -10.083  10.819
  377    HA   ALA  48           HA       ALA  48  20.397 -12.019  12.983
  378    HB1  ALA  48           HB1      ALA  48  22.624 -12.128  10.950
  379    HB2  ALA  48           HB2      ALA  48  21.233 -13.208  11.019
  380    HB3  ALA  48           HB3      ALA  48  22.422 -13.218  12.321
  381    H1   SER   0           H1       SER   0  -2.954  17.469   9.134
  382    H2   SER   0           H2       SER   0  -2.932  15.998   8.300
  383    H3   SER   0           H3       SER   0  -3.245  17.437   7.470
  384    HA   SER   0           HA       SER   0  -1.041  18.232   7.902
  385    HB2  SER   0           HB2      SER   0  -0.606  15.524   9.185
  386    HB3  SER   0           HB3      SER   0   0.587  16.812   9.020
  387    HG   SER   0           HG       SER   0  -0.137  17.509  10.859
  388    H    MET   1           H        MET   1   0.437  17.950   6.253
  389    HA   MET   1           HA       MET   1   0.148  15.536   4.595
  390    HB2  MET   1           HB2      MET   1   0.300  18.386   3.589
  391    HB3  MET   1           HB3      MET   1   0.349  16.954   2.574
  392    HG2  MET   1           HG2      MET   1  -1.908  16.357   3.345
  393    HG3  MET   1           HG3      MET   1  -1.953  17.837   4.299
  394    HE1  MET   1           HE1      MET   1  -0.508  17.180   0.672
  395    HE2  MET   1           HE2      MET   1  -1.899  17.644  -0.307
  396    HE3  MET   1           HE3      MET   1  -1.997  16.241   0.756
  397    H    ASP   2           H        ASP   2   2.025  14.886   3.506
  398    HA   ASP   2           HA       ASP   2   4.461  15.833   4.796
  399    HB2  ASP   2           HB2      ASP   2   5.499  13.826   4.048
  400    HB3  ASP   2           HB3      ASP   2   3.890  13.369   4.595
  401    H    GLU   3           H        GLU   3   6.375  16.303   3.595
  402    HA   GLU   3           HA       GLU   3   6.347  16.612   0.778
  403    HB2  GLU   3           HB2      GLU   3   6.665  19.089   0.766
  404    HB3  GLU   3           HB3      GLU   3   5.034  18.565   1.166
  405    HG2  GLU   3           HG2      GLU   3   5.513  18.889   3.522
  406    HG3  GLU   3           HG3      GLU   3   7.138  19.440   3.126
  407    H    THR   4           H        THR   4   8.378  17.435  -0.051
  408    HA   THR   4           HA       THR   4  10.638  17.574  -0.122
  409    HB   THR   4           HB       THR   4  10.549  18.293   2.811
  410    HG1  THR   4           HG1      THR   4   9.425  19.570   0.747
  411   HG21  THR   4          HG21      THR   4  12.783  17.851   1.926
  412   HG22  THR   4          HG22      THR   4  12.580  19.573   2.251
  413   HG23  THR   4          HG23      THR   4  12.490  18.971   0.596
  414    H    VAL   5           H        VAL   5  10.815  15.336  -0.488
  415    HA   VAL   5           HA       VAL   5  11.349  13.583   1.766
  416    HB   VAL   5           HB       VAL   5  11.376  13.062  -1.213
  417   HG11  VAL   5          HG11      VAL   5  11.713  11.144   1.088
  418   HG12  VAL   5          HG12      VAL   5  12.922  11.555  -0.127
  419   HG13  VAL   5          HG13      VAL   5  11.468  10.674  -0.595
  420   HG21  VAL   5          HG21      VAL   5   9.156  13.507  -0.305
  421   HG22  VAL   5          HG22      VAL   5   9.403  12.270   0.927
  422   HG23  VAL   5          HG23      VAL   5   9.318  11.816  -0.775
  423    H    LYS   6           H        LYS   6  13.318  13.180   2.553
  424    HA   LYS   6           HA       LYS   6  15.639  13.753   0.854
  425    HB2  LYS   6           HB2      LYS   6  15.319  15.574   2.491
  426    HB3  LYS   6           HB3      LYS   6  15.423  14.391   3.780
  427    HG2  LYS   6           HG2      LYS   6  17.525  15.562   3.528
  428    HG3  LYS   6           HG3      LYS   6  17.711  13.856   3.120
  429    HD2  LYS   6           HD2      LYS   6  17.511  14.433   0.736
  430    HD3  LYS   6           HD3      LYS   6  17.396  16.135   1.168
  431    HE2  LYS   6           HE2      LYS   6  19.610  15.998   2.186
  432    HE3  LYS   6           HE3      LYS   6  19.723  14.306   1.719
  433    HZ1  LYS   6           HZ1      LYS   6  20.887  15.714   0.156
  434    HZ2  LYS   6           HZ2      LYS   6  19.482  16.610  -0.139
  435    HZ3  LYS   6           HZ3      LYS   6  19.561  14.985  -0.598
  436    H    LEU   7           H        LEU   7  16.453  11.828   0.421
  437    HA   LEU   7           HA       LEU   7  17.498   9.840   0.682
  438    HB2  LEU   7           HB2      LEU   7  17.505  10.518   3.585
  439    HB3  LEU   7           HB3      LEU   7  18.360   9.171   2.889
  440    HG   LEU   7           HG       LEU   7  18.887  12.077   2.275
  441   HD11  LEU   7          HD11      LEU   7  20.451  10.112   3.943
  442   HD12  LEU   7          HD12      LEU   7  19.533  11.488   4.555
  443   HD13  LEU   7          HD13      LEU   7  20.948  11.755   3.537
  444   HD21  LEU   7          HD21      LEU   7  19.386  10.631   0.405
  445   HD22  LEU   7          HD22      LEU   7  20.310   9.559   1.452
  446   HD23  LEU   7          HD23      LEU   7  20.879  11.200   1.147
  447    H    ASN   8           H        ASN   8  15.631   9.856   3.697
  448    HA   ASN   8           HA       ASN   8  14.453   7.297   3.079
  449    HB2  ASN   8           HB2      ASN   8  13.707   9.251   5.269
  450    HB3  ASN   8           HB3      ASN   8  13.244   7.567   5.184
  451   HD21  ASN   8          HD21      ASN   8  14.621   8.954   7.274
  452   HD22  ASN   8          HD22      ASN   8  16.128   8.137   7.482
  453    H    HIS   9           H        HIS   9  12.557   6.961   2.073
  454    HA   HIS   9           HA       HIS   9  11.116   9.276   1.082
  455    HB2  HIS   9           HB2      HIS   9  10.969   6.329   0.482
  456    HB3  HIS   9           HB3      HIS   9   9.766   7.460  -0.125
  457    HD1  HIS   9           HD1      HIS   9  10.248   8.211  -2.418
  458    HD2  HIS   9           HD2      HIS   9  13.742   7.356  -0.329
  459    HE1  HIS   9           HE1      HIS   9  12.124   8.605  -4.044
  460    HE2  HIS   9           HE2      HIS   9  14.227   8.022  -2.784
  461    H    THR  10           H        THR  10   9.174   9.938   1.773
  462    HA   THR  10           HA       THR  10   8.295   9.068   4.322
  463    HB   THR  10           HB       THR  10   6.757  10.802   2.376
  464    HG1  THR  10           HG1      THR  10   7.902  12.542   3.450
  465   HG21  THR  10          HG21      THR  10   6.801  10.730   5.401
  466   HG22  THR  10          HG22      THR  10   5.509  10.103   4.377
  467   HG23  THR  10          HG23      THR  10   5.850  11.832   4.407
  468    H    CYS  11           H        CYS  11   6.828   7.625   4.899
  469    HA   CYS  11           HA       CYS  11   5.520   5.957   3.010
  470    HB2  CYS  11           HB2      CYS  11   6.061   5.143   5.270
  471    HB3  CYS  11           HB3      CYS  11   4.981   6.339   5.970
  472    H    VAL  12           H        VAL  12   3.836   6.565   1.796
  473    HA   VAL  12           HA       VAL  12   2.262   8.836   2.095
  474    HB   VAL  12           HB       VAL  12   0.560   7.635   0.685
  475   HG11  VAL  12          HG11      VAL  12   2.346   8.882  -0.375
  476   HG12  VAL  12          HG12      VAL  12   2.004   7.410  -1.289
  477   HG13  VAL  12          HG13      VAL  12   3.422   7.491  -0.243
  478   HG21  VAL  12          HG21      VAL  12   0.927   5.384   1.562
  479   HG22  VAL  12          HG22      VAL  12   2.540   5.368   0.851
  480   HG23  VAL  12          HG23      VAL  12   1.118   5.429  -0.190
  481    H    ILE  13           H        ILE  13   2.278   6.042   3.951
  482    HA   ILE  13           HA       ILE  13  -0.492   6.247   4.814
  483    HB   ILE  13           HB       ILE  13   1.499   4.250   5.784
  484   HG12  ILE  13          HG12      ILE  13   1.565   4.212   3.341
  485   HG13  ILE  13          HG13      ILE  13   0.810   2.757   3.986
  486   HG21  ILE  13          HG21      ILE  13  -0.455   2.884   6.152
  487   HG22  ILE  13          HG22      ILE  13  -1.479   4.128   5.433
  488   HG23  ILE  13          HG23      ILE  13  -0.638   4.446   6.952
  489   HD11  ILE  13          HD11      ILE  13  -0.713   5.136   3.010
  490   HD12  ILE  13          HD12      ILE  13  -1.335   3.538   3.432
  491   HD13  ILE  13          HD13      ILE  13  -0.298   3.736   2.018
  492    H    CYS  14           H        CYS  14   2.696   5.887   6.273
  493    HA   CYS  14           HA       CYS  14   1.755   6.649   8.870
  494    HB2  CYS  14           HB2      CYS  14   4.509   6.145   7.841
  495    HB3  CYS  14           HB3      CYS  14   4.145   6.417   9.519
  496    H    ASP  15           H        ASP  15   2.904   8.322   6.164
  497    HA   ASP  15           HA       ASP  15   3.709  10.384   5.739
  498    HB2  ASP  15           HB2      ASP  15   2.268  10.911   8.284
  499    HB3  ASP  15           HB3      ASP  15   3.055  12.198   7.396
  500    H    GLN  16           H        GLN  16   5.447   8.559   6.897
  501    HA   GLN  16           HA       GLN  16   7.269  10.276   8.421
  502    HB2  GLN  16           HB2      GLN  16   6.861   7.306   8.804
  503    HB3  GLN  16           HB3      GLN  16   7.999   8.311   9.678
  504    HG2  GLN  16           HG2      GLN  16   5.025   8.530   9.781
  505    HG3  GLN  16           HG3      GLN  16   6.047   7.822  11.016
  506   HE21  GLN  16          HE21      GLN  16   4.182  10.023  11.182
  507   HE22  GLN  16          HE22      GLN  16   5.096  11.365  11.760
  508    H    GLU  17           H        GLU  17   9.397  10.157   7.803
  509    HA   GLU  17           HA       GLU  17   9.925   9.218   5.168
  510    HB2  GLU  17           HB2      GLU  17  11.699  10.565   7.194
  511    HB3  GLU  17           HB3      GLU  17  12.164  10.210   5.539
  512    HG2  GLU  17           HG2      GLU  17  10.590  11.708   4.659
  513    HG3  GLU  17           HG3      GLU  17   9.773  11.868   6.211
  514    H    LYS  18           H        LYS  18  10.251   7.252   4.843
  515    HA   LYS  18           HA       LYS  18  11.896   5.625   6.671
  516    HB2  LYS  18           HB2      LYS  18   9.942   4.315   4.911
  517    HB3  LYS  18           HB3      LYS  18  10.524   3.819   6.468
  518    HG2  LYS  18           HG2      LYS  18   8.481   5.937   5.914
  519    HG3  LYS  18           HG3      LYS  18   8.201   4.347   6.623
  520    HD2  LYS  18           HD2      LYS  18  10.129   6.151   7.943
  521    HD3  LYS  18           HD3      LYS  18   8.433   6.516   8.087
  522    HE2  LYS  18           HE2      LYS  18   9.167   5.227   9.973
  523    HE3  LYS  18           HE3      LYS  18   8.070   4.301   8.980
  524    HZ1  LYS  18           HZ1      LYS  18   9.933   3.103   8.048
  525    HZ2  LYS  18           HZ2      LYS  18   9.960   2.982   9.733
  526    HZ3  LYS  18           HZ3      LYS  18  11.019   4.040   8.945
  527    H    ASN  19           H        ASN  19  13.509   4.387   5.770
  528    HA   ASN  19           HA       ASN  19  13.965   4.856   2.919
  529    HB2  ASN  19           HB2      ASN  19  16.232   4.263   3.270
  530    HB3  ASN  19           HB3      ASN  19  15.778   5.254   4.647
  531   HD21  ASN  19          HD21      ASN  19  15.563   4.319   6.674
  532   HD22  ASN  19          HD22      ASN  19  16.225   2.731   7.033
  533    H    ARG  20           H        ARG  20  12.502   2.573   4.814
  534    HA   ARG  20           HA       ARG  20  13.090   0.461   2.858
  535    HB2  ARG  20           HB2      ARG  20  12.757   0.250   5.828
  536    HB3  ARG  20           HB3      ARG  20  12.559  -1.142   4.796
  537    HG2  ARG  20           HG2      ARG  20  14.816  -0.816   3.946
  538    HG3  ARG  20           HG3      ARG  20  15.022   0.515   5.076
  539    HD2  ARG  20           HD2      ARG  20  14.502  -0.984   6.855
  540    HD3  ARG  20           HD3      ARG  20  14.309  -2.308   5.753
  541    HE   ARG  20           HE       ARG  20  16.899  -0.967   5.785
  542   HH11  ARG  20          HH11      ARG  20  14.950  -3.720   6.716
  543   HH12  ARG  20          HH12      ARG  20  16.315  -4.751   7.003
  544   HH21  ARG  20          HH21      ARG  20  18.698  -2.328   6.152
  545   HH22  ARG  20          HH22      ARG  20  18.447  -3.960   6.680
  546    H    GLY  21           H        GLY  21  11.491  -0.139   1.709
  547    HA2  GLY  21           HA2      GLY  21   9.022  -1.030   2.289
  548    HA3  GLY  21           HA3      GLY  21   8.772   0.711   2.213
  549    H    ILE  22           H        ILE  22   7.466   0.407   0.185
  550    HA   ILE  22           HA       ILE  22   9.176  -0.428  -2.046
  551    HB   ILE  22           HB       ILE  22   7.480  -1.575  -3.034
  552   HG12  ILE  22          HG12      ILE  22   5.532   0.072  -1.462
  553   HG13  ILE  22          HG13      ILE  22   6.016   0.399  -3.093
  554   HG21  ILE  22          HG21      ILE  22   6.387  -2.944  -1.417
  555   HG22  ILE  22          HG22      ILE  22   6.526  -1.695  -0.179
  556   HG23  ILE  22          HG23      ILE  22   7.971  -2.520  -0.767
  557   HD11  ILE  22          HD11      ILE  22   4.525  -1.986  -2.100
  558   HD12  ILE  22          HD12      ILE  22   5.140  -1.798  -3.750
  559   HD13  ILE  22          HD13      ILE  22   3.910  -0.689  -3.131
  560    H    HIS  23           H        HIS  23   7.858   0.241  -4.117
  561    HA   HIS  23           HA       HIS  23   7.083   3.036  -4.098
  562    HB2  HIS  23           HB2      HIS  23   9.446   2.081  -5.740
  563    HB3  HIS  23           HB3      HIS  23   8.771   3.690  -5.744
  564    HD1  HIS  23           HD1      HIS  23   9.513   5.299  -3.889
  565    HD2  HIS  23           HD2      HIS  23  10.984   1.445  -3.531
  566    HE1  HIS  23           HE1      HIS  23  11.294   5.421  -2.114
  567    HE2  HIS  23           HE2      HIS  23  12.287   3.105  -2.035
  568    H    LEU  24           H        LEU  24   5.143   2.694  -5.159
  569    HA   LEU  24           HA       LEU  24   4.960   0.812  -7.335
  570    HB2  LEU  24           HB2      LEU  24   3.086   2.611  -5.897
  571    HB3  LEU  24           HB3      LEU  24   2.689   2.202  -7.517
  572    HG   LEU  24           HG       LEU  24   1.733   0.329  -6.849
  573   HD11  LEU  24          HD11      LEU  24   4.293  -0.389  -5.479
  574   HD12  LEU  24          HD12      LEU  24   3.794  -0.835  -7.115
  575   HD13  LEU  24          HD13      LEU  24   2.909  -1.460  -5.723
  576   HD21  LEU  24          HD21      LEU  24   1.322  -0.055  -4.537
  577   HD22  LEU  24          HD22      LEU  24   1.201   1.662  -4.919
  578   HD23  LEU  24          HD23      LEU  24   2.633   1.042  -4.095
  579    H    TYR  25           H        TYR  25   4.053   4.198  -7.070
  580    HA   TYR  25           HA       TYR  25   4.721   4.559  -9.865
  581    HB2  TYR  25           HB2      TYR  25   3.073   6.332  -8.109
  582    HB3  TYR  25           HB3      TYR  25   3.282   6.521  -9.836
  583    HD1  TYR  25           HD1      TYR  25   3.056   3.112  -8.993
  584    HD2  TYR  25           HD2      TYR  25   0.615   6.532  -9.600
  585    HE1  TYR  25           HE1      TYR  25   1.140   1.647  -9.289
  586    HE2  TYR  25           HE2      TYR  25  -1.350   5.065  -9.931
  587    HH   TYR  25           HH       TYR  25  -1.758   2.724 -10.655
  588    H    THR  26           H        THR  26   4.550   7.428  -8.113
  589    HA   THR  26           HA       THR  26   7.475   7.521  -7.898
  590    HB   THR  26           HB       THR  26   6.761   9.290  -9.298
  591    HG1  THR  26           HG1      THR  26   7.407  10.055  -6.671
  592   HG21  THR  26          HG21      THR  26   4.711  10.066  -7.232
  593   HG22  THR  26          HG22      THR  26   4.371   9.148  -8.700
  594   HG23  THR  26          HG23      THR  26   4.959  10.811  -8.812
  595    H    LYS  27           H        LYS  27   5.323   6.363  -6.060
  596    HA   LYS  27           HA       LYS  27   5.638   8.134  -3.735
  597    HB2  LYS  27           HB2      LYS  27   3.671   5.956  -3.584
  598    HB3  LYS  27           HB3      LYS  27   3.577   7.588  -2.966
  599    HG2  LYS  27           HG2      LYS  27   3.130   6.703  -5.777
  600    HG3  LYS  27           HG3      LYS  27   1.915   7.237  -4.632
  601    HD2  LYS  27           HD2      LYS  27   4.157   8.933  -5.671
  602    HD3  LYS  27           HD3      LYS  27   2.500   8.971  -6.275
  603    HE2  LYS  27           HE2      LYS  27   2.741   9.237  -3.366
  604    HE3  LYS  27           HE3      LYS  27   3.439  10.574  -4.277
  605    HZ1  LYS  27           HZ1      LYS  27   0.634   9.604  -4.270
  606    HZ2  LYS  27           HZ2      LYS  27   1.215  10.599  -5.508
  607    HZ3  LYS  27           HZ3      LYS  27   1.207  11.155  -3.911
  608    H    PHE  28           H        PHE  28   5.060   6.675  -1.730
  609    HA   PHE  28           HA       PHE  28   6.677   4.267  -1.692
  610    HB2  PHE  28           HB2      PHE  28   8.364   5.932  -1.259
  611    HB3  PHE  28           HB3      PHE  28   7.348   6.729  -0.067
  612    HD1  PHE  28           HD1      PHE  28   7.134   5.904   2.143
  613    HD2  PHE  28           HD2      PHE  28   9.455   3.784  -0.709
  614    HE1  PHE  28           HE1      PHE  28   8.064   4.527   3.947
  615    HE2  PHE  28           HE2      PHE  28  10.403   2.399   1.092
  616    HZ   PHE  28           HZ       PHE  28   9.695   2.757   3.438
  617    H    ILE  29           H        ILE  29   5.445   2.820  -0.678
  618    HA   ILE  29           HA       ILE  29   4.039   3.627   1.789
  619    HB   ILE  29           HB       ILE  29   3.911   0.984   0.292
  620   HG12  ILE  29          HG12      ILE  29   1.392   1.737   0.209
  621   HG13  ILE  29          HG13      ILE  29   2.072   3.347   0.385
  622   HG21  ILE  29          HG21      ILE  29   2.402   1.882   2.735
  623   HG22  ILE  29          HG22      ILE  29   3.707   0.694   2.700
  624   HG23  ILE  29          HG23      ILE  29   2.181   0.355   1.881
  625   HD11  ILE  29          HD11      ILE  29   2.933   1.415  -1.740
  626   HD12  ILE  29          HD12      ILE  29   3.289   3.141  -1.632
  627   HD13  ILE  29          HD13      ILE  29   1.644   2.592  -1.948
  628    H    CYS  30           H        CYS  30   4.989   3.069   3.736
  629    HA   CYS  30           HA       CYS  30   7.585   1.933   3.666
  630    HB2  CYS  30           HB2      CYS  30   7.703   2.172   5.972
  631    HB3  CYS  30           HB3      CYS  30   6.579   3.431   5.522
  632    H    LEU  31           H        LEU  31   8.253  -0.007   4.554
  633    HA   LEU  31           HA       LEU  31   7.196  -2.073   3.143
  634    HB2  LEU  31           HB2      LEU  31   8.935  -3.303   4.018
  635    HB3  LEU  31           HB3      LEU  31   9.510  -1.675   4.110
  636    HG   LEU  31           HG       LEU  31   8.532  -1.843   6.572
  637   HD11  LEU  31          HD11      LEU  31   8.971  -4.046   7.537
  638   HD12  LEU  31          HD12      LEU  31   9.317  -4.690   5.933
  639   HD13  LEU  31          HD13      LEU  31   7.692  -4.129   6.326
  640   HD21  LEU  31          HD21      LEU  31  11.188  -2.936   5.662
  641   HD22  LEU  31          HD22      LEU  31  10.799  -2.456   7.314
  642   HD23  LEU  31          HD23      LEU  31  10.806  -1.254   6.023
  643    H    ASP  32           H        ASP  32   6.176  -0.954   6.173
  644    HA   ASP  32           HA       ASP  32   5.201  -3.530   7.113
  645    HB2  ASP  32           HB2      ASP  32   6.115  -1.516   8.534
  646    HB3  ASP  32           HB3      ASP  32   4.450  -0.987   8.414
  647    H    CYS  33           H        CYS  33   3.996  -0.472   6.012
  648    HA   CYS  33           HA       CYS  33   1.247  -1.064   6.124
  649    HB2  CYS  33           HB2      CYS  33   2.730   1.045   4.561
  650    HB3  CYS  33           HB3      CYS  33   0.997   0.870   4.578
  651    H    GLU  34           H        GLU  34   3.783  -1.469   3.841
  652    HA   GLU  34           HA       GLU  34   2.397  -2.158   1.587
  653    HB2  GLU  34           HB2      GLU  34   4.825  -1.927   1.660
  654    HB3  GLU  34           HB3      GLU  34   4.958  -3.323   2.704
  655    HG2  GLU  34           HG2      GLU  34   3.622  -3.978   0.225
  656    HG3  GLU  34           HG3      GLU  34   5.202  -3.267  -0.044
  657    H    ARG  35           H        ARG  35   3.259  -4.155   4.339
  658    HA   ARG  35           HA       ARG  35   1.769  -6.420   3.388
  659    HB2  ARG  35           HB2      ARG  35   2.818  -5.878   6.172
  660    HB3  ARG  35           HB3      ARG  35   2.308  -7.438   5.533
  661    HG2  ARG  35           HG2      ARG  35   4.120  -7.474   3.992
  662    HG3  ARG  35           HG3      ARG  35   4.562  -5.831   4.394
  663    HD2  ARG  35           HD2      ARG  35   5.096  -6.549   6.673
  664    HD3  ARG  35           HD3      ARG  35   4.722  -8.197   6.189
  665    HE   ARG  35           HE       ARG  35   6.566  -7.253   4.370
  666   HH11  ARG  35          HH11      ARG  35   6.480  -7.861   7.813
  667   HH12  ARG  35          HH12      ARG  35   8.171  -8.232   7.913
  668   HH21  ARG  35          HH21      ARG  35   8.766  -7.726   4.490
  669   HH22  ARG  35          HH22      ARG  35   9.479  -8.168   6.007
  670    H    LYS  36           H        LYS  36   1.036  -3.681   5.334
  671    HA   LYS  36           HA       LYS  36  -1.012  -4.640   6.947
  672    HB2  LYS  36           HB2      LYS  36  -0.425  -1.950   5.754
  673    HB3  LYS  36           HB3      LYS  36  -1.721  -2.214   6.878
  674    HG2  LYS  36           HG2      LYS  36   0.079  -3.007   8.479
  675    HG3  LYS  36           HG3      LYS  36   1.222  -2.387   7.367
  676    HD2  LYS  36           HD2      LYS  36   0.613  -0.332   7.765
  677    HD3  LYS  36           HD3      LYS  36  -1.016  -0.702   8.249
  678    HE2  LYS  36           HE2      LYS  36   0.119  -0.007  10.162
  679    HE3  LYS  36           HE3      LYS  36   0.012  -1.747  10.297
  680    HZ1  LYS  36           HZ1      LYS  36   2.297  -1.924   9.607
  681    HZ2  LYS  36           HZ2      LYS  36   2.193  -0.855  10.918
  682    HZ3  LYS  36           HZ3      LYS  36   2.390  -0.251   9.354
  683    H    VAL  37           H        VAL  37  -0.829  -3.361   3.791
  684    HA   VAL  37           HA       VAL  37  -3.420  -2.667   3.314
  685    HB   VAL  37           HB       VAL  37  -2.806  -2.833   0.898
  686   HG11  VAL  37          HG11      VAL  37  -0.441  -1.547   2.110
  687   HG12  VAL  37          HG12      VAL  37  -2.002  -1.017   2.754
  688   HG13  VAL  37          HG13      VAL  37  -1.663  -0.866   1.024
  689   HG21  VAL  37          HG21      VAL  37  -0.595  -4.361   2.052
  690   HG22  VAL  37          HG22      VAL  37  -0.152  -3.192   0.805
  691   HG23  VAL  37          HG23      VAL  37  -1.340  -4.451   0.451
  692    H    ILE  38           H        ILE  38  -1.840  -5.679   2.421
  693    HA   ILE  38           HA       ILE  38  -4.093  -6.901   1.172
  694    HB   ILE  38           HB       ILE  38  -1.724  -8.320   2.414
  695   HG12  ILE  38          HG12      ILE  38  -1.147  -6.331   0.999
  696   HG13  ILE  38          HG13      ILE  38  -0.467  -7.875   0.619
  697   HG21  ILE  38          HG21      ILE  38  -3.556  -8.960   0.133
  698   HG22  ILE  38          HG22      ILE  38  -3.208  -9.938   1.564
  699   HG23  ILE  38          HG23      ILE  38  -1.968  -9.704   0.313
  700   HD11  ILE  38          HD11      ILE  38  -1.216  -6.573  -1.383
  701   HD12  ILE  38          HD12      ILE  38  -2.872  -6.740  -0.792
  702   HD13  ILE  38          HD13      ILE  38  -1.948  -8.173  -1.250
  703    H    SER  39           H        SER  39  -2.641  -6.793   4.278
  704    HA   SER  39           HA       SER  39  -3.979  -8.952   5.428
  705    HB2  SER  39           HB2      SER  39  -1.961  -7.859   6.394
  706    HB3  SER  39           HB3      SER  39  -2.961  -6.477   6.839
  707    HG   SER  39           HG       SER  39  -3.982  -8.869   7.700
  708    H    THR  40           H        THR  40  -4.934  -5.771   4.661
  709    HA   THR  40           HA       THR  40  -7.038  -5.517   6.607
  710    HB   THR  40           HB       THR  40  -6.110  -3.805   4.302
  711    HG1  THR  40           HG1      THR  40  -4.637  -3.854   5.981
  712   HG21  THR  40          HG21      THR  40  -8.038  -2.986   6.470
  713   HG22  THR  40          HG22      THR  40  -8.516  -3.411   4.827
  714   HG23  THR  40          HG23      THR  40  -7.466  -2.018   5.106
  715    H    SER  41           H        SER  41  -7.088  -5.347   3.013
  716    HA   SER  41           HA       SER  41  -9.969  -5.460   3.186
  717    HB2  SER  41           HB2      SER  41  -8.113  -4.403   1.201
  718    HB3  SER  41           HB3      SER  41  -9.757  -4.772   0.710
  719    HG   SER  41           HG       SER  41 -10.218  -2.910   1.552
  720    H    THR  42           H        THR  42  -7.800  -7.899   2.613
  721    HA   THR  42           HA       THR  42  -8.584  -8.722   0.014
  722    HB   THR  42           HB       THR  42  -7.367 -10.884   0.647
  723    HG1  THR  42           HG1      THR  42  -6.132  -9.426   2.680
  724   HG21  THR  42          HG21      THR  42  -6.432  -9.058  -0.711
  725   HG22  THR  42          HG22      THR  42  -5.218  -9.822   0.312
  726   HG23  THR  42          HG23      THR  42  -5.892  -8.256   0.764
  727    H    SER  43           H        SER  43 -10.963  -8.610   1.522
  728    HA   SER  43           HA       SER  43 -11.836 -11.407   1.323
  729    HB2  SER  43           HB2      SER  43 -13.490  -8.972   2.054
  730    HB3  SER  43           HB3      SER  43 -13.919 -10.666   2.293
  731    HG   SER  43           HG       SER  43 -11.834 -10.622   3.620
  732    H    ASP  44           H        ASP  44 -11.024 -10.939  -1.000
  733    HA   ASP  44           HA       ASP  44 -12.225  -8.977  -2.611
  734    HB2  ASP  44           HB2      ASP  44 -10.057  -9.848  -3.178
  735    HB3  ASP  44           HB3      ASP  44 -10.702 -11.476  -3.348
  736    HA   PRO  45           HA       PRO  45 -15.920 -11.241  -3.780
  737    HB2  PRO  45           HB2      PRO  45 -17.339  -9.090  -4.460
  738    HB3  PRO  45           HB3      PRO  45 -16.999  -9.423  -2.793
  739    HG2  PRO  45           HG2      PRO  45 -15.808  -7.483  -4.538
  740    HG3  PRO  45           HG3      PRO  45 -16.164  -7.339  -2.839
  741    HD2  PRO  45           HD2      PRO  45 -13.658  -7.904  -3.952
  742    HD3  PRO  45           HD3      PRO  45 -14.144  -8.147  -2.270
  743    H    ASP  46           H        ASP  46 -17.170 -11.284  -5.853
  744    HA   ASP  46           HA       ASP  46 -15.484 -10.490  -8.127
  745    HB2  ASP  46           HB2      ASP  46 -17.286 -12.907  -7.931
  746    HB3  ASP  46           HB3      ASP  46 -16.290 -12.467  -9.304
  747    H    TYR  47           H        TYR  47 -16.999 -10.714 -10.220
  748    HA   TYR  47           HA       TYR  47 -19.472  -9.258  -9.650
  749    HB2  TYR  47           HB2      TYR  47 -18.971  -7.798 -11.573
  750    HB3  TYR  47           HB3      TYR  47 -17.791  -7.626 -10.289
  751    HD1  TYR  47           HD1      TYR  47 -18.190  -7.861 -13.727
  752    HD2  TYR  47           HD2      TYR  47 -15.678  -9.289 -10.601
  753    HE1  TYR  47           HE1      TYR  47 -16.393  -8.251 -15.357
  754    HE2  TYR  47           HE2      TYR  47 -13.872  -9.677 -12.227
  755    HH   TYR  47           HH       TYR  47 -13.645 -10.084 -14.672
  756    H    ALA  48           H        ALA  48 -21.180  -9.730 -10.939
  757    HA   ALA  48           HA       ALA  48 -20.753 -11.678 -13.100
  758    HB1  ALA  48           HB1      ALA  48 -22.972 -11.744 -11.055
  759    HB2  ALA  48           HB2      ALA  48 -21.601 -12.851 -11.131
  760    HB3  ALA  48           HB3      ALA  48 -22.798 -12.839 -12.426
  Start of MODEL   13
    1    H1   SER   0           H1       SER   0  -5.953   8.705  15.822
    2    H2   SER   0           H2       SER   0  -5.784   7.536  14.616
    3    H3   SER   0           H3       SER   0  -7.303   8.198  14.946
    4    HA   SER   0           HA       SER   0  -6.596  10.343  14.189
    5    HB2  SER   0           HB2      SER   0  -4.310  10.325  12.959
    6    HB3  SER   0           HB3      SER   0  -4.315  10.440  14.718
    7    HG   SER   0           HG       SER   0  -3.037   8.771  14.585
    8    H    MET   1           H        MET   1  -8.411   8.986  13.145
    9    HA   MET   1           HA       MET   1  -7.632   8.380  10.367
   10    HB2  MET   1           HB2      MET   1  -9.771   7.008  12.017
   11    HB3  MET   1           HB3      MET   1  -9.503   6.739  10.305
   12    HG2  MET   1           HG2      MET   1  -8.491   4.931  11.371
   13    HG3  MET   1           HG3      MET   1  -7.161   6.000  10.936
   14    HE1  MET   1           HE1      MET   1  -9.442   4.638  13.776
   15    HE2  MET   1           HE2      MET   1  -9.719   6.368  13.967
   16    HE3  MET   1           HE3      MET   1  -8.838   5.475  15.205
   17    H    ASP   2           H        ASP   2  -9.736   8.403   8.961
   18    HA   ASP   2           HA       ASP   2 -11.409   9.593   8.002
   19    HB2  ASP   2           HB2      ASP   2 -12.633   8.748   9.990
   20    HB3  ASP   2           HB3      ASP   2 -12.209  10.223  10.850
   21    H    GLU   3           H        GLU   3  -9.825  11.088   7.168
   22    HA   GLU   3           HA       GLU   3 -10.038  13.746   8.415
   23    HB2  GLU   3           HB2      GLU   3  -7.890  12.704   6.561
   24    HB3  GLU   3           HB3      GLU   3  -7.973  14.339   7.199
   25    HG2  GLU   3           HG2      GLU   3  -7.810  13.375   9.490
   26    HG3  GLU   3           HG3      GLU   3  -7.534  11.800   8.749
   27    H    THR   4           H        THR   4 -10.071  12.004   5.327
   28    HA   THR   4           HA       THR   4 -11.606  14.248   4.198
   29    HB   THR   4           HB       THR   4  -9.616  12.599   2.635
   30    HG1  THR   4           HG1      THR   4  -9.283  14.807   4.271
   31   HG21  THR   4          HG21      THR   4  -9.865  14.416   0.984
   32   HG22  THR   4          HG22      THR   4 -11.088  15.164   2.012
   33   HG23  THR   4          HG23      THR   4 -11.390  13.585   1.287
   34    H    VAL   5           H        VAL   5 -13.530  13.671   3.421
   35    HA   VAL   5           HA       VAL   5 -13.865  11.068   2.179
   36    HB   VAL   5           HB       VAL   5 -14.506  10.554   4.438
   37   HG11  VAL   5          HG11      VAL   5 -14.929  12.803   5.236
   38   HG12  VAL   5          HG12      VAL   5 -16.298  11.748   5.593
   39   HG13  VAL   5          HG13      VAL   5 -16.390  12.891   4.254
   40   HG21  VAL   5          HG21      VAL   5 -16.843   9.872   4.114
   41   HG22  VAL   5          HG22      VAL   5 -15.852   9.531   2.697
   42   HG23  VAL   5          HG23      VAL   5 -16.942  10.917   2.697
   43    H    LYS   6           H        LYS   6 -15.066  11.181   0.408
   44    HA   LYS   6           HA       LYS   6 -16.958  13.408   0.091
   45    HB2  LYS   6           HB2      LYS   6 -15.073  12.398  -2.017
   46    HB3  LYS   6           HB3      LYS   6 -16.298  13.617  -2.266
   47    HG2  LYS   6           HG2      LYS   6 -15.145  15.143  -0.871
   48    HG3  LYS   6           HG3      LYS   6 -14.009  13.908  -0.343
   49    HD2  LYS   6           HD2      LYS   6 -12.925  15.295  -1.981
   50    HD3  LYS   6           HD3      LYS   6 -13.229  13.718  -2.695
   51    HE2  LYS   6           HE2      LYS   6 -15.225  14.618  -3.801
   52    HE3  LYS   6           HE3      LYS   6 -14.863  16.196  -3.115
   53    HZ1  LYS   6           HZ1      LYS   6 -13.192  14.685  -5.049
   54    HZ2  LYS   6           HZ2      LYS   6 -12.725  16.135  -4.307
   55    HZ3  LYS   6           HZ3      LYS   6 -14.054  16.112  -5.348
   56    H    LEU   7           H        LEU   7 -15.924  10.820  -2.037
   57    HA   LEU   7           HA       LEU   7 -18.043   9.045  -1.384
   58    HB2  LEU   7           HB2      LEU   7 -19.193   9.014  -3.529
   59    HB3  LEU   7           HB3      LEU   7 -19.345  10.585  -2.784
   60    HG   LEU   7           HG       LEU   7 -17.224  10.125  -4.849
   61   HD11  LEU   7          HD11      LEU   7 -18.809  10.791  -6.581
   62   HD12  LEU   7          HD12      LEU   7 -20.119  10.775  -5.401
   63   HD13  LEU   7          HD13      LEU   7 -19.300   9.273  -5.832
   64   HD21  LEU   7          HD21      LEU   7 -18.897  12.492  -4.040
   65   HD22  LEU   7          HD22      LEU   7 -17.625  12.499  -5.260
   66   HD23  LEU   7          HD23      LEU   7 -17.225  12.197  -3.570
   67    H    ASN   8           H        ASN   8 -15.632  10.081  -3.727
   68    HA   ASN   8           HA       ASN   8 -14.591   7.319  -3.781
   69    HB2  ASN   8           HB2      ASN   8 -14.013   9.591  -5.702
   70    HB3  ASN   8           HB3      ASN   8 -13.379   7.973  -5.833
   71   HD21  ASN   8          HD21      ASN   8 -14.877   9.434  -7.766
   72   HD22  ASN   8          HD22      ASN   8 -16.309   8.526  -8.080
   73    H    HIS   9           H        HIS   9 -12.845   7.071  -2.490
   74    HA   HIS   9           HA       HIS   9 -11.422   9.398  -1.527
   75    HB2  HIS   9           HB2      HIS   9 -11.934   7.186  -0.246
   76    HB3  HIS   9           HB3      HIS   9 -10.493   6.592  -1.035
   77    HD1  HIS   9           HD1      HIS   9 -11.355   7.751   2.096
   78    HD2  HIS   9           HD2      HIS   9  -8.375   8.905  -0.563
   79    HE1  HIS   9           HE1      HIS   9  -9.586   8.859   3.493
   80    HE2  HIS   9           HE2      HIS   9  -7.857   9.660   1.852
   81    H    THR  10           H        THR  10  -9.354   9.895  -1.962
   82    HA   THR  10           HA       THR  10  -8.520   9.213  -4.636
   83    HB   THR  10           HB       THR  10  -7.160  10.999  -2.590
   84    HG1  THR  10           HG1      THR  10  -8.228  12.625  -4.091
   85   HG21  THR  10          HG21      THR  10  -5.690  10.299  -4.438
   86   HG22  THR  10          HG22      THR  10  -6.056  12.023  -4.502
   87   HG23  THR  10          HG23      THR  10  -6.874  10.906  -5.595
   88    H    CYS  11           H        CYS  11  -6.917   7.905  -5.259
   89    HA   CYS  11           HA       CYS  11  -5.781   6.079  -3.411
   90    HB2  CYS  11           HB2      CYS  11  -6.173   5.414  -5.737
   91    HB3  CYS  11           HB3      CYS  11  -5.017   6.614  -6.283
   92    H    VAL  12           H        VAL  12  -4.280   6.499  -2.068
   93    HA   VAL  12           HA       VAL  12  -2.468   8.503  -1.937
   94    HB   VAL  12           HB       VAL  12  -3.213   6.422  -0.476
   95   HG11  VAL  12          HG11      VAL  12  -2.046   4.729  -1.664
   96   HG12  VAL  12          HG12      VAL  12  -1.382   4.908  -0.041
   97   HG13  VAL  12          HG13      VAL  12  -0.514   5.573  -1.428
   98   HG21  VAL  12          HG21      VAL  12  -2.382   8.218   0.549
   99   HG22  VAL  12          HG22      VAL  12  -0.836   8.123  -0.283
  100   HG23  VAL  12          HG23      VAL  12  -1.233   6.952   0.974
  101    H    ILE  13           H        ILE  13  -2.545   5.965  -4.192
  102    HA   ILE  13           HA       ILE  13   0.299   6.184  -4.836
  103    HB   ILE  13           HB       ILE  13  -1.629   4.193  -5.964
  104   HG12  ILE  13          HG12      ILE  13  -1.569   4.086  -3.458
  105   HG13  ILE  13          HG13      ILE  13  -1.035   2.626  -4.272
  106   HG21  ILE  13          HG21      ILE  13   1.356   4.200  -5.677
  107   HG22  ILE  13          HG22      ILE  13   0.444   4.458  -7.165
  108   HG23  ILE  13          HG23      ILE  13   0.388   2.889  -6.357
  109   HD11  ILE  13          HD11      ILE  13   1.219   3.130  -3.840
  110   HD12  ILE  13          HD12      ILE  13   0.316   3.314  -2.333
  111   HD13  ILE  13          HD13      ILE  13   0.804   4.737  -3.252
  112    H    CYS  14           H        CYS  14  -2.824   5.920  -6.486
  113    HA   CYS  14           HA       CYS  14  -1.745   6.756  -9.005
  114    HB2  CYS  14           HB2      CYS  14  -4.579   6.362  -8.147
  115    HB3  CYS  14           HB3      CYS  14  -4.092   6.654  -9.788
  116    H    ASP  15           H        ASP  15  -3.089   8.354  -6.310
  117    HA   ASP  15           HA       ASP  15  -3.855  10.426  -5.864
  118    HB2  ASP  15           HB2      ASP  15  -2.186  10.999  -8.287
  119    HB3  ASP  15           HB3      ASP  15  -3.060  12.262  -7.435
  120    H    GLN  16           H        GLN  16  -5.603   8.770  -7.095
  121    HA   GLN  16           HA       GLN  16  -7.285  10.560  -8.674
  122    HB2  GLN  16           HB2      GLN  16  -6.872   7.611  -9.183
  123    HB3  GLN  16           HB3      GLN  16  -8.030   8.629 -10.015
  124    HG2  GLN  16           HG2      GLN  16  -5.062   8.918 -10.094
  125    HG3  GLN  16           HG3      GLN  16  -6.065   8.254 -11.366
  126   HE21  GLN  16          HE21      GLN  16  -4.247  10.479 -11.460
  127   HE22  GLN  16          HE22      GLN  16  -5.181  11.845 -11.944
  128    H    GLU  17           H        GLU  17  -9.529  10.216  -8.381
  129    HA   GLU  17           HA       GLU  17 -10.192   9.402  -5.711
  130    HB2  GLU  17           HB2      GLU  17 -11.845  10.695  -7.881
  131    HB3  GLU  17           HB3      GLU  17 -12.410  10.377  -6.247
  132    HG2  GLU  17           HG2      GLU  17 -10.800  11.878  -5.329
  133    HG3  GLU  17           HG3      GLU  17 -10.038  12.072  -6.902
  134    H    LYS  18           H        LYS  18 -10.587   7.432  -5.351
  135    HA   LYS  18           HA       LYS  18 -12.103   5.769  -7.257
  136    HB2  LYS  18           HB2      LYS  18 -10.204   4.438  -5.470
  137    HB3  LYS  18           HB3      LYS  18 -10.654   4.038  -7.098
  138    HG2  LYS  18           HG2      LYS  18  -8.767   6.224  -6.298
  139    HG3  LYS  18           HG3      LYS  18  -8.315   4.653  -6.956
  140    HD2  LYS  18           HD2      LYS  18 -10.193   6.358  -8.494
  141    HD3  LYS  18           HD3      LYS  18  -8.499   6.780  -8.474
  142    HE2  LYS  18           HE2      LYS  18  -9.006   5.448 -10.404
  143    HE3  LYS  18           HE3      LYS  18  -7.981   4.566  -9.295
  144    HZ1  LYS  18           HZ1      LYS  18  -9.766   3.192 -10.215
  145    HZ2  LYS  18           HZ2      LYS  18 -10.911   4.218  -9.515
  146    HZ3  LYS  18           HZ3      LYS  18  -9.874   3.313  -8.534
  147    H    ASN  19           H        ASN  19 -13.635   4.370  -6.356
  148    HA   ASN  19           HA       ASN  19 -14.255   5.052  -3.577
  149    HB2  ASN  19           HB2      ASN  19 -16.506   4.353  -3.998
  150    HB3  ASN  19           HB3      ASN  19 -16.004   5.406  -5.309
  151   HD21  ASN  19          HD21      ASN  19 -15.718   4.585  -7.354
  152   HD22  ASN  19          HD22      ASN  19 -16.308   2.996  -7.816
  153    H    ARG  20           H        ARG  20 -12.877   2.542  -5.347
  154    HA   ARG  20           HA       ARG  20 -13.396   0.707  -3.110
  155    HB2  ARG  20           HB2      ARG  20 -13.071   0.002  -6.017
  156    HB3  ARG  20           HB3      ARG  20 -13.002  -1.166  -4.730
  157    HG2  ARG  20           HG2      ARG  20 -15.278  -0.636  -4.106
  158    HG3  ARG  20           HG3      ARG  20 -15.341   0.578  -5.376
  159    HD2  ARG  20           HD2      ARG  20 -14.923  -1.067  -7.048
  160    HD3  ARG  20           HD3      ARG  20 -14.752  -2.264  -5.801
  161    HE   ARG  20           HE       ARG  20 -17.305  -1.002  -5.699
  162   HH11  ARG  20          HH11      ARG  20 -15.483  -3.482  -7.360
  163   HH12  ARG  20          HH12      ARG  20 -16.892  -4.354  -7.879
  164   HH21  ARG  20          HH21      ARG  20 -19.168  -2.143  -6.394
  165   HH22  ARG  20          HH22      ARG  20 -18.983  -3.589  -7.333
  166    H    GLY  21           H        GLY  21 -11.760  -0.242  -2.157
  167    HA2  GLY  21           HA2      GLY  21  -9.282  -0.949  -2.789
  168    HA3  GLY  21           HA3      GLY  21  -9.098   0.792  -2.694
  169    H    ILE  22           H        ILE  22  -7.669   0.438  -0.761
  170    HA   ILE  22           HA       ILE  22  -9.266  -0.287   1.600
  171    HB   ILE  22           HB       ILE  22  -7.507  -1.402   2.574
  172   HG12  ILE  22          HG12      ILE  22  -5.691   0.058   0.687
  173   HG13  ILE  22          HG13      ILE  22  -5.933   0.440   2.357
  174   HG21  ILE  22          HG21      ILE  22  -6.612  -2.952   0.978
  175   HG22  ILE  22          HG22      ILE  22  -6.906  -1.822  -0.346
  176   HG23  ILE  22          HG23      ILE  22  -8.266  -2.549   0.509
  177   HD11  ILE  22          HD11      ILE  22  -3.863  -0.724   2.092
  178   HD12  ILE  22          HD12      ILE  22  -4.682  -2.049   1.266
  179   HD13  ILE  22          HD13      ILE  22  -5.005  -1.739   2.975
  180    H    HIS  23           H        HIS  23  -7.689   0.469   3.557
  181    HA   HIS  23           HA       HIS  23  -6.871   3.186   3.275
  182    HB2  HIS  23           HB2      HIS  23  -8.629   4.098   4.830
  183    HB3  HIS  23           HB3      HIS  23  -9.226   3.648   3.249
  184    HD1  HIS  23           HD1      HIS  23  -9.454   2.733   6.869
  185    HD2  HIS  23           HD2      HIS  23 -11.015   1.548   3.227
  186    HE1  HIS  23           HE1      HIS  23 -11.375   1.212   7.432
  187    HE2  HIS  23           HE2      HIS  23 -12.205   0.374   5.205
  188    H    LEU  24           H        LEU  24  -5.074   3.083   4.463
  189    HA   LEU  24           HA       LEU  24  -5.208   1.910   7.125
  190    HB2  LEU  24           HB2      LEU  24  -2.822   2.666   5.440
  191    HB3  LEU  24           HB3      LEU  24  -2.791   1.953   6.999
  192    HG   LEU  24           HG       LEU  24  -4.029   0.523   4.684
  193   HD11  LEU  24          HD11      LEU  24  -1.162   0.516   5.612
  194   HD12  LEU  24          HD12      LEU  24  -1.770   1.003   4.029
  195   HD13  LEU  24          HD13      LEU  24  -1.861  -0.687   4.529
  196   HD21  LEU  24          HD21      LEU  24  -2.851  -0.434   7.293
  197   HD22  LEU  24          HD22      LEU  24  -3.580  -1.447   6.047
  198   HD23  LEU  24          HD23      LEU  24  -4.574  -0.290   6.935
  199    H    TYR  25           H        TYR  25  -4.886   3.255   8.836
  200    HA   TYR  25           HA       TYR  25  -4.635   5.172  10.028
  201    HB2  TYR  25           HB2      TYR  25  -3.038   6.256   7.738
  202    HB3  TYR  25           HB3      TYR  25  -2.978   6.790   9.398
  203    HD1  TYR  25           HD1      TYR  25  -3.006   3.203   8.700
  204    HD2  TYR  25           HD2      TYR  25  -0.503   6.585   9.346
  205    HE1  TYR  25           HE1      TYR  25  -1.108   1.714   9.011
  206    HE2  TYR  25           HE2      TYR  25   1.436   5.086   9.674
  207    HH   TYR  25           HH       TYR  25   1.450   1.909   8.781
  208    H    THR  26           H        THR  26  -4.219   7.408   7.572
  209    HA   THR  26           HA       THR  26  -7.091   7.963   7.541
  210    HB   THR  26           HB       THR  26  -6.243   9.864   8.444
  211    HG1  THR  26           HG1      THR  26  -5.998  11.468   6.780
  212   HG21  THR  26          HG21      THR  26  -3.773   9.632   6.736
  213   HG22  THR  26          HG22      THR  26  -3.913   9.104   8.412
  214   HG23  THR  26          HG23      THR  26  -4.058  10.818   8.007
  215    H    LYS  27           H        LYS  27  -4.653   6.718   5.554
  216    HA   LYS  27           HA       LYS  27  -5.485   8.183   3.174
  217    HB2  LYS  27           HB2      LYS  27  -3.636   6.048   2.621
  218    HB3  LYS  27           HB3      LYS  27  -3.471   7.771   2.342
  219    HG2  LYS  27           HG2      LYS  27  -2.893   6.343   4.906
  220    HG3  LYS  27           HG3      LYS  27  -1.713   6.888   3.722
  221    HD2  LYS  27           HD2      LYS  27  -3.633   8.723   5.109
  222    HD3  LYS  27           HD3      LYS  27  -2.010   8.397   5.695
  223    HE2  LYS  27           HE2      LYS  27  -1.283   9.086   3.297
  224    HE3  LYS  27           HE3      LYS  27  -2.890   9.791   3.192
  225    HZ1  LYS  27           HZ1      LYS  27  -0.845  10.483   5.239
  226    HZ2  LYS  27           HZ2      LYS  27  -2.402  11.147   5.123
  227    HZ3  LYS  27           HZ3      LYS  27  -1.278  11.424   3.898
  228    H    PHE  28           H        PHE  28  -5.153   6.670   1.180
  229    HA   PHE  28           HA       PHE  28  -6.801   4.272   1.377
  230    HB2  PHE  28           HB2      PHE  28  -8.420   5.941   0.892
  231    HB3  PHE  28           HB3      PHE  28  -7.361   6.727  -0.261
  232    HD1  PHE  28           HD1      PHE  28  -9.521   3.779   0.296
  233    HD2  PHE  28           HD2      PHE  28  -7.309   6.055  -2.524
  234    HE1  PHE  28           HE1      PHE  28 -10.571   2.525  -1.541
  235    HE2  PHE  28           HE2      PHE  28  -8.335   4.802  -4.363
  236    HZ   PHE  28           HZ       PHE  28  -9.957   3.012  -3.892
  237    H    ILE  29           H        ILE  29  -5.410   2.816   0.530
  238    HA   ILE  29           HA       ILE  29  -3.994   3.471  -1.939
  239    HB   ILE  29           HB       ILE  29  -4.168   0.822  -0.456
  240   HG12  ILE  29          HG12      ILE  29  -1.614   1.316  -0.237
  241   HG13  ILE  29          HG13      ILE  29  -2.091   2.987  -0.498
  242   HG21  ILE  29          HG21      ILE  29  -2.448   0.029  -2.000
  243   HG22  ILE  29          HG22      ILE  29  -2.498   1.568  -2.856
  244   HG23  ILE  29          HG23      ILE  29  -3.913   0.511  -2.863
  245   HD11  ILE  29          HD11      ILE  29  -3.439   2.972   1.474
  246   HD12  ILE  29          HD12      ILE  29  -1.840   2.338   1.883
  247   HD13  ILE  29          HD13      ILE  29  -3.202   1.237   1.677
  248    H    CYS  30           H        CYS  30  -5.092   3.201  -3.863
  249    HA   CYS  30           HA       CYS  30  -7.694   2.088  -3.888
  250    HB2  CYS  30           HB2      CYS  30  -7.825   2.602  -6.128
  251    HB3  CYS  30           HB3      CYS  30  -6.552   3.693  -5.621
  252    H    LEU  31           H        LEU  31  -8.425   0.285  -4.986
  253    HA   LEU  31           HA       LEU  31  -7.479  -1.991  -3.803
  254    HB2  LEU  31           HB2      LEU  31  -9.261  -3.021  -4.832
  255    HB3  LEU  31           HB3      LEU  31  -9.772  -1.378  -4.688
  256    HG   LEU  31           HG       LEU  31  -8.828  -1.253  -7.172
  257   HD11  LEU  31          HD11      LEU  31  -9.363  -3.288  -8.408
  258   HD12  LEU  31          HD12      LEU  31  -9.700  -4.125  -6.891
  259   HD13  LEU  31          HD13      LEU  31  -8.066  -3.560  -7.245
  260   HD21  LEU  31          HD21      LEU  31 -11.082  -0.668  -6.494
  261   HD22  LEU  31          HD22      LEU  31 -11.518  -2.374  -6.410
  262   HD23  LEU  31          HD23      LEU  31 -11.111  -1.644  -7.963
  263    H    ASP  32           H        ASP  32  -6.486  -0.573  -6.697
  264    HA   ASP  32           HA       ASP  32  -5.611  -2.978  -8.039
  265    HB2  ASP  32           HB2      ASP  32  -6.467  -0.939  -9.171
  266    HB3  ASP  32           HB3      ASP  32  -5.040  -0.120  -8.632
  267    H    CYS  33           H        CYS  33  -4.337  -0.252  -6.424
  268    HA   CYS  33           HA       CYS  33  -1.597  -0.930  -6.651
  269    HB2  CYS  33           HB2      CYS  33  -2.974   1.116  -4.935
  270    HB3  CYS  33           HB3      CYS  33  -1.255   0.850  -4.955
  271    H    GLU  34           H        GLU  34  -4.139  -1.443  -4.396
  272    HA   GLU  34           HA       GLU  34  -2.660  -2.248  -2.200
  273    HB2  GLU  34           HB2      GLU  34  -5.067  -1.842  -2.097
  274    HB3  GLU  34           HB3      GLU  34  -5.372  -3.228  -3.125
  275    HG2  GLU  34           HG2      GLU  34  -3.912  -3.668  -0.577
  276    HG3  GLU  34           HG3      GLU  34  -5.625  -3.333  -0.504
  277    H    ARG  35           H        ARG  35  -3.736  -4.120  -4.994
  278    HA   ARG  35           HA       ARG  35  -2.325  -6.427  -4.058
  279    HB2  ARG  35           HB2      ARG  35  -2.881  -7.500  -6.156
  280    HB3  ARG  35           HB3      ARG  35  -4.301  -6.706  -5.495
  281    HG2  ARG  35           HG2      ARG  35  -3.935  -4.833  -7.062
  282    HG3  ARG  35           HG3      ARG  35  -2.594  -5.728  -7.759
  283    HD2  ARG  35           HD2      ARG  35  -5.445  -6.572  -7.687
  284    HD3  ARG  35           HD3      ARG  35  -4.553  -6.052  -9.103
  285    HE   ARG  35           HE       ARG  35  -3.151  -8.188  -8.092
  286   HH11  ARG  35          HH11      ARG  35  -6.408  -7.650  -9.261
  287   HH12  ARG  35          HH12      ARG  35  -6.612  -9.279  -9.820
  288   HH21  ARG  35          HH21      ARG  35  -3.422 -10.334  -8.816
  289   HH22  ARG  35          HH22      ARG  35  -4.913 -10.806  -9.566
  290    H    LYS  36           H        LYS  36  -1.451  -3.649  -5.821
  291    HA   LYS  36           HA       LYS  36   0.598  -4.695  -7.437
  292    HB2  LYS  36           HB2      LYS  36   0.199  -1.948  -6.367
  293    HB3  LYS  36           HB3      LYS  36   1.465  -2.362  -7.492
  294    HG2  LYS  36           HG2      LYS  36  -0.486  -3.156  -8.967
  295    HG3  LYS  36           HG3      LYS  36  -1.476  -2.226  -7.923
  296    HD2  LYS  36           HD2      LYS  36  -0.373  -0.300  -8.517
  297    HD3  LYS  36           HD3      LYS  36   0.940  -1.140  -9.298
  298    HE2  LYS  36           HE2      LYS  36  -0.666  -1.962 -10.983
  299    HE3  LYS  36           HE3      LYS  36  -1.933  -1.010 -10.213
  300    HZ1  LYS  36           HZ1      LYS  36  -0.995   0.108 -12.145
  301    HZ2  LYS  36           HZ2      LYS  36   0.539   0.094 -11.440
  302    HZ3  LYS  36           HZ3      LYS  36  -0.705   0.998 -10.737
  303    H    VAL  37           H        VAL  37   0.369  -3.360  -4.273
  304    HA   VAL  37           HA       VAL  37   3.032  -3.098  -3.634
  305    HB   VAL  37           HB       VAL  37   2.338  -3.203  -1.296
  306   HG11  VAL  37          HG11      VAL  37   0.203  -1.668  -2.739
  307   HG12  VAL  37          HG12      VAL  37   1.896  -1.167  -2.814
  308   HG13  VAL  37          HG13      VAL  37   1.067  -1.232  -1.259
  309   HG21  VAL  37          HG21      VAL  37  -0.115  -4.342  -2.475
  310   HG22  VAL  37          HG22      VAL  37  -0.238  -3.355  -1.018
  311   HG23  VAL  37          HG23      VAL  37   0.776  -4.799  -1.017
  312    H    ILE  38           H        ILE  38   0.870  -5.776  -3.133
  313    HA   ILE  38           HA       ILE  38   2.535  -7.504  -1.691
  314    HB   ILE  38           HB       ILE  38   0.433  -8.522  -3.581
  315   HG12  ILE  38          HG12      ILE  38  -0.057  -6.963  -1.053
  316   HG13  ILE  38          HG13      ILE  38  -0.710  -6.665  -2.648
  317   HG21  ILE  38          HG21      ILE  38   1.330  -9.337  -0.835
  318   HG22  ILE  38          HG22      ILE  38   1.630 -10.181  -2.350
  319   HG23  ILE  38          HG23      ILE  38  -0.009 -10.080  -1.707
  320   HD11  ILE  38          HD11      ILE  38  -2.233  -7.693  -0.860
  321   HD12  ILE  38          HD12      ILE  38  -1.354  -9.188  -1.190
  322   HD13  ILE  38          HD13      ILE  38  -2.244  -8.386  -2.484
  323    H    SER  39           H        SER  39   2.078  -6.754  -5.007
  324    HA   SER  39           HA       SER  39   3.507  -9.041  -5.902
  325    HB2  SER  39           HB2      SER  39   1.615  -8.089  -7.208
  326    HB3  SER  39           HB3      SER  39   2.575  -6.638  -7.486
  327    HG   SER  39           HG       SER  39   3.591  -9.164  -8.200
  328    H    THR  40           H        THR  40   4.191  -5.864  -4.941
  329    HA   THR  40           HA       THR  40   6.643  -5.558  -6.424
  330    HB   THR  40           HB       THR  40   5.486  -3.920  -4.157
  331    HG1  THR  40           HG1      THR  40   4.253  -4.006  -6.160
  332   HG21  THR  40          HG21      THR  40   7.919  -3.611  -4.408
  333   HG22  THR  40          HG22      THR  40   7.011  -2.165  -4.853
  334   HG23  THR  40          HG23      THR  40   7.678  -3.208  -6.110
  335    H    SER  41           H        SER  41   5.930  -5.631  -2.911
  336    HA   SER  41           HA       SER  41   8.715  -6.216  -2.397
  337    HB2  SER  41           HB2      SER  41   7.888  -4.530  -1.037
  338    HB3  SER  41           HB3      SER  41   6.448  -5.447  -0.678
  339    HG   SER  41           HG       SER  41   7.483  -6.002   1.051
  340    H    THR  42           H        THR  42   5.630  -7.568  -1.281
  341    HA   THR  42           HA       THR  42   6.948  -9.789  -0.073
  342    HB   THR  42           HB       THR  42   4.397 -10.515   0.087
  343    HG1  THR  42           HG1      THR  42   3.979  -7.745   0.091
  344   HG21  THR  42          HG21      THR  42   5.601  -8.204   1.619
  345   HG22  THR  42          HG22      THR  42   5.837  -9.914   1.979
  346   HG23  THR  42          HG23      THR  42   4.238  -9.190   2.145
  347    H    SER  43           H        SER  43   6.751  -9.338  -3.174
  348    HA   SER  43           HA       SER  43   6.181 -12.167  -3.744
  349    HB2  SER  43           HB2      SER  43   4.718 -10.561  -4.960
  350    HB3  SER  43           HB3      SER  43   6.154  -9.847  -5.692
  351    HG   SER  43           HG       SER  43   6.516 -12.227  -6.318
  352    H    ASP  44           H        ASP  44   8.562  -9.945  -3.260
  353    HA   ASP  44           HA       ASP  44  10.677 -11.643  -4.003
  354    HB2  ASP  44           HB2      ASP  44  10.151 -10.963  -6.296
  355    HB3  ASP  44           HB3      ASP  44  10.234  -9.268  -5.829
  356    HA   PRO  45           HA       PRO  45  11.701  -8.730  -0.688
  357    HB2  PRO  45           HB2      PRO  45  13.980 -10.535  -0.301
  358    HB3  PRO  45           HB3      PRO  45  12.709 -10.099   0.822
  359    HG2  PRO  45           HG2      PRO  45  12.902 -12.482  -0.282
  360    HG3  PRO  45           HG3      PRO  45  11.359 -11.781   0.182
  361    HD2  PRO  45           HD2      PRO  45  12.546 -12.118  -2.525
  362    HD3  PRO  45           HD3      PRO  45  10.845 -12.140  -2.023
  363    H    ASP  46           H        ASP  46  13.493  -7.425  -0.178
  364    HA   ASP  46           HA       ASP  46  15.111  -6.794  -2.542
  365    HB2  ASP  46           HB2      ASP  46  13.731  -4.967  -1.651
  366    HB3  ASP  46           HB3      ASP  46  14.515  -5.129  -0.083
  367    H    TYR  47           H        TYR  47  15.326  -7.537   0.872
  368    HA   TYR  47           HA       TYR  47  18.185  -8.052   0.493
  369    HB2  TYR  47           HB2      TYR  47  18.359  -7.413   3.013
  370    HB3  TYR  47           HB3      TYR  47  18.339  -6.142   1.801
  371    HD1  TYR  47           HD1      TYR  47  16.475  -7.732   4.528
  372    HD2  TYR  47           HD2      TYR  47  16.426  -4.656   1.590
  373    HE1  TYR  47           HE1      TYR  47  14.592  -6.660   5.687
  374    HE2  TYR  47           HE2      TYR  47  14.540  -3.579   2.742
  375    HH   TYR  47           HH       TYR  47  12.730  -4.189   4.283
  376    H    ALA  48           H        ALA  48  18.313 -10.181   0.472
  377    HA   ALA  48           HA       ALA  48  17.359 -11.667   2.782
  378    HB1  ALA  48           HB1      ALA  48  16.582 -12.468  -0.023
  379    HB2  ALA  48           HB2      ALA  48  15.490 -11.799   1.189
  380    HB3  ALA  48           HB3      ALA  48  16.242 -13.373   1.451
  381    H1   SER   0           H1       SER   0   6.023   8.539 -16.096
  382    H2   SER   0           H2       SER   0   5.843   7.376 -14.887
  383    H3   SER   0           H3       SER   0   7.370   8.018 -15.221
  384    HA   SER   0           HA       SER   0   6.691  10.174 -14.468
  385    HB2  SER   0           HB2      SER   0   4.401  10.185 -13.242
  386    HB3  SER   0           HB3      SER   0   4.413  10.295 -15.001
  387    HG   SER   0           HG       SER   0   3.101   8.652 -14.846
  388    H    MET   1           H        MET   1   8.481   8.792 -13.418
  389    HA   MET   1           HA       MET   1   7.691   8.202 -10.640
  390    HB2  MET   1           HB2      MET   1   9.811   6.795 -12.284
  391    HB3  MET   1           HB3      MET   1   9.538   6.534 -10.571
  392    HG2  MET   1           HG2      MET   1   8.498   4.739 -11.634
  393    HG3  MET   1           HG3      MET   1   7.186   5.829 -11.199
  394    HE1  MET   1           HE1      MET   1   9.437   4.423 -14.035
  395    HE2  MET   1           HE2      MET   1   9.745   6.148 -14.232
  396    HE3  MET   1           HE3      MET   1   8.848   5.265 -15.467
  397    H    ASP   2           H        ASP   2   9.802   8.189  -9.235
  398    HA   ASP   2           HA       ASP   2  11.488   9.362  -8.275
  399    HB2  ASP   2           HB2      ASP   2  12.701   8.488 -10.258
  400    HB3  ASP   2           HB3      ASP   2  12.296   9.962 -11.127
  401    H    GLU   3           H        GLU   3   9.933  10.887  -7.443
  402    HA   GLU   3           HA       GLU   3  10.188  13.532  -8.706
  403    HB2  GLU   3           HB2      GLU   3   8.021  12.541  -6.848
  404    HB3  GLU   3           HB3      GLU   3   8.135  14.171  -7.491
  405    HG2  GLU   3           HG2      GLU   3   7.948  13.207  -9.779
  406    HG3  GLU   3           HG3      GLU   3   7.651  11.638  -9.034
  407    H    THR   4           H        THR   4  10.184  11.815  -5.606
  408    HA   THR   4           HA       THR   4  11.765  14.034  -4.492
  409    HB   THR   4           HB       THR   4   9.744  12.424  -2.926
  410    HG1  THR   4           HG1      THR   4   9.450  14.617  -4.576
  411   HG21  THR   4          HG21      THR   4  10.026  14.240  -1.277
  412   HG22  THR   4          HG22      THR   4  11.261  14.965  -2.307
  413   HG23  THR   4          HG23      THR   4  11.537  13.383  -1.578
  414    H    VAL   5           H        VAL   5  13.678  13.421  -3.716
  415    HA   VAL   5           HA       VAL   5  13.966  10.817  -2.461
  416    HB   VAL   5           HB       VAL   5  14.599  10.288  -4.719
  417   HG11  VAL   5          HG11      VAL   5  15.062  12.526  -5.523
  418   HG12  VAL   5          HG12      VAL   5  16.411  11.447  -5.876
  419   HG13  VAL   5          HG13      VAL   5  16.523  12.594  -4.540
  420   HG21  VAL   5          HG21      VAL   5  16.925   9.570  -4.395
  421   HG22  VAL   5          HG22      VAL   5  15.929   9.245  -2.977
  422   HG23  VAL   5          HG23      VAL   5  17.040  10.613  -2.978
  423    H    LYS   6           H        LYS   6  15.175  10.914  -0.694
  424    HA   LYS   6           HA       LYS   6  17.094  13.118  -0.381
  425    HB2  LYS   6           HB2      LYS   6  15.193  12.145   1.729
  426    HB3  LYS   6           HB3      LYS   6  16.440  13.342   1.976
  427    HG2  LYS   6           HG2      LYS   6  15.314  14.885   0.576
  428    HG3  LYS   6           HG3      LYS   6  14.156  13.668   0.052
  429    HD2  LYS   6           HD2      LYS   6  13.101  15.076   1.689
  430    HD3  LYS   6           HD3      LYS   6  13.372  13.494   2.407
  431    HE2  LYS   6           HE2      LYS   6  15.379  14.372   3.505
  432    HE3  LYS   6           HE3      LYS   6  15.055  15.958   2.817
  433    HZ1  LYS   6           HZ1      LYS   6  13.355  14.475   4.759
  434    HZ2  LYS   6           HZ2      LYS   6  12.911  15.932   4.014
  435    HZ3  LYS   6           HZ3      LYS   6  14.244  15.891   5.053
  436    H    LEU   7           H        LEU   7  16.021  10.550   1.751
  437    HA   LEU   7           HA       LEU   7  18.113   8.741   1.111
  438    HB2  LEU   7           HB2      LEU   7  19.261   8.702   3.256
  439    HB3  LEU   7           HB3      LEU   7  19.436  10.267   2.507
  440    HG   LEU   7           HG       LEU   7  17.307   9.846   4.571
  441   HD11  LEU   7          HD11      LEU   7  18.903  10.496   6.302
  442   HD12  LEU   7          HD12      LEU   7  20.213  10.454   5.122
  443   HD13  LEU   7          HD13      LEU   7  19.370   8.967   5.559
  444   HD21  LEU   7          HD21      LEU   7  19.017  12.185   3.752
  445   HD22  LEU   7          HD22      LEU   7  17.745  12.216   4.973
  446   HD23  LEU   7          HD23      LEU   7  17.341  11.914   3.284
  447    H    ASN   8           H        ASN   8  15.723   9.823   3.454
  448    HA   ASN   8           HA       ASN   8  14.630   7.083   3.514
  449    HB2  ASN   8           HB2      ASN   8  14.090   9.374   5.424
  450    HB3  ASN   8           HB3      ASN   8  13.426   7.768   5.561
  451   HD21  ASN   8          HD21      ASN   8  14.953   9.211   7.493
  452   HD22  ASN   8          HD22      ASN   8  16.368   8.275   7.808
  453    H    HIS   9           H        HIS   9  12.875   6.856   2.225
  454    HA   HIS   9           HA       HIS   9  11.494   9.208   1.251
  455    HB2  HIS   9           HB2      HIS   9  11.970   6.983  -0.021
  456    HB3  HIS   9           HB3      HIS   9  10.519   6.416   0.769
  457    HD1  HIS   9           HD1      HIS   9  11.402   7.540  -2.368
  458    HD2  HIS   9           HD2      HIS   9   8.441   8.759   0.284
  459    HE1  HIS   9           HE1      HIS   9   9.660   8.679  -3.774
  460    HE2  HIS   9           HE2      HIS   9   7.939   9.508  -2.137
  461    H    THR  10           H        THR  10   9.434   9.740   1.686
  462    HA   THR  10           HA       THR  10   8.593   9.082   4.362
  463    HB   THR  10           HB       THR  10   7.256  10.877   2.307
  464    HG1  THR  10           HG1      THR  10   8.342  12.497   3.804
  465   HG21  THR  10          HG21      THR  10   5.777  10.210   4.157
  466   HG22  THR  10          HG22      THR  10   6.171  11.928   4.216
  467   HG23  THR  10          HG23      THR  10   6.971  10.802   5.312
  468    H    CYS  11           H        CYS  11   6.964   7.802   4.991
  469    HA   CYS  11           HA       CYS  11   5.801   5.988   3.147
  470    HB2  CYS  11           HB2      CYS  11   6.181   5.325   5.476
  471    HB3  CYS  11           HB3      CYS  11   5.044   6.546   6.017
  472    H    VAL  12           H        VAL  12   4.307   6.427   1.803
  473    HA   VAL  12           HA       VAL  12   2.530   8.460   1.665
  474    HB   VAL  12           HB       VAL  12   3.240   6.361   0.212
  475   HG11  VAL  12          HG11      VAL  12   2.044   4.693   1.404
  476   HG12  VAL  12          HG12      VAL  12   1.383   4.880  -0.221
  477   HG13  VAL  12          HG13      VAL  12   0.526   5.563   1.164
  478   HG21  VAL  12          HG21      VAL  12   2.441   8.168  -0.820
  479   HG22  VAL  12          HG22      VAL  12   0.892   8.103   0.011
  480   HG23  VAL  12          HG23      VAL  12   1.271   6.921  -1.242
  481    H    ILE  13           H        ILE  13   2.563   5.930   3.927
  482    HA   ILE  13           HA       ILE  13  -0.277   6.199   4.570
  483    HB   ILE  13           HB       ILE  13   1.617   4.181   5.707
  484   HG12  ILE  13          HG12      ILE  13   1.559   4.067   3.201
  485   HG13  ILE  13          HG13      ILE  13   1.000   2.618   4.021
  486   HG21  ILE  13          HG21      ILE  13  -1.368   4.235   5.415
  487   HG22  ILE  13          HG22      ILE  13  -0.453   4.484   6.904
  488   HG23  ILE  13          HG23      ILE  13  -0.421   2.912   6.102
  489   HD11  ILE  13          HD11      ILE  13  -1.244   3.153   3.584
  490   HD12  ILE  13          HD12      ILE  13  -0.336   3.321   2.076
  491   HD13  ILE  13          HD13      ILE  13  -0.805   4.753   2.991
  492    H    CYS  14           H        CYS  14   2.841   5.892   6.220
  493    HA   CYS  14           HA       CYS  14   1.777   6.754   8.737
  494    HB2  CYS  14           HB2      CYS  14   4.604   6.306   7.882
  495    HB3  CYS  14           HB3      CYS  14   4.121   6.615   9.522
  496    H    ASP  15           H        ASP  15   3.146   8.317   6.036
  497    HA   ASP  15           HA       ASP  15   3.948  10.374   5.581
  498    HB2  ASP  15           HB2      ASP  15   2.289  10.982   8.002
  499    HB3  ASP  15           HB3      ASP  15   3.185  12.227   7.147
  500    H    GLN  16           H        GLN  16   5.668   8.696   6.818
  501    HA   GLN  16           HA       GLN  16   7.379  10.463   8.393
  502    HB2  GLN  16           HB2      GLN  16   6.915   7.524   8.912
  503    HB3  GLN  16           HB3      GLN  16   8.092   8.522   9.739
  504    HG2  GLN  16           HG2      GLN  16   5.130   8.859   9.823
  505    HG3  GLN  16           HG3      GLN  16   6.126   8.186  11.096
  506   HE21  GLN  16          HE21      GLN  16   4.342  10.433  11.180
  507   HE22  GLN  16          HE22      GLN  16   5.291  11.788  11.661
  508    H    GLU  17           H        GLU  17   9.615  10.087   8.097
  509    HA   GLU  17           HA       GLU  17  10.267   9.243   5.436
  510    HB2  GLU  17           HB2      GLU  17  11.940  10.523   7.602
  511    HB3  GLU  17           HB3      GLU  17  12.499  10.189   5.967
  512    HG2  GLU  17           HG2      GLU  17  10.911  11.710   5.043
  513    HG3  GLU  17           HG3      GLU  17  10.153  11.922   6.616
  514    H    LYS  18           H        LYS  18  10.631   7.270   5.085
  515    HA   LYS  18           HA       LYS  18  12.118   5.587   6.992
  516    HB2  LYS  18           HB2      LYS  18  10.196   4.281   5.213
  517    HB3  LYS  18           HB3      LYS  18  10.641   3.882   6.842
  518    HG2  LYS  18           HG2      LYS  18   8.788   6.092   6.032
  519    HG3  LYS  18           HG3      LYS  18   8.312   4.531   6.696
  520    HD2  LYS  18           HD2      LYS  18  10.213   6.216   8.226
  521    HD3  LYS  18           HD3      LYS  18   8.527   6.662   8.205
  522    HE2  LYS  18           HE2      LYS  18   9.011   5.331  10.138
  523    HE3  LYS  18           HE3      LYS  18   7.977   4.459   9.033
  524    HZ1  LYS  18           HZ1      LYS  18   9.738   3.064   9.965
  525    HZ2  LYS  18           HZ2      LYS  18  10.903   4.071   9.267
  526    HZ3  LYS  18           HZ3      LYS  18   9.857   3.178   8.283
  527    H    ASN  19           H        ASN  19  13.631   4.163   6.098
  528    HA   ASN  19           HA       ASN  19  14.258   4.826   3.319
  529    HB2  ASN  19           HB2      ASN  19  16.499   4.088   3.741
  530    HB3  ASN  19           HB3      ASN  19  16.014   5.153   5.049
  531   HD21  ASN  19          HD21      ASN  19  15.702   4.343   7.097
  532   HD22  ASN  19          HD22      ASN  19  16.269   2.745   7.563
  533    H    ARG  20           H        ARG  20  12.837   2.348   5.095
  534    HA   ARG  20           HA       ARG  20  13.345   0.473   2.888
  535    HB2  ARG  20           HB2      ARG  20  13.024  -0.107   5.815
  536    HB3  ARG  20           HB3      ARG  20  12.894  -1.351   4.603
  537    HG2  ARG  20           HG2      ARG  20  15.152  -0.879   3.867
  538    HG3  ARG  20           HG3      ARG  20  15.295   0.337   5.128
  539    HD2  ARG  20           HD2      ARG  20  14.763  -1.361   6.733
  540    HD3  ARG  20           HD3      ARG  20  14.681  -2.569   5.493
  541    HE   ARG  20           HE       ARG  20  17.208  -1.249   5.492
  542   HH11  ARG  20          HH11      ARG  20  15.345  -3.710   7.133
  543   HH12  ARG  20          HH12      ARG  20  16.734  -4.601   7.662
  544   HH21  ARG  20          HH21      ARG  20  19.053  -2.437   6.168
  545   HH22  ARG  20          HH22      ARG  20  18.844  -3.877   7.113
  546    H    GLY  21           H        GLY  21  11.680  -0.429   1.913
  547    HA2  GLY  21           HA2      GLY  21   9.184  -1.092   2.549
  548    HA3  GLY  21           HA3      GLY  21   9.030   0.658   2.436
  549    H    ILE  22           H        ILE  22   7.602   0.303   0.516
  550    HA   ILE  22           HA       ILE  22   9.184  -0.456  -1.842
  551    HB   ILE  22           HB       ILE  22   7.404  -1.546  -2.808
  552   HG12  ILE  22          HG12      ILE  22   5.612  -0.048  -0.928
  553   HG13  ILE  22          HG13      ILE  22   5.860   0.324  -2.599
  554   HG21  ILE  22          HG21      ILE  22   6.483  -3.072  -1.205
  555   HG22  ILE  22          HG22      ILE  22   6.800  -1.942   0.113
  556   HG23  ILE  22          HG23      ILE  22   8.145  -2.698  -0.741
  557   HD11  ILE  22          HD11      ILE  22   3.773  -0.806  -2.331
  558   HD12  ILE  22          HD12      ILE  22   4.568  -2.140  -1.497
  559   HD13  ILE  22          HD13      ILE  22   4.897  -1.845  -3.208
  560    H    HIS  23           H        HIS  23   7.618   0.319  -3.800
  561    HA   HIS  23           HA       HIS  23   6.846   3.050  -3.527
  562    HB2  HIS  23           HB2      HIS  23   8.619   3.929  -5.084
  563    HB3  HIS  23           HB3      HIS  23   9.209   3.473  -3.502
  564    HD1  HIS  23           HD1      HIS  23   9.417   2.544  -7.119
  565    HD2  HIS  23           HD2      HIS  23  10.961   1.346  -3.469
  566    HE1  HIS  23           HE1      HIS  23  11.314   0.986  -7.676
  567    HE2  HIS  23           HE2      HIS  23  12.123   0.132  -5.443
  568    H    LEU  24           H        LEU  24   5.048   2.970  -4.714
  569    HA   LEU  24           HA       LEU  24   5.162   1.787  -7.372
  570    HB2  LEU  24           HB2      LEU  24   2.789   2.590  -5.690
  571    HB3  LEU  24           HB3      LEU  24   2.747   1.872  -7.248
  572    HG   LEU  24           HG       LEU  24   3.959   0.430  -4.928
  573   HD11  LEU  24          HD11      LEU  24   1.093   0.465  -5.856
  574   HD12  LEU  24          HD12      LEU  24   1.708   0.948  -4.274
  575   HD13  LEU  24          HD13      LEU  24   1.771  -0.744  -4.769
  576   HD21  LEU  24          HD21      LEU  24   2.767  -0.518  -7.535
  577   HD22  LEU  24          HD22      LEU  24   3.479  -1.539  -6.284
  578   HD23  LEU  24          HD23      LEU  24   4.492  -0.402  -7.176
  579    H    TYR  25           H        TYR  25   4.865   3.133  -9.089
  580    HA   TYR  25           HA       TYR  25   4.644   5.047 -10.289
  581    HB2  TYR  25           HB2      TYR  25   3.065   6.167  -8.004
  582    HB3  TYR  25           HB3      TYR  25   3.015   6.695  -9.667
  583    HD1  TYR  25           HD1      TYR  25   2.983   3.111  -8.956
  584    HD2  TYR  25           HD2      TYR  25   0.535   6.531  -9.611
  585    HE1  TYR  25           HE1      TYR  25   1.061   1.652  -9.262
  586    HE2  TYR  25           HE2      TYR  25  -1.428   5.067  -9.933
  587    HH   TYR  25           HH       TYR  25  -1.499   1.892  -9.036
  588    H    THR  26           H        THR  26   4.265   7.302  -7.844
  589    HA   THR  26           HA       THR  26   7.146   7.808  -7.809
  590    HB   THR  26           HB       THR  26   6.328   9.715  -8.729
  591    HG1  THR  26           HG1      THR  26   6.100  11.334  -7.067
  592   HG21  THR  26          HG21      THR  26   3.855   9.534  -7.017
  593   HG22  THR  26          HG22      THR  26   3.987   8.999  -8.692
  594   HG23  THR  26          HG23      THR  26   4.159  10.712  -8.293
  595    H    LYS  27           H        LYS  27   4.688   6.608  -5.819
  596    HA   LYS  27           HA       LYS  27   5.541   8.072  -3.446
  597    HB2  LYS  27           HB2      LYS  27   3.657   5.970  -2.886
  598    HB3  LYS  27           HB3      LYS  27   3.520   7.695  -2.611
  599    HG2  LYS  27           HG2      LYS  27   2.918   6.268  -5.171
  600    HG3  LYS  27           HG3      LYS  27   1.748   6.840  -3.989
  601    HD2  LYS  27           HD2      LYS  27   3.701   8.636  -5.382
  602    HD3  LYS  27           HD3      LYS  27   2.073   8.334  -5.970
  603    HE2  LYS  27           HE2      LYS  27   1.356   9.045  -3.575
  604    HE3  LYS  27           HE3      LYS  27   2.971   9.728  -3.473
  605    HZ1  LYS  27           HZ1      LYS  27   0.935  10.440  -5.523
  606    HZ2  LYS  27           HZ2      LYS  27   2.501  11.080  -5.411
  607    HZ3  LYS  27           HZ3      LYS  27   1.379  11.381  -4.187
  608    H    PHE  28           H        PHE  28   5.184   6.570  -1.446
  609    HA   PHE  28           HA       PHE  28   6.792   4.146  -1.635
  610    HB2  PHE  28           HB2      PHE  28   8.438   5.789  -1.154
  611    HB3  PHE  28           HB3      PHE  28   7.392   6.598  -0.005
  612    HD1  PHE  28           HD1      PHE  28   9.505   3.613  -0.549
  613    HD2  PHE  28           HD2      PHE  28   7.328   5.935   2.262
  614    HE1  PHE  28           HE1      PHE  28  10.531   2.348   1.292
  615    HE2  PHE  28           HE2      PHE  28   8.332   4.671   4.106
  616    HZ   PHE  28           HZ       PHE  28   9.925   2.855   3.641
  617    H    ILE  29           H        ILE  29   5.378   2.714  -0.782
  618    HA   ILE  29           HA       ILE  29   3.972   3.402   1.683
  619    HB   ILE  29           HB       ILE  29   4.103   0.746   0.211
  620   HG12  ILE  29          HG12      ILE  29   1.559   1.281  -0.008
  621   HG13  ILE  29          HG13      ILE  29   2.062   2.945   0.248
  622   HG21  ILE  29          HG21      ILE  29   2.371  -0.015   1.758
  623   HG22  ILE  29          HG22      ILE  29   2.446   1.527   2.609
  624   HG23  ILE  29          HG23      ILE  29   3.842   0.447   2.621
  625   HD11  ILE  29          HD11      ILE  29   3.408   2.903  -1.725
  626   HD12  ILE  29          HD12      ILE  29   1.800   2.293  -2.131
  627   HD13  ILE  29          HD13      ILE  29   3.144   1.171  -1.924
  628    H    CYS  30           H        CYS  30   5.063   3.123   3.609
  629    HA   CYS  30           HA       CYS  30   7.646   1.969   3.640
  630    HB2  CYS  30           HB2      CYS  30   7.785   2.488   5.877
  631    HB3  CYS  30           HB3      CYS  30   6.531   3.599   5.366
  632    H    LEU  31           H        LEU  31   8.348   0.158   4.746
  633    HA   LEU  31           HA       LEU  31   7.367  -2.107   3.568
  634    HB2  LEU  31           HB2      LEU  31   9.133  -3.160   4.599
  635    HB3  LEU  31           HB3      LEU  31   9.668  -1.524   4.455
  636    HG   LEU  31           HG       LEU  31   8.726  -1.382   6.935
  637   HD11  LEU  31          HD11      LEU  31   9.226  -3.420   8.181
  638   HD12  LEU  31          HD12      LEU  31   9.549  -4.268   6.668
  639   HD13  LEU  31          HD13      LEU  31   7.926  -3.676   7.018
  640   HD21  LEU  31          HD21      LEU  31  10.990  -0.836   6.258
  641   HD22  LEU  31          HD22      LEU  31  11.398  -2.551   6.182
  642   HD23  LEU  31          HD23      LEU  31  11.000  -1.806   7.730
  643    H    ASP  32           H        ASP  32   6.393  -0.661   6.453
  644    HA   ASP  32           HA       ASP  32   5.481  -3.046   7.809
  645    HB2  ASP  32           HB2      ASP  32   6.369  -1.018   8.936
  646    HB3  ASP  32           HB3      ASP  32   4.958  -0.176   8.393
  647    H    CYS  33           H        CYS  33   4.251  -0.308   6.181
  648    HA   CYS  33           HA       CYS  33   1.500  -0.937   6.411
  649    HB2  CYS  33           HB2      CYS  33   2.913   1.079   4.690
  650    HB3  CYS  33           HB3      CYS  33   1.188   0.841   4.708
  651    H    GLU  34           H        GLU  34   4.032  -1.503   4.158
  652    HA   GLU  34           HA       GLU  34   2.545  -2.292   1.961
  653    HB2  GLU  34           HB2      GLU  34   4.966  -1.949   1.898
  654    HB3  GLU  34           HB3      GLU  34   5.207  -3.353   2.901
  655    HG2  GLU  34           HG2      GLU  34   3.776  -3.733   0.363
  656    HG3  GLU  34           HG3      GLU  34   5.489  -3.428   0.284
  657    H    ARG  35           H        ARG  35   3.603  -4.162   4.746
  658    HA   ARG  35           HA       ARG  35   2.140  -6.454   3.842
  659    HB2  ARG  35           HB2      ARG  35   2.678  -7.528   5.941
  660    HB3  ARG  35           HB3      ARG  35   4.112  -6.762   5.280
  661    HG2  ARG  35           HG2      ARG  35   3.773  -4.877   6.843
  662    HG3  ARG  35           HG3      ARG  35   2.420  -5.753   7.541
  663    HD2  ARG  35           HD2      ARG  35   5.260  -6.639   7.467
  664    HD3  ARG  35           HD3      ARG  35   4.379  -6.101   8.883
  665    HE   ARG  35           HE       ARG  35   2.944  -8.222   7.874
  666   HH11  ARG  35          HH11      ARG  35   6.202  -7.723   9.046
  667   HH12  ARG  35          HH12      ARG  35   6.380  -9.350   9.623
  668   HH21  ARG  35          HH21      ARG  35   3.174 -10.363   8.611
  669   HH22  ARG  35          HH22      ARG  35   4.653 -10.858   9.368
  670    H    LYS  36           H        LYS  36   1.309  -3.655   5.594
  671    HA   LYS  36           HA       LYS  36  -0.757  -4.663   7.212
  672    HB2  LYS  36           HB2      LYS  36  -0.312  -1.927   6.130
  673    HB3  LYS  36           HB3      LYS  36  -1.584  -2.315   7.258
  674    HG2  LYS  36           HG2      LYS  36   0.354  -3.135   8.734
  675    HG3  LYS  36           HG3      LYS  36   1.358  -2.226   7.685
  676    HD2  LYS  36           HD2      LYS  36   0.287  -0.282   8.275
  677    HD3  LYS  36           HD3      LYS  36  -1.041  -1.097   9.057
  678    HE2  LYS  36           HE2      LYS  36   0.551  -1.941  10.742
  679    HE3  LYS  36           HE3      LYS  36   1.834  -1.012   9.973
  680    HZ1  LYS  36           HZ1      LYS  36   0.919   0.125  11.900
  681    HZ2  LYS  36           HZ2      LYS  36  -0.619   0.123  11.202
  682    HZ3  LYS  36           HZ3      LYS  36   0.632   1.014  10.491
  683    H    VAL  37           H        VAL  37  -0.505  -3.347   4.043
  684    HA   VAL  37           HA       VAL  37  -3.163  -3.042   3.403
  685    HB   VAL  37           HB       VAL  37  -2.470  -3.166   1.065
  686   HG11  VAL  37          HG11      VAL  37  -0.309  -1.662   2.501
  687   HG12  VAL  37          HG12      VAL  37  -1.994  -1.131   2.575
  688   HG13  VAL  37          HG13      VAL  37  -1.166  -1.218   1.021
  689   HG21  VAL  37          HG21      VAL  37  -0.037  -4.343   2.249
  690   HG22  VAL  37          HG22      VAL  37   0.103  -3.364   0.789
  691   HG23  VAL  37          HG23      VAL  37  -0.935  -4.790   0.792
  692    H    ILE  38           H        ILE  38  -1.045  -5.758   2.910
  693    HA   ILE  38           HA       ILE  38  -2.738  -7.465   1.477
  694    HB   ILE  38           HB       ILE  38  -0.652  -8.509   3.371
  695   HG12  ILE  38          HG12      ILE  38  -0.135  -6.968   0.838
  696   HG13  ILE  38          HG13      ILE  38   0.522  -6.675   2.430
  697   HG21  ILE  38          HG21      ILE  38  -1.559  -9.319   0.626
  698   HG22  ILE  38          HG22      ILE  38  -1.877 -10.153   2.145
  699   HG23  ILE  38          HG23      ILE  38  -0.235 -10.080   1.505
  700   HD11  ILE  38          HD11      ILE  38   2.027  -7.734   0.648
  701   HD12  ILE  38          HD12      ILE  38   1.124  -9.213   0.983
  702   HD13  ILE  38          HD13      ILE  38   2.026  -8.420   2.274
  703    H    SER  39           H        SER  39  -2.267  -6.708   4.790
  704    HA   SER  39           HA       SER  39  -3.732  -8.967   5.695
  705    HB2  SER  39           HB2      SER  39  -1.830  -8.037   7.002
  706    HB3  SER  39           HB3      SER  39  -2.766  -6.570   7.269
  707    HG   SER  39           HG       SER  39  -3.823  -9.078   7.996
  708    H    THR  40           H        THR  40  -4.365  -5.783   4.716
  709    HA   THR  40           HA       THR  40  -6.810  -5.433   6.200
  710    HB   THR  40           HB       THR  40  -5.629  -3.821   3.928
  711    HG1  THR  40           HG1      THR  40  -4.401  -3.919   5.935
  712   HG21  THR  40          HG21      THR  40  -8.058  -3.472   4.176
  713   HG22  THR  40          HG22      THR  40  -7.128  -2.040   4.614
  714   HG23  THR  40          HG23      THR  40  -7.812  -3.067   5.876
  715    H    SER  41           H        SER  41  -6.101  -5.529   2.688
  716    HA   SER  41           HA       SER  41  -8.897  -6.072   2.177
  717    HB2  SER  41           HB2      SER  41  -8.043  -4.402   0.809
  718    HB3  SER  41           HB3      SER  41  -6.616  -5.343   0.456
  719    HG   SER  41           HG       SER  41  -7.641  -5.920  -1.266
  720    H    THR  42           H        THR  42  -5.832  -7.478   1.068
  721    HA   THR  42           HA       THR  42  -7.188  -9.680  -0.134
  722    HB   THR  42           HB       THR  42  -4.654 -10.450  -0.294
  723    HG1  THR  42           HG1      THR  42  -4.184  -7.689  -0.306
  724   HG21  THR  42          HG21      THR  42  -5.816  -8.125  -1.834
  725   HG22  THR  42          HG22      THR  42  -6.081  -9.832  -2.188
  726   HG23  THR  42          HG23      THR  42  -4.470  -9.136  -2.357
  727    H    SER  43           H        SER  43  -6.979  -9.223   2.964
  728    HA   SER  43           HA       SER  43  -6.459 -12.061   3.548
  729    HB2  SER  43           HB2      SER  43  -4.970 -10.474   4.759
  730    HB3  SER  43           HB3      SER  43  -6.393  -9.728   5.483
  731    HG   SER  43           HG       SER  43  -6.789 -12.114   6.114
  732    H    ASP  44           H        ASP  44  -8.802  -9.798   3.051
  733    HA   ASP  44           HA       ASP  44 -10.948 -11.455   3.801
  734    HB2  ASP  44           HB2      ASP  44 -10.410 -10.770   6.091
  735    HB3  ASP  44           HB3      ASP  44 -10.473  -9.077   5.617
  736    HA   PRO  45           HA       PRO  45 -11.923  -8.544   0.476
  737    HB2  PRO  45           HB2      PRO  45 -14.190 -10.332   0.067
  738    HB3  PRO  45           HB3      PRO  45 -12.920  -9.905  -1.036
  739    HG2  PRO  45           HG2      PRO  45 -13.193 -12.311   0.111
  740    HG3  PRO  45           HG3      PRO  45 -11.681 -11.603  -0.370
  741    HD2  PRO  45           HD2      PRO  45 -12.803 -11.914   2.319
  742    HD3  PRO  45           HD3      PRO  45 -11.111 -11.953   1.810
  743    H    ASP  46           H        ASP  46 -13.678  -7.175  -0.032
  744    HA   ASP  46           HA       ASP  46 -15.300  -6.538   2.322
  745    HB2  ASP  46           HB2      ASP  46 -13.895  -4.736   1.422
  746    HB3  ASP  46           HB3      ASP  46 -14.682  -4.893  -0.145
  747    H    TYR  47           H        TYR  47 -15.526  -7.298  -1.087
  748    HA   TYR  47           HA       TYR  47 -18.392  -7.762  -0.713
  749    HB2  TYR  47           HB2      TYR  47 -18.555  -7.129  -3.234
  750    HB3  TYR  47           HB3      TYR  47 -18.515  -5.855  -2.026
  751    HD1  TYR  47           HD1      TYR  47 -16.677  -7.484  -4.746
  752    HD2  TYR  47           HD2      TYR  47 -16.579  -4.399  -1.820
  753    HE1  TYR  47           HE1      TYR  47 -14.774  -6.450  -5.908
  754    HE2  TYR  47           HE2      TYR  47 -14.675  -3.357  -2.974
  755    HH   TYR  47           HH       TYR  47 -12.879  -3.993  -4.505
  756    H    ALA  48           H        ALA  48 -18.553  -9.889  -0.681
  757    HA   ALA  48           HA       ALA  48 -17.629 -11.404  -2.982
  758    HB1  ALA  48           HB1      ALA  48 -16.866 -12.200  -0.172
  759    HB2  ALA  48           HB2      ALA  48 -15.763 -11.554  -1.387
  760    HB3  ALA  48           HB3      ALA  48 -16.539 -13.118  -1.642
  Start of MODEL   14
    1    H1   SER   0           H1       SER   0   2.115  14.002   5.147
    2    H2   SER   0           H2       SER   0   3.141  15.147   5.863
    3    H3   SER   0           H3       SER   0   2.217  15.570   4.514
    4    HA   SER   0           HA       SER   0   1.113  14.795   7.138
    5    HB2  SER   0           HB2      SER   0   0.468  17.289   7.146
    6    HB3  SER   0           HB3      SER   0   2.152  16.888   7.483
    7    HG   SER   0           HG       SER   0   1.006  18.003   5.157
    8    H    MET   1           H        MET   1   0.076  13.378   5.220
    9    HA   MET   1           HA       MET   1  -2.065  14.863   3.896
   10    HB2  MET   1           HB2      MET   1  -0.900  13.266   2.506
   11    HB3  MET   1           HB3      MET   1  -1.183  11.981   3.674
   12    HG2  MET   1           HG2      MET   1  -3.655  12.349   3.283
   13    HG3  MET   1           HG3      MET   1  -3.192  13.359   1.916
   14    HE1  MET   1           HE1      MET   1  -1.446  10.833  -0.466
   15    HE2  MET   1           HE2      MET   1  -0.708  11.935   0.696
   16    HE3  MET   1           HE3      MET   1  -2.072  12.471  -0.282
   17    H    ASP   2           H        ASP   2  -4.009  15.057   4.800
   18    HA   ASP   2           HA       ASP   2  -5.001  12.875   6.496
   19    HB2  ASP   2           HB2      ASP   2  -5.365  15.162   7.360
   20    HB3  ASP   2           HB3      ASP   2  -6.251  15.573   5.895
   21    H    GLU   3           H        GLU   3  -6.596  15.003   4.179
   22    HA   GLU   3           HA       GLU   3  -8.171  14.591   2.589
   23    HB2  GLU   3           HB2      GLU   3  -5.865  12.857   1.708
   24    HB3  GLU   3           HB3      GLU   3  -7.209  13.324   0.671
   25    HG2  GLU   3           HG2      GLU   3  -6.628  15.706   1.102
   26    HG3  GLU   3           HG3      GLU   3  -5.198  15.149   1.966
   27    H    THR   4           H        THR   4  -9.208  13.351   4.541
   28    HA   THR   4           HA       THR   4  -9.572  10.554   4.254
   29    HB   THR   4           HB       THR   4 -11.725  11.235   5.674
   30    HG1  THR   4           HG1      THR   4  -9.985  13.381   6.321
   31   HG21  THR   4          HG21      THR   4  -9.841   9.920   6.509
   32   HG22  THR   4          HG22      THR   4 -10.320  11.140   7.690
   33   HG23  THR   4          HG23      THR   4  -8.884  11.390   6.697
   34    H    VAL   5           H        VAL   5 -11.651  13.329   3.481
   35    HA   VAL   5           HA       VAL   5 -13.407  13.645   2.117
   36    HB   VAL   5           HB       VAL   5 -13.145  13.091  -0.185
   37   HG11  VAL   5          HG11      VAL   5 -10.496  13.667   1.126
   38   HG12  VAL   5          HG12      VAL   5 -11.726  14.844   0.663
   39   HG13  VAL   5          HG13      VAL   5 -10.868  13.931  -0.577
   40   HG21  VAL   5          HG21      VAL   5 -11.385  11.603  -0.996
   41   HG22  VAL   5          HG22      VAL   5 -12.575  10.746  -0.016
   42   HG23  VAL   5          HG23      VAL   5 -11.004  11.160   0.667
   43    H    LYS   6           H        LYS   6 -14.993  12.490   0.425
   44    HA   LYS   6           HA       LYS   6 -16.013  10.083   1.769
   45    HB2  LYS   6           HB2      LYS   6 -17.578  12.537   1.069
   46    HB3  LYS   6           HB3      LYS   6 -18.300  11.033   1.590
   47    HG2  LYS   6           HG2      LYS   6 -17.170  11.233   3.718
   48    HG3  LYS   6           HG3      LYS   6 -16.405  12.731   3.194
   49    HD2  LYS   6           HD2      LYS   6 -18.608  13.767   2.959
   50    HD3  LYS   6           HD3      LYS   6 -19.370  12.266   3.471
   51    HE2  LYS   6           HE2      LYS   6 -18.274  12.423   5.633
   52    HE3  LYS   6           HE3      LYS   6 -17.476  13.901   5.118
   53    HZ1  LYS   6           HZ1      LYS   6 -20.410  13.562   5.336
   54    HZ2  LYS   6           HZ2      LYS   6 -19.594  14.989   4.946
   55    HZ3  LYS   6           HZ3      LYS   6 -19.436  14.322   6.490
   56    H    LEU   7           H        LEU   7 -17.660   8.927   0.541
   57    HA   LEU   7           HA       LEU   7 -18.400   7.825  -1.287
   58    HB2  LEU   7           HB2      LEU   7 -17.706  10.333  -2.740
   59    HB3  LEU   7           HB3      LEU   7 -18.575   9.002  -3.448
   60    HG   LEU   7           HG       LEU   7 -19.524  10.698  -1.142
   61   HD11  LEU   7          HD11      LEU   7 -19.511  11.904  -3.265
   62   HD12  LEU   7          HD12      LEU   7 -21.155  11.559  -2.733
   63   HD13  LEU   7          HD13      LEU   7 -20.424  10.597  -4.017
   64   HD21  LEU   7          HD21      LEU   7 -20.338   8.424  -0.989
   65   HD22  LEU   7          HD22      LEU   7 -20.858   8.476  -2.671
   66   HD23  LEU   7          HD23      LEU   7 -21.645   9.504  -1.473
   67    H    ASN   8           H        ASN   8 -15.883   9.699  -2.887
   68    HA   ASN   8           HA       ASN   8 -14.427   7.251  -3.531
   69    HB2  ASN   8           HB2      ASN   8 -12.810   9.246  -4.406
   70    HB3  ASN   8           HB3      ASN   8 -14.077   8.577  -5.400
   71   HD21  ASN   8          HD21      ASN   8 -15.882   9.800  -5.790
   72   HD22  ASN   8          HD22      ASN   8 -15.934  11.486  -5.431
   73    H    HIS   9           H        HIS   9 -12.279   6.928  -2.820
   74    HA   HIS   9           HA       HIS   9 -11.193   9.014  -1.071
   75    HB2  HIS   9           HB2      HIS   9 -11.871   6.797   0.058
   76    HB3  HIS   9           HB3      HIS   9 -10.436   6.135  -0.688
   77    HD1  HIS   9           HD1      HIS   9 -10.697   6.236   2.356
   78    HD2  HIS   9           HD2      HIS   9  -8.925   9.246   0.105
   79    HE1  HIS   9           HE1      HIS   9  -9.175   7.458   3.939
   80    HE2  HIS   9           HE2      HIS   9  -8.265   9.388   2.599
   81    H    THR  10           H        THR  10  -9.209   9.568  -1.535
   82    HA   THR  10           HA       THR  10  -8.454   8.986  -4.245
   83    HB   THR  10           HB       THR  10  -7.084  10.815  -2.251
   84    HG1  THR  10           HG1      THR  10  -8.450  12.418  -3.112
   85   HG21  THR  10          HG21      THR  10  -5.736  10.343  -4.243
   86   HG22  THR  10          HG22      THR  10  -6.309  12.011  -4.250
   87   HG23  THR  10          HG23      THR  10  -7.087  10.807  -5.276
   88    H    CYS  11           H        CYS  11  -6.868   7.742  -4.949
   89    HA   CYS  11           HA       CYS  11  -5.404   6.060  -3.184
   90    HB2  CYS  11           HB2      CYS  11  -5.962   5.318  -5.469
   91    HB3  CYS  11           HB3      CYS  11  -4.968   6.605  -6.139
   92    H    VAL  12           H        VAL  12  -3.773   6.670  -2.000
   93    HA   VAL  12           HA       VAL  12  -2.284   9.011  -2.189
   94    HB   VAL  12           HB       VAL  12  -0.569   7.799  -0.825
   95   HG11  VAL  12          HG11      VAL  12  -2.041   7.365   1.103
   96   HG12  VAL  12          HG12      VAL  12  -3.437   7.487   0.030
   97   HG13  VAL  12          HG13      VAL  12  -2.403   8.892   0.297
   98   HG21  VAL  12          HG21      VAL  12  -2.435   5.470  -1.229
   99   HG22  VAL  12          HG22      VAL  12  -1.121   5.521  -0.056
  100   HG23  VAL  12          HG23      VAL  12  -0.765   5.590  -1.782
  101    H    ILE  13           H        ILE  13  -2.233   6.296  -4.159
  102    HA   ILE  13           HA       ILE  13   0.545   6.586  -4.966
  103    HB   ILE  13           HB       ILE  13  -1.374   4.562  -6.024
  104   HG12  ILE  13          HG12      ILE  13  -1.429   4.516  -3.529
  105   HG13  ILE  13          HG13      ILE  13  -0.831   3.036  -4.270
  106   HG21  ILE  13          HG21      ILE  13   0.631   3.240  -6.323
  107   HG22  ILE  13          HG22      ILE  13   1.594   4.544  -5.621
  108   HG23  ILE  13          HG23      ILE  13   0.747   4.795  -7.150
  109   HD11  ILE  13          HD11      ILE  13   0.918   5.203  -3.195
  110   HD12  ILE  13          HD12      ILE  13   1.396   3.596  -3.745
  111   HD13  ILE  13          HD13      ILE  13   0.415   3.779  -2.289
  112    H    CYS  14           H        CYS  14  -2.598   6.179  -6.529
  113    HA   CYS  14           HA       CYS  14  -1.582   7.081  -9.057
  114    HB2  CYS  14           HB2      CYS  14  -4.368   6.464  -8.193
  115    HB3  CYS  14           HB3      CYS  14  -3.895   6.749  -9.839
  116    H    ASP  15           H        ASP  15  -2.946   8.559  -6.326
  117    HA   ASP  15           HA       ASP  15  -3.874  10.548  -5.811
  118    HB2  ASP  15           HB2      ASP  15  -2.487  11.325  -8.351
  119    HB3  ASP  15           HB3      ASP  15  -3.355  12.470  -7.345
  120    H    GLN  16           H        GLN  16  -5.591   8.799  -6.830
  121    HA   GLN  16           HA       GLN  16  -7.393  10.376  -8.504
  122    HB2  GLN  16           HB2      GLN  16  -6.820   7.430  -8.793
  123    HB3  GLN  16           HB3      GLN  16  -8.061   8.305  -9.665
  124    HG2  GLN  16           HG2      GLN  16  -5.115   8.733  -9.868
  125    HG3  GLN  16           HG3      GLN  16  -6.138   7.962 -11.063
  126   HE21  GLN  16          HE21      GLN  16  -4.416  10.230 -11.379
  127   HE22  GLN  16          HE22      GLN  16  -5.417  11.535 -11.890
  128    H    GLU  17           H        GLU  17  -9.533  10.189  -8.050
  129    HA   GLU  17           HA       GLU  17 -10.261   9.387  -5.395
  130    HB2  GLU  17           HB2      GLU  17 -11.857  10.557  -7.673
  131    HB3  GLU  17           HB3      GLU  17 -12.478  10.303  -6.044
  132    HG2  GLU  17           HG2      GLU  17 -10.984  11.894  -5.137
  133    HG3  GLU  17           HG3      GLU  17 -10.069  11.967  -6.630
  134    H    LYS  18           H        LYS  18 -10.278   7.262  -5.174
  135    HA   LYS  18           HA       LYS  18 -11.930   5.666  -7.015
  136    HB2  LYS  18           HB2      LYS  18 -10.001   4.410  -5.187
  137    HB3  LYS  18           HB3      LYS  18 -10.534   3.875  -6.755
  138    HG2  LYS  18           HG2      LYS  18  -8.583   6.072  -6.161
  139    HG3  LYS  18           HG3      LYS  18  -8.237   4.508  -6.887
  140    HD2  LYS  18           HD2      LYS  18 -10.190   6.331  -8.187
  141    HD3  LYS  18           HD3      LYS  18  -8.483   6.631  -8.364
  142    HE2  LYS  18           HE2      LYS  18  -9.298   5.379 -10.236
  143    HE3  LYS  18           HE3      LYS  18  -8.227   4.404  -9.262
  144    HZ1  LYS  18           HZ1      LYS  18 -10.080   3.236  -8.338
  145    HZ2  LYS  18           HZ2      LYS  18 -10.226   3.209 -10.020
  146    HZ3  LYS  18           HZ3      LYS  18 -11.175   4.269  -9.110
  147    H    ASN  19           H        ASN  19 -13.508   4.338  -6.191
  148    HA   ASN  19           HA       ASN  19 -14.063   4.779  -3.349
  149    HB2  ASN  19           HB2      ASN  19 -16.336   4.269  -3.789
  150    HB3  ASN  19           HB3      ASN  19 -15.810   5.311  -5.099
  151   HD21  ASN  19          HD21      ASN  19 -18.006   3.351  -4.928
  152   HD22  ASN  19          HD22      ASN  19 -17.745   2.264  -6.282
  153    H    ARG  20           H        ARG  20 -12.450   2.634  -5.154
  154    HA   ARG  20           HA       ARG  20 -13.108   0.401  -3.366
  155    HB2  ARG  20           HB2      ARG  20 -12.678   0.339  -6.330
  156    HB3  ARG  20           HB3      ARG  20 -12.459  -1.097  -5.346
  157    HG2  ARG  20           HG2      ARG  20 -14.765  -0.859  -4.558
  158    HG3  ARG  20           HG3      ARG  20 -14.980   0.498  -5.651
  159    HD2  ARG  20           HD2      ARG  20 -14.145  -1.139  -7.407
  160    HD3  ARG  20           HD3      ARG  20 -14.509  -2.389  -6.242
  161    HE   ARG  20           HE       ARG  20 -16.789  -0.899  -6.368
  162   HH11  ARG  20          HH11      ARG  20 -14.844  -2.639  -8.696
  163   HH12  ARG  20          HH12      ARG  20 -16.179  -2.994  -9.741
  164   HH21  ARG  20          HH21      ARG  20 -18.557  -1.372  -7.740
  165   HH22  ARG  20          HH22      ARG  20 -18.294  -2.278  -9.196
  166    H    GLY  21           H        GLY  21 -11.475  -0.422  -2.313
  167    HA2  GLY  21           HA2      GLY  21  -8.957  -1.090  -2.835
  168    HA3  GLY  21           HA3      GLY  21  -8.790   0.655  -2.699
  169    H    ILE  22           H        ILE  22  -7.423   0.141  -0.670
  170    HA   ILE  22           HA       ILE  22  -9.272  -0.331   1.561
  171    HB   ILE  22           HB       ILE  22  -7.750  -1.582   2.721
  172   HG12  ILE  22          HG12      ILE  22  -5.538  -0.426   1.056
  173   HG13  ILE  22          HG13      ILE  22  -6.042   0.211   2.588
  174   HG21  ILE  22          HG21      ILE  22  -7.164  -2.083  -0.185
  175   HG22  ILE  22          HG22      ILE  22  -8.263  -2.961   0.882
  176   HG23  ILE  22          HG23      ILE  22  -6.519  -3.099   1.106
  177   HD11  ILE  22          HD11      ILE  22  -4.711  -2.381   2.005
  178   HD12  ILE  22          HD12      ILE  22  -5.546  -2.077   3.527
  179   HD13  ILE  22          HD13      ILE  22  -4.169  -1.072   3.067
  180    H    HIS  23           H        HIS  23  -7.824   0.417   3.602
  181    HA   HIS  23           HA       HIS  23  -6.755   3.038   3.137
  182    HB2  HIS  23           HB2      HIS  23  -8.441   4.194   4.553
  183    HB3  HIS  23           HB3      HIS  23  -9.092   3.601   3.045
  184    HD1  HIS  23           HD1      HIS  23  -9.404   3.278   6.729
  185    HD2  HIS  23           HD2      HIS  23 -10.901   1.513   3.296
  186    HE1  HIS  23           HE1      HIS  23 -11.387   1.922   7.482
  187    HE2  HIS  23           HE2      HIS  23 -12.298   0.871   5.378
  188    H    LEU  24           H        LEU  24  -5.008   3.027   4.371
  189    HA   LEU  24           HA       LEU  24  -5.101   1.898   7.062
  190    HB2  LEU  24           HB2      LEU  24  -2.879   2.848   5.260
  191    HB3  LEU  24           HB3      LEU  24  -2.648   2.690   6.943
  192    HG   LEU  24           HG       LEU  24  -2.101   0.548   6.731
  193   HD11  LEU  24          HD11      LEU  24  -4.383  -0.149   6.745
  194   HD12  LEU  24          HD12      LEU  24  -3.357  -1.147   5.710
  195   HD13  LEU  24          HD13      LEU  24  -4.447   0.046   4.989
  196   HD21  LEU  24          HD21      LEU  24  -1.321  -0.186   4.688
  197   HD22  LEU  24          HD22      LEU  24  -1.120   1.567   4.718
  198   HD23  LEU  24          HD23      LEU  24  -2.446   0.847   3.803
  199    H    TYR  25           H        TYR  25  -4.992   3.322   8.810
  200    HA   TYR  25           HA       TYR  25  -4.853   5.250   9.994
  201    HB2  TYR  25           HB2      TYR  25  -3.289   6.378   7.698
  202    HB3  TYR  25           HB3      TYR  25  -3.249   6.931   9.353
  203    HD1  TYR  25           HD1      TYR  25  -0.758   6.767   9.409
  204    HD2  TYR  25           HD2      TYR  25  -3.170   3.357   8.584
  205    HE1  TYR  25           HE1      TYR  25   1.189   5.299   9.782
  206    HE2  TYR  25           HE2      TYR  25  -1.278   1.895   8.936
  207    HH   TYR  25           HH       TYR  25   1.544   2.928  10.487
  208    H    THR  26           H        THR  26  -4.526   7.532   7.535
  209    HA   THR  26           HA       THR  26  -7.412   8.098   7.591
  210    HB   THR  26           HB       THR  26  -6.949  10.381   7.386
  211    HG1  THR  26           HG1      THR  26  -5.537  10.763   5.821
  212   HG21  THR  26          HG21      THR  26  -4.602   9.235   8.899
  213   HG22  THR  26          HG22      THR  26  -6.205   9.564   9.563
  214   HG23  THR  26          HG23      THR  26  -5.184  10.897   9.022
  215    H    LYS  27           H        LYS  27  -5.207   6.641   5.597
  216    HA   LYS  27           HA       LYS  27  -6.043   8.145   3.202
  217    HB2  LYS  27           HB2      LYS  27  -3.787   7.045   2.347
  218    HB3  LYS  27           HB3      LYS  27  -3.835   8.583   3.183
  219    HG2  LYS  27           HG2      LYS  27  -3.415   6.005   4.643
  220    HG3  LYS  27           HG3      LYS  27  -2.092   6.892   3.887
  221    HD2  LYS  27           HD2      LYS  27  -3.983   7.943   5.978
  222    HD3  LYS  27           HD3      LYS  27  -2.300   7.521   6.240
  223    HE2  LYS  27           HE2      LYS  27  -2.285   9.242   4.064
  224    HE3  LYS  27           HE3      LYS  27  -3.474   9.928   5.169
  225    HZ1  LYS  27           HZ1      LYS  27  -0.844   9.096   6.201
  226    HZ2  LYS  27           HZ2      LYS  27  -1.927  10.239   6.821
  227    HZ3  LYS  27           HZ3      LYS  27  -1.018  10.597   5.446
  228    H    PHE  28           H        PHE  28  -5.154   6.709   1.210
  229    HA   PHE  28           HA       PHE  28  -6.610   4.169   1.320
  230    HB2  PHE  28           HB2      PHE  28  -8.213   5.901   0.822
  231    HB3  PHE  28           HB3      PHE  28  -7.162   6.579  -0.401
  232    HD1  PHE  28           HD1      PHE  28  -9.404   3.714   0.326
  233    HD2  PHE  28           HD2      PHE  28  -7.054   5.756  -2.560
  234    HE1  PHE  28           HE1      PHE  28 -10.456   2.390  -1.477
  235    HE2  PHE  28           HE2      PHE  28  -8.081   4.448  -4.352
  236    HZ   PHE  28           HZ       PHE  28  -9.780   2.759  -3.831
  237    H    ILE  29           H        ILE  29  -5.350   2.679   0.352
  238    HA   ILE  29           HA       ILE  29  -3.883   3.478  -2.068
  239    HB   ILE  29           HB       ILE  29  -3.816   0.830  -0.594
  240   HG12  ILE  29          HG12      ILE  29  -1.286   1.654  -0.453
  241   HG13  ILE  29          HG13      ILE  29  -2.056   3.237  -0.537
  242   HG21  ILE  29          HG21      ILE  29  -2.195   1.759  -2.955
  243   HG22  ILE  29          HG22      ILE  29  -3.560   0.638  -3.029
  244   HG23  ILE  29          HG23      ILE  29  -2.087   0.189  -2.157
  245   HD11  ILE  29          HD11      ILE  29  -1.636   2.445   1.760
  246   HD12  ILE  29          HD12      ILE  29  -2.755   1.116   1.472
  247   HD13  ILE  29          HD13      ILE  29  -3.335   2.781   1.433
  248    H    CYS  30           H        CYS  30  -4.894   3.120  -3.973
  249    HA   CYS  30           HA       CYS  30  -7.467   1.972  -4.026
  250    HB2  CYS  30           HB2      CYS  30  -7.522   2.379  -6.318
  251    HB3  CYS  30           HB3      CYS  30  -6.411   3.597  -5.735
  252    H    LEU  31           H        LEU  31  -8.149   0.135  -5.028
  253    HA   LEU  31           HA       LEU  31  -7.128  -2.115  -3.898
  254    HB2  LEU  31           HB2      LEU  31  -8.929  -3.180  -4.873
  255    HB3  LEU  31           HB3      LEU  31  -9.442  -1.527  -4.828
  256    HG   LEU  31           HG       LEU  31  -8.481  -1.490  -7.287
  257   HD11  LEU  31          HD11      LEU  31  -8.892  -3.587  -8.456
  258   HD12  LEU  31          HD12      LEU  31  -9.269  -4.377  -6.927
  259   HD13  LEU  31          HD13      LEU  31  -7.636  -3.787  -7.233
  260   HD21  LEU  31          HD21      LEU  31 -11.137  -2.695  -6.524
  261   HD22  LEU  31          HD22      LEU  31 -10.733  -2.009  -8.097
  262   HD23  LEU  31          HD23      LEU  31 -10.770  -0.976  -6.669
  263    H    ASP  32           H        ASP  32  -6.077  -0.595  -6.708
  264    HA   ASP  32           HA       ASP  32  -5.079  -2.947  -8.074
  265    HB2  ASP  32           HB2      ASP  32  -5.984  -0.980  -9.276
  266    HB3  ASP  32           HB3      ASP  32  -4.647  -0.061  -8.658
  267    H    CYS  33           H        CYS  33  -3.871  -0.041  -6.586
  268    HA   CYS  33           HA       CYS  33  -1.123  -0.757  -6.626
  269    HB2  CYS  33           HB2      CYS  33  -2.602   1.253  -4.940
  270    HB3  CYS  33           HB3      CYS  33  -0.877   1.041  -4.939
  271    H    GLU  34           H        GLU  34  -3.783  -1.214  -4.499
  272    HA   GLU  34           HA       GLU  34  -2.390  -2.018  -2.252
  273    HB2  GLU  34           HB2      GLU  34  -4.819  -1.434  -2.390
  274    HB3  GLU  34           HB3      GLU  34  -5.103  -2.986  -3.122
  275    HG2  GLU  34           HG2      GLU  34  -3.807  -2.786  -0.482
  276    HG3  GLU  34           HG3      GLU  34  -5.541  -2.717  -0.647
  277    H    ARG  35           H        ARG  35  -3.529  -3.854  -5.043
  278    HA   ARG  35           HA       ARG  35  -2.277  -6.231  -4.046
  279    HB2  ARG  35           HB2      ARG  35  -2.869  -7.349  -6.077
  280    HB3  ARG  35           HB3      ARG  35  -4.240  -6.394  -5.546
  281    HG2  ARG  35           HG2      ARG  35  -3.711  -4.698  -7.211
  282    HG3  ARG  35           HG3      ARG  35  -2.328  -5.646  -7.732
  283    HD2  ARG  35           HD2      ARG  35  -5.196  -6.438  -7.881
  284    HD3  ARG  35           HD3      ARG  35  -4.148  -6.047  -9.232
  285    HE   ARG  35           HE       ARG  35  -2.861  -8.103  -8.046
  286   HH11  ARG  35          HH11      ARG  35  -6.163  -7.690  -9.140
  287   HH12  ARG  35          HH12      ARG  35  -6.395  -9.375  -9.475
  288   HH21  ARG  35          HH21      ARG  35  -3.171 -10.320  -8.471
  289   HH22  ARG  35          HH22      ARG  35  -4.695 -10.873  -9.096
  290    H    LYS  36           H        LYS  36  -1.210  -3.571  -5.911
  291    HA   LYS  36           HA       LYS  36   0.825  -4.747  -7.445
  292    HB2  LYS  36           HB2      LYS  36   0.321  -1.998  -6.367
  293    HB3  LYS  36           HB3      LYS  36   1.802  -2.367  -7.206
  294    HG2  LYS  36           HG2      LYS  36   0.516  -2.988  -9.191
  295    HG3  LYS  36           HG3      LYS  36  -0.943  -2.581  -8.330
  296    HD2  LYS  36           HD2      LYS  36  -0.193  -0.314  -8.038
  297    HD3  LYS  36           HD3      LYS  36   1.244  -0.733  -8.910
  298    HE2  LYS  36           HE2      LYS  36  -1.555  -0.750  -9.962
  299    HE3  LYS  36           HE3      LYS  36  -0.285   0.386 -10.386
  300    HZ1  LYS  36           HZ1      LYS  36  -0.554  -1.254 -12.104
  301    HZ2  LYS  36           HZ2      LYS  36  -0.314  -2.513 -11.005
  302    HZ3  LYS  36           HZ3      LYS  36   0.954  -1.458 -11.372
  303    H    VAL  37           H        VAL  37   0.584  -3.410  -4.281
  304    HA   VAL  37           HA       VAL  37   3.250  -3.165  -3.666
  305    HB   VAL  37           HB       VAL  37   2.528  -3.148  -1.322
  306   HG11  VAL  37          HG11      VAL  37   2.115  -1.246  -3.143
  307   HG12  VAL  37          HG12      VAL  37   1.559  -1.068  -1.476
  308   HG13  VAL  37          HG13      VAL  37   0.429  -1.584  -2.732
  309   HG21  VAL  37          HG21      VAL  37  -0.033  -3.204  -1.029
  310   HG22  VAL  37          HG22      VAL  37   0.886  -4.708  -1.054
  311   HG23  VAL  37          HG23      VAL  37   0.006  -4.192  -2.496
  312    H    ILE  38           H        ILE  38   1.046  -5.777  -3.010
  313    HA   ILE  38           HA       ILE  38   2.650  -7.491  -1.527
  314    HB   ILE  38           HB       ILE  38   0.684  -8.545  -3.531
  315   HG12  ILE  38          HG12      ILE  38   0.034  -6.905  -1.101
  316   HG13  ILE  38          HG13      ILE  38  -0.526  -6.677  -2.742
  317   HG21  ILE  38          HG21      ILE  38   0.105 -10.044  -1.625
  318   HG22  ILE  38          HG22      ILE  38   1.414  -9.293  -0.714
  319   HG23  ILE  38          HG23      ILE  38   1.769 -10.184  -2.190
  320   HD11  ILE  38          HD11      ILE  38  -1.255  -9.168  -1.287
  321   HD12  ILE  38          HD12      ILE  38  -2.105  -8.332  -2.587
  322   HD13  ILE  38          HD13      ILE  38  -2.117  -7.669  -0.950
  323    H    SER  39           H        SER  39   2.256  -6.869  -4.885
  324    HA   SER  39           HA       SER  39   3.664  -9.158  -5.689
  325    HB2  SER  39           HB2      SER  39   2.691  -6.773  -7.250
  326    HB3  SER  39           HB3      SER  39   3.263  -8.272  -7.941
  327    HG   SER  39           HG       SER  39   1.399  -8.859  -6.151
  328    H    THR  40           H        THR  40   4.327  -5.777  -5.278
  329    HA   THR  40           HA       THR  40   6.822  -5.785  -6.718
  330    HB   THR  40           HB       THR  40   5.590  -3.692  -4.917
  331    HG1  THR  40           HG1      THR  40   4.365  -4.294  -6.832
  332   HG21  THR  40          HG21      THR  40   7.750  -3.382  -7.004
  333   HG22  THR  40          HG22      THR  40   8.015  -3.383  -5.261
  334   HG23  THR  40          HG23      THR  40   7.058  -2.104  -6.003
  335    H    SER  41           H        SER  41   5.767  -6.044  -3.407
  336    HA   SER  41           HA       SER  41   8.183  -5.335  -2.142
  337    HB2  SER  41           HB2      SER  41   5.970  -5.230  -1.095
  338    HB3  SER  41           HB3      SER  41   5.953  -6.976  -1.101
  339    HG   SER  41           HG       SER  41   6.638  -5.956   0.903
  340    H    THR  42           H        THR  42   7.448  -8.111  -3.873
  341    HA   THR  42           HA       THR  42   8.386 -10.085  -2.072
  342    HB   THR  42           HB       THR  42   8.415 -11.540  -4.109
  343    HG1  THR  42           HG1      THR  42   7.527 -10.487  -6.035
  344   HG21  THR  42          HG21      THR  42   5.957  -9.818  -3.751
  345   HG22  THR  42          HG22      THR  42   6.358 -11.260  -2.815
  346   HG23  THR  42          HG23      THR  42   5.996 -11.397  -4.535
  347    H    SER  43           H        SER  43   9.864  -8.557  -4.937
  348    HA   SER  43           HA       SER  43  12.032  -8.336  -5.613
  349    HB2  SER  43           HB2      SER  43  12.477  -8.085  -2.630
  350    HB3  SER  43           HB3      SER  43  13.510  -7.433  -3.900
  351    HG   SER  43           HG       SER  43  10.790  -6.726  -3.480
  352    H    ASP  44           H        ASP  44  14.476  -9.004  -4.550
  353    HA   ASP  44           HA       ASP  44  14.381 -11.744  -3.607
  354    HB2  ASP  44           HB2      ASP  44  15.440 -10.983  -6.275
  355    HB3  ASP  44           HB3      ASP  44  16.388 -12.135  -5.341
  356    HA   PRO  45           HA       PRO  45  18.480  -9.855  -2.338
  357    HB2  PRO  45           HB2      PRO  45  19.716  -7.942  -3.715
  358    HB3  PRO  45           HB3      PRO  45  19.680  -9.592  -4.316
  359    HG2  PRO  45           HG2      PRO  45  18.140  -7.213  -5.162
  360    HG3  PRO  45           HG3      PRO  45  18.789  -8.545  -6.105
  361    HD2  PRO  45           HD2      PRO  45  16.134  -8.273  -5.188
  362    HD3  PRO  45           HD3      PRO  45  16.857  -9.723  -5.907
  363    H    ASP  46           H        ASP  46  19.330  -8.030  -1.114
  364    HA   ASP  46           HA       ASP  46  18.245  -5.449  -1.108
  365    HB2  ASP  46           HB2      ASP  46  16.206  -6.572  -0.226
  366    HB3  ASP  46           HB3      ASP  46  17.154  -7.180   1.129
  367    H    TYR  47           H        TYR  47  19.192  -7.854   1.325
  368    HA   TYR  47           HA       TYR  47  21.059  -5.965   2.491
  369    HB2  TYR  47           HB2      TYR  47  20.324  -8.764   3.299
  370    HB3  TYR  47           HB3      TYR  47  21.388  -7.706   4.209
  371    HD1  TYR  47           HD1      TYR  47  20.439  -5.596   5.200
  372    HD2  TYR  47           HD2      TYR  47  17.974  -8.633   3.526
  373    HE1  TYR  47           HE1      TYR  47  18.502  -4.676   6.401
  374    HE2  TYR  47           HE2      TYR  47  16.029  -7.719   4.720
  375    HH   TYR  47           HH       TYR  47  16.008  -4.673   6.136
  376    H    ALA  48           H        ALA  48  22.842  -5.755   1.273
  377    HA   ALA  48           HA       ALA  48  24.126  -8.161   0.211
  378    HB1  ALA  48           HB1      ALA  48  23.762  -6.325  -1.360
  379    HB2  ALA  48           HB2      ALA  48  25.483  -6.626  -1.121
  380    HB3  ALA  48           HB3      ALA  48  24.711  -5.250  -0.334
  381    H1   SER   0           H1       SER   0  -1.982  14.008  -5.416
  382    H2   SER   0           H2       SER   0  -2.987  15.169  -6.137
  383    H3   SER   0           H3       SER   0  -2.053  15.583  -4.793
  384    HA   SER   0           HA       SER   0  -0.970  14.777  -7.418
  385    HB2  SER   0           HB2      SER   0  -0.276  17.257  -7.433
  386    HB3  SER   0           HB3      SER   0  -1.970  16.893  -7.761
  387    HG   SER   0           HG       SER   0  -0.791  17.991  -5.454
  388    H    MET   1           H        MET   1   0.047  13.347  -5.491
  389    HA   MET   1           HA       MET   1   2.220  14.801  -4.185
  390    HB2  MET   1           HB2      MET   1   1.034  13.230  -2.787
  391    HB3  MET   1           HB3      MET   1   1.292  11.934  -3.949
  392    HG2  MET   1           HG2      MET   1   3.772  12.265  -3.565
  393    HG3  MET   1           HG3      MET   1   3.327  13.286  -2.201
  394    HE1  MET   1           HE1      MET   1   1.543  10.794   0.189
  395    HE2  MET   1           HE2      MET   1   0.822  11.903  -0.977
  396    HE3  MET   1           HE3      MET   1   2.196  12.420  -0.001
  397    H    ASP   2           H        ASP   2   4.166  14.957  -5.090
  398    HA   ASP   2           HA       ASP   2   5.119  12.754  -6.780
  399    HB2  ASP   2           HB2      ASP   2   5.520  15.033  -7.650
  400    HB3  ASP   2           HB3      ASP   2   6.416  15.431  -6.189
  401    H    GLU   3           H        GLU   3   6.758  14.865  -4.478
  402    HA   GLU   3           HA       GLU   3   8.326  14.433  -2.888
  403    HB2  GLU   3           HB2      GLU   3   5.993  12.742  -1.995
  404    HB3  GLU   3           HB3      GLU   3   7.348  13.186  -0.962
  405    HG2  GLU   3           HG2      GLU   3   6.809  15.577  -1.400
  406    HG3  GLU   3           HG3      GLU   3   5.368  15.043  -2.259
  407    H    THR   4           H        THR   4   9.337  13.166  -4.839
  408    HA   THR   4           HA       THR   4   9.654  10.366  -4.542
  409    HB   THR   4           HB       THR   4  11.816  11.006  -5.972
  410    HG1  THR   4           HG1      THR   4  10.102  13.180  -6.612
  411   HG21  THR   4          HG21      THR   4   9.911   9.717  -6.797
  412   HG22  THR   4          HG22      THR   4  10.405  10.924  -7.985
  413   HG23  THR   4          HG23      THR   4   8.977  11.202  -6.989
  414    H    VAL   5           H        VAL   5  11.789  13.100  -3.787
  415    HA   VAL   5           HA       VAL   5  13.544  13.397  -2.423
  416    HB   VAL   5           HB       VAL   5  13.281  12.856  -0.119
  417   HG11  VAL   5          HG11      VAL   5  10.640  13.475  -1.426
  418   HG12  VAL   5          HG12      VAL   5  11.891  14.632  -0.969
  419   HG13  VAL   5          HG13      VAL   5  11.018  13.737   0.275
  420   HG21  VAL   5          HG21      VAL   5  11.495  11.403   0.702
  421   HG22  VAL   5          HG22      VAL   5  12.668  10.523  -0.278
  422   HG23  VAL   5          HG23      VAL   5  11.104  10.960  -0.960
  423    H    LYS   6           H        LYS   6  15.115  12.222  -0.732
  424    HA   LYS   6           HA       LYS   6  16.091   9.794  -2.069
  425    HB2  LYS   6           HB2      LYS   6  17.698  12.223  -1.377
  426    HB3  LYS   6           HB3      LYS   6  18.396  10.707  -1.896
  427    HG2  LYS   6           HG2      LYS   6  17.264  10.920  -4.022
  428    HG3  LYS   6           HG3      LYS   6  16.524  12.430  -3.501
  429    HD2  LYS   6           HD2      LYS   6  18.743  13.432  -3.273
  430    HD3  LYS   6           HD3      LYS   6  19.480  11.917  -3.780
  431    HE2  LYS   6           HE2      LYS   6  18.382  12.082  -5.940
  432    HE3  LYS   6           HE3      LYS   6  17.611  13.579  -5.432
  433    HZ1  LYS   6           HZ1      LYS   6  20.541  13.179  -5.657
  434    HZ2  LYS   6           HZ2      LYS   6  19.757  14.625  -5.269
  435    HZ3  LYS   6           HZ3      LYS   6  19.579  13.956  -6.810
  436    H    LEU   7           H        LEU   7  17.728   8.615  -0.837
  437    HA   LEU   7           HA       LEU   7  18.446   7.508   0.995
  438    HB2  LEU   7           HB2      LEU   7  17.797  10.033   2.439
  439    HB3  LEU   7           HB3      LEU   7  18.643   8.690   3.152
  440    HG   LEU   7           HG       LEU   7  19.619  10.361   0.836
  441   HD11  LEU   7          HD11      LEU   7  19.630  11.578   2.956
  442   HD12  LEU   7          HD12      LEU   7  21.268  11.202   2.423
  443   HD13  LEU   7          HD13      LEU   7  20.522  10.258   3.712
  444   HD21  LEU   7          HD21      LEU   7  20.393   8.075   0.690
  445   HD22  LEU   7          HD22      LEU   7  20.917   8.122   2.370
  446   HD23  LEU   7          HD23      LEU   7  21.718   9.132   1.168
  447    H    ASN   8           H        ASN   8  15.966   9.429   2.595
  448    HA   ASN   8           HA       ASN   8  14.472   7.008   3.247
  449    HB2  ASN   8           HB2      ASN   8  12.890   9.033   4.117
  450    HB3  ASN   8           HB3      ASN   8  14.143   8.345   5.111
  451   HD21  ASN   8          HD21      ASN   8  15.963   9.532   5.507
  452   HD22  ASN   8          HD22      ASN   8  16.058  11.210   5.128
  453    H    HIS   9           H        HIS   9  12.315   6.720   2.546
  454    HA   HIS   9           HA       HIS   9  11.260   8.815   0.786
  455    HB2  HIS   9           HB2      HIS   9  11.901   6.584  -0.335
  456    HB3  HIS   9           HB3      HIS   9  10.456   5.948   0.414
  457    HD1  HIS   9           HD1      HIS   9  10.720   6.040  -2.632
  458    HD2  HIS   9           HD2      HIS   9   8.996   9.082  -0.387
  459    HE1  HIS   9           HE1      HIS   9   9.207   7.276  -4.214
  460    HE2  HIS   9           HE2      HIS   9   8.323   9.222  -2.876
  461    H    THR  10           H        THR  10   9.288   9.408   1.251
  462    HA   THR  10           HA       THR  10   8.528   8.849   3.965
  463    HB   THR  10           HB       THR  10   7.182  10.690   1.968
  464    HG1  THR  10           HG1      THR  10   8.578  12.280   2.829
  465   HG21  THR  10          HG21      THR  10   5.833  10.252   3.963
  466   HG22  THR  10          HG22      THR  10   6.435  11.910   3.964
  467   HG23  THR  10          HG23      THR  10   7.195  10.696   4.992
  468    H    CYS  11           H        CYS  11   6.923   7.631   4.679
  469    HA   CYS  11           HA       CYS  11   5.426   5.968   2.922
  470    HB2  CYS  11           HB2      CYS  11   5.975   5.226   5.210
  471    HB3  CYS  11           HB3      CYS  11   5.008   6.533   5.877
  472    H    VAL  12           H        VAL  12   3.803   6.599   1.738
  473    HA   VAL  12           HA       VAL  12   2.354   8.966   1.919
  474    HB   VAL  12           HB       VAL  12   0.618   7.778   0.565
  475   HG11  VAL  12          HG11      VAL  12   2.078   7.319  -1.366
  476   HG12  VAL  12          HG12      VAL  12   3.478   7.419  -0.297
  477   HG13  VAL  12          HG13      VAL  12   2.468   8.840  -0.563
  478   HG21  VAL  12          HG21      VAL  12   2.445   5.421   0.973
  479   HG22  VAL  12          HG22      VAL  12   1.128   5.490  -0.197
  480   HG23  VAL  12          HG23      VAL  12   0.779   5.571   1.530
  481    H    ILE  13           H        ILE  13   2.260   6.259   3.901
  482    HA   ILE  13           HA       ILE  13  -0.512   6.599   4.709
  483    HB   ILE  13           HB       ILE  13   1.377   4.549   5.773
  484   HG12  ILE  13          HG12      ILE  13   1.427   4.491   3.279
  485   HG13  ILE  13          HG13      ILE  13   0.804   3.025   4.026
  486   HG21  ILE  13          HG21      ILE  13  -0.649   3.261   6.083
  487   HG22  ILE  13          HG22      ILE  13  -1.591   4.577   5.378
  488   HG23  ILE  13          HG23      ILE  13  -0.737   4.819   6.903
  489   HD11  ILE  13          HD11      ILE  13  -0.908   5.219   2.945
  490   HD12  ILE  13          HD12      ILE  13  -1.413   3.623   3.499
  491   HD13  ILE  13          HD13      ILE  13  -0.430   3.784   2.044
  492    H    CYS  14           H        CYS  14   2.627   6.147   6.271
  493    HA   CYS  14           HA       CYS  14   1.630   7.075   8.799
  494    HB2  CYS  14           HB2      CYS  14   4.401   6.403   7.933
  495    HB3  CYS  14           HB3      CYS  14   3.942   6.707   9.577
  496    H    ASP  15           H        ASP  15   3.018   8.516   6.059
  497    HA   ASP  15           HA       ASP  15   3.981  10.488   5.535
  498    HB2  ASP  15           HB2      ASP  15   2.612  11.301   8.073
  499    HB3  ASP  15           HB3      ASP  15   3.497  12.425   7.059
  500    H    GLN  16           H        GLN  16   5.665   8.715   6.558
  501    HA   GLN  16           HA       GLN  16   7.500  10.267   8.223
  502    HB2  GLN  16           HB2      GLN  16   6.876   7.331   8.522
  503    HB3  GLN  16           HB3      GLN  16   8.133   8.186   9.390
  504    HG2  GLN  16           HG2      GLN  16   5.194   8.664   9.594
  505    HG3  GLN  16           HG3      GLN  16   6.207   7.883  10.791
  506   HE21  GLN  16          HE21      GLN  16   4.522  10.178  11.108
  507   HE22  GLN  16          HE22      GLN  16   5.551  11.468  11.612
  508    H    GLU  17           H        GLU  17   9.629  10.047   7.759
  509    HA   GLU  17           HA       GLU  17  10.343   9.220   5.109
  510    HB2  GLU  17           HB2      GLU  17  11.964  10.370   7.381
  511    HB3  GLU  17           HB3      GLU  17  12.577  10.101   5.752
  512    HG2  GLU  17           HG2      GLU  17  11.109  11.717   4.841
  513    HG3  GLU  17           HG3      GLU  17  10.197  11.808   6.336
  514    H    LYS  18           H        LYS  18  10.322   7.096   4.895
  515    HA   LYS  18           HA       LYS  18  11.952   5.480   6.736
  516    HB2  LYS  18           HB2      LYS  18   9.999   4.248   4.920
  517    HB3  LYS  18           HB3      LYS  18  10.530   3.713   6.490
  518    HG2  LYS  18           HG2      LYS  18   8.611   5.938   5.892
  519    HG3  LYS  18           HG3      LYS  18   8.242   4.383   6.624
  520    HD2  LYS  18           HD2      LYS  18  10.229   6.177   7.914
  521    HD3  LYS  18           HD3      LYS  18   8.526   6.506   8.094
  522    HE2  LYS  18           HE2      LYS  18   9.327   5.246   9.967
  523    HE3  LYS  18           HE3      LYS  18   8.234   4.288   9.001
  524    HZ1  LYS  18           HZ1      LYS  18  10.066   3.088   8.071
  525    HZ2  LYS  18           HZ2      LYS  18  10.212   3.056   9.753
  526    HZ3  LYS  18           HZ3      LYS  18  11.182   4.095   8.842
  527    H    ASN  19           H        ASN  19  13.504   4.128   5.916
  528    HA   ASN  19           HA       ASN  19  14.065   4.542   3.072
  529    HB2  ASN  19           HB2      ASN  19  16.330   3.994   3.511
  530    HB3  ASN  19           HB3      ASN  19  15.823   5.051   4.817
  531   HD21  ASN  19          HD21      ASN  19  17.983   3.049   4.648
  532   HD22  ASN  19          HD22      ASN  19  17.706   1.966   6.006
  533    H    ARG  20           H        ARG  20  12.419   2.429   4.892
  534    HA   ARG  20           HA       ARG  20  13.035   0.182   3.106
  535    HB2  ARG  20           HB2      ARG  20  12.610   0.131   6.072
  536    HB3  ARG  20           HB3      ARG  20  12.366  -1.302   5.091
  537    HG2  ARG  20           HG2      ARG  20  14.674  -1.103   4.301
  538    HG3  ARG  20           HG3      ARG  20  14.912   0.255   5.386
  539    HD2  ARG  20           HD2      ARG  20  14.052  -1.362   7.150
  540    HD3  ARG  20           HD3      ARG  20  14.400  -2.621   5.990
  541    HE   ARG  20           HE       ARG  20  16.702  -1.162   6.116
  542   HH11  ARG  20          HH11      ARG  20  14.732  -2.877   8.443
  543   HH12  ARG  20          HH12      ARG  20  16.066  -3.257   9.485
  544   HH21  ARG  20          HH21      ARG  20  18.465  -1.663   7.479
  545   HH22  ARG  20          HH22      ARG  20  18.191  -2.560   8.937
  546    H    GLY  21           H        GLY  21  11.387  -0.624   2.060
  547    HA2  GLY  21           HA2      GLY  21   8.860  -1.242   2.586
  548    HA3  GLY  21           HA3      GLY  21   8.724   0.505   2.448
  549    H    ILE  22           H        ILE  22   7.341   0.006   0.424
  550    HA   ILE  22           HA       ILE  22   9.176  -0.504  -1.806
  551    HB   ILE  22           HB       ILE  22   7.632  -1.731  -2.964
  552   HG12  ILE  22          HG12      ILE  22   5.443  -0.534  -1.295
  553   HG13  ILE  22          HG13      ILE  22   5.954   0.091  -2.831
  554   HG21  ILE  22          HG21      ILE  22   7.042  -2.213  -0.054
  555   HG22  ILE  22          HG22      ILE  22   8.125  -3.113  -1.120
  556   HG23  ILE  22          HG23      ILE  22   6.379  -3.222  -1.341
  557   HD11  ILE  22          HD11      ILE  22   4.580  -2.476  -2.237
  558   HD12  ILE  22          HD12      ILE  22   5.418  -2.191  -3.761
  559   HD13  ILE  22          HD13      ILE  22   4.059  -1.161  -3.301
  560    H    HIS  23           H        HIS  23   7.728   0.260  -3.849
  561    HA   HIS  23           HA       HIS  23   6.715   2.901  -3.392
  562    HB2  HIS  23           HB2      HIS  23   8.417   4.023  -4.820
  563    HB3  HIS  23           HB3      HIS  23   9.062   3.427  -3.310
  564    HD1  HIS  23           HD1      HIS  23   9.367   3.086  -6.991
  565    HD2  HIS  23           HD2      HIS  23  10.831   1.301  -3.555
  566    HE1  HIS  23           HE1      HIS  23  11.313   1.684  -7.744
  567    HE2  HIS  23           HE2      HIS  23  12.224   0.645  -5.635
  568    H    LEU  24           H        LEU  24   4.965   2.917  -4.621
  569    HA   LEU  24           HA       LEU  24   5.033   1.777  -7.308
  570    HB2  LEU  24           HB2      LEU  24   2.829   2.768  -5.508
  571    HB3  LEU  24           HB3      LEU  24   2.595   2.610  -7.190
  572    HG   LEU  24           HG       LEU  24   2.011   0.479  -6.967
  573   HD11  LEU  24          HD11      LEU  24   4.284  -0.255  -6.984
  574   HD12  LEU  24          HD12      LEU  24   3.246  -1.234  -5.944
  575   HD13  LEU  24          HD13      LEU  24   4.355  -0.055  -5.230
  576   HD21  LEU  24          HD21      LEU  24   1.224  -0.235  -4.919
  577   HD22  LEU  24          HD22      LEU  24   1.054   1.521  -4.957
  578   HD23  LEU  24          HD23      LEU  24   2.369   0.782  -4.042
  579    H    TYR  25           H        TYR  25   4.950   3.196  -9.059
  580    HA   TYR  25           HA       TYR  25   4.832   5.121 -10.252
  581    HB2  TYR  25           HB2      TYR  25   3.292   6.281  -7.956
  582    HB3  TYR  25           HB3      TYR  25   3.259   6.830  -9.614
  583    HD1  TYR  25           HD1      TYR  25   0.774   6.706  -9.668
  584    HD2  TYR  25           HD2      TYR  25   3.124   3.258  -8.834
  585    HE1  TYR  25           HE1      TYR  25  -1.200   5.273 -10.034
  586    HE2  TYR  25           HE2      TYR  25   1.204   1.828  -9.177
  587    HH   TYR  25           HH       TYR  25  -1.601   2.912 -10.733
  588    H    THR  26           H        THR  26   4.551   7.417  -7.800
  589    HA   THR  26           HA       THR  26   7.446   7.936  -7.867
  590    HB   THR  26           HB       THR  26   7.023  10.228  -7.670
  591    HG1  THR  26           HG1      THR  26   5.627  10.637  -6.097
  592   HG21  THR  26          HG21      THR  26   4.651   9.119  -9.170
  593   HG22  THR  26          HG22      THR  26   6.258   9.416  -9.841
  594   HG23  THR  26          HG23      THR  26   5.262  10.769  -9.301
  595    H    LYS  27           H        LYS  27   5.218   6.525  -5.864
  596    HA   LYS  27           HA       LYS  27   6.090   8.019  -3.475
  597    HB2  LYS  27           HB2      LYS  27   3.817   6.961  -2.610
  598    HB3  LYS  27           HB3      LYS  27   3.888   8.495  -3.453
  599    HG2  LYS  27           HG2      LYS  27   3.424   5.919  -4.900
  600    HG3  LYS  27           HG3      LYS  27   2.119   6.830  -4.143
  601    HD2  LYS  27           HD2      LYS  27   4.019   7.843  -6.244
  602    HD3  LYS  27           HD3      LYS  27   2.328   7.448  -6.500
  603    HE2  LYS  27           HE2      LYS  27   2.348   9.176  -4.329
  604    HE3  LYS  27           HE3      LYS  27   3.545   9.839  -5.441
  605    HZ1  LYS  27           HZ1      LYS  27   0.899   9.042  -6.462
  606    HZ2  LYS  27           HZ2      LYS  27   1.997  10.164  -7.085
  607    HZ3  LYS  27           HZ3      LYS  27   1.096  10.542  -5.710
  608    H    PHE  28           H        PHE  28   5.185   6.612  -1.479
  609    HA   PHE  28           HA       PHE  28   6.593   4.041  -1.579
  610    HB2  PHE  28           HB2      PHE  28   8.225   5.748  -1.089
  611    HB3  PHE  28           HB3      PHE  28   7.187   6.448   0.132
  612    HD1  PHE  28           HD1      PHE  28   9.379   3.543  -0.589
  613    HD2  PHE  28           HD2      PHE  28   7.068   5.634   2.294
  614    HE1  PHE  28           HE1      PHE  28  10.412   2.208   1.215
  615    HE2  PHE  28           HE2      PHE  28   8.078   4.316   4.089
  616    HZ   PHE  28           HZ       PHE  28   9.749   2.597   3.570
  617    H    ILE  29           H        ILE  29   5.308   2.578  -0.605
  618    HA   ILE  29           HA       ILE  29   3.862   3.410   1.816
  619    HB   ILE  29           HB       ILE  29   3.745   0.757   0.352
  620   HG12  ILE  29          HG12      ILE  29   1.227   1.626   0.212
  621   HG13  ILE  29          HG13      ILE  29   2.026   3.194   0.289
  622   HG21  ILE  29          HG21      ILE  29   2.146   1.722   2.713
  623   HG22  ILE  29          HG22      ILE  29   3.491   0.578   2.789
  624   HG23  ILE  29          HG23      ILE  29   2.009   0.151   1.922
  625   HD11  ILE  29          HD11      ILE  29   1.588   2.400  -2.005
  626   HD12  ILE  29          HD12      ILE  29   2.684   1.054  -1.713
  627   HD13  ILE  29          HD13      ILE  29   3.292   2.709  -1.681
  628    H    CYS  30           H        CYS  30   4.868   3.040   3.718
  629    HA   CYS  30           HA       CYS  30   7.420   1.848   3.772
  630    HB2  CYS  30           HB2      CYS  30   7.487   2.272   6.057
  631    HB3  CYS  30           HB3      CYS  30   6.393   3.499   5.475
  632    H    LEU  31           H        LEU  31   8.074   0.009   4.779
  633    HA   LEU  31           HA       LEU  31   7.014  -2.230   3.660
  634    HB2  LEU  31           HB2      LEU  31   8.798  -3.325   4.637
  635    HB3  LEU  31           HB3      LEU  31   9.342  -1.678   4.585
  636    HG   LEU  31           HG       LEU  31   8.385  -1.618   7.047
  637   HD11  LEU  31          HD11      LEU  31   8.762  -3.721   8.219
  638   HD12  LEU  31          HD12      LEU  31   9.123  -4.522   6.691
  639   HD13  LEU  31          HD13      LEU  31   7.502  -3.902   6.998
  640   HD21  LEU  31          HD21      LEU  31  11.017  -2.869   6.281
  641   HD22  LEU  31          HD22      LEU  31  10.630  -2.172   7.854
  642   HD23  LEU  31          HD23      LEU  31  10.681  -1.144   6.422
  643    H    ASP  32           H        ASP  32   5.993  -0.683   6.464
  644    HA   ASP  32           HA       ASP  32   4.963  -3.014   7.842
  645    HB2  ASP  32           HB2      ASP  32   5.904  -1.061   9.036
  646    HB3  ASP  32           HB3      ASP  32   4.583  -0.120   8.418
  647    H    CYS  33           H        CYS  33   3.795  -0.095   6.351
  648    HA   CYS  33           HA       CYS  33   1.037  -0.765   6.394
  649    HB2  CYS  33           HB2      CYS  33   2.547   1.214   4.699
  650    HB3  CYS  33           HB3      CYS  33   0.817   1.031   4.702
  651    H    GLU  34           H        GLU  34   3.685  -1.274   4.262
  652    HA   GLU  34           HA       GLU  34   2.274  -2.062   2.022
  653    HB2  GLU  34           HB2      GLU  34   4.714  -1.520   2.152
  654    HB3  GLU  34           HB3      GLU  34   4.973  -3.074   2.891
  655    HG2  GLU  34           HG2      GLU  34   3.676  -2.858   0.250
  656    HG3  GLU  34           HG3      GLU  34   5.413  -2.826   0.414
  657    H    ARG  35           H        ARG  35   3.390  -3.908   4.817
  658    HA   ARG  35           HA       ARG  35   2.095  -6.266   3.833
  659    HB2  ARG  35           HB2      ARG  35   2.678  -7.387   5.865
  660    HB3  ARG  35           HB3      ARG  35   4.062  -6.453   5.327
  661    HG2  ARG  35           HG2      ARG  35   3.563  -4.746   6.988
  662    HG3  ARG  35           HG3      ARG  35   2.166  -5.669   7.514
  663    HD2  ARG  35           HD2      ARG  35   5.019  -6.508   7.662
  664    HD3  ARG  35           HD3      ARG  35   3.978  -6.095   9.012
  665    HE   ARG  35           HE       ARG  35   2.657  -8.130   7.841
  666   HH11  ARG  35          HH11      ARG  35   5.966  -7.772   8.917
  667   HH12  ARG  35          HH12      ARG  35   6.170  -9.458   9.261
  668   HH21  ARG  35          HH21      ARG  35   2.923 -10.348   8.274
  669   HH22  ARG  35          HH22      ARG  35   4.434 -10.931   8.895
  670    H    LYS  36           H        LYS  36   1.078  -3.584   5.691
  671    HA   LYS  36           HA       LYS  36  -0.974  -4.718   7.231
  672    HB2  LYS  36           HB2      LYS  36  -0.426  -1.981   6.142
  673    HB3  LYS  36           HB3      LYS  36  -1.912  -2.323   6.985
  674    HG2  LYS  36           HG2      LYS  36  -0.633  -2.959   8.968
  675    HG3  LYS  36           HG3      LYS  36   0.831  -2.580   8.104
  676    HD2  LYS  36           HD2      LYS  36   0.121  -0.300   7.806
  677    HD3  LYS  36           HD3      LYS  36  -1.322  -0.693   8.682
  678    HE2  LYS  36           HE2      LYS  36   1.478  -0.755   9.729
  679    HE3  LYS  36           HE3      LYS  36   0.227   0.404  10.154
  680    HZ1  LYS  36           HZ1      LYS  36   0.466  -1.236  11.877
  681    HZ2  LYS  36           HZ2      LYS  36   0.209  -2.495  10.777
  682    HZ3  LYS  36           HZ3      LYS  36  -1.045  -1.420  11.139
  683    H    VAL  37           H        VAL  37  -0.717  -3.396   4.061
  684    HA   VAL  37           HA       VAL  37  -3.380  -3.109   3.451
  685    HB   VAL  37           HB       VAL  37  -2.664  -3.111   1.106
  686   HG11  VAL  37          HG11      VAL  37  -2.214  -1.211   2.922
  687   HG12  VAL  37          HG12      VAL  37  -1.659  -1.048   1.252
  688   HG13  VAL  37          HG13      VAL  37  -0.534  -1.579   2.507
  689   HG21  VAL  37          HG21      VAL  37  -0.105  -3.212   0.807
  690   HG22  VAL  37          HG22      VAL  37  -1.050  -4.700   0.840
  691   HG23  VAL  37          HG23      VAL  37  -0.157  -4.194   2.278
  692    H    ILE  38           H        ILE  38  -1.222  -5.760   2.802
  693    HA   ILE  38           HA       ILE  38  -2.859  -7.452   1.326
  694    HB   ILE  38           HB       ILE  38  -0.905  -8.532   3.329
  695   HG12  ILE  38          HG12      ILE  38  -0.233  -6.912   0.891
  696   HG13  ILE  38          HG13      ILE  38   0.332  -6.683   2.529
  697   HG21  ILE  38          HG21      ILE  38  -0.355 -10.045   1.427
  698   HG22  ILE  38          HG22      ILE  38  -1.652  -9.274   0.516
  699   HG23  ILE  38          HG23      ILE  38  -2.021 -10.155   1.995
  700   HD11  ILE  38          HD11      ILE  38   1.021  -9.194   1.086
  701   HD12  ILE  38          HD12      ILE  38   1.883  -8.366   2.384
  702   HD13  ILE  38          HD13      ILE  38   1.908  -7.710   0.745
  703    H    SER  39           H        SER  39  -2.446  -6.824   4.683
  704    HA   SER  39           HA       SER  39  -3.893  -9.088   5.493
  705    HB2  SER  39           HB2      SER  39  -2.864  -6.720   7.043
  706    HB3  SER  39           HB3      SER  39  -3.476  -8.200   7.745
  707    HG   SER  39           HG       SER  39  -1.624  -8.826   5.940
  708    H    THR  40           H        THR  40  -4.499  -5.697   5.071
  709    HA   THR  40           HA       THR  40  -6.989  -5.658   6.519
  710    HB   THR  40           HB       THR  40  -5.725  -3.593   4.708
  711    HG1  THR  40           HG1      THR  40  -4.499  -4.203   6.617
  712   HG21  THR  40          HG21      THR  40  -7.869  -3.245   6.802
  713   HG22  THR  40          HG22      THR  40  -8.143  -3.246   5.059
  714   HG23  THR  40          HG23      THR  40  -7.160  -1.981   5.795
  715    H    SER  41           H        SER  41  -5.948  -5.947   3.206
  716    HA   SER  41           HA       SER  41  -8.354  -5.198   1.948
  717    HB2  SER  41           HB2      SER  41  -6.137  -5.135   0.900
  718    HB3  SER  41           HB3      SER  41  -6.160  -6.881   0.897
  719    HG   SER  41           HG       SER  41  -6.827  -5.867  -1.101
  720    H    THR  42           H        THR  42  -7.660  -7.981   3.683
  721    HA   THR  42           HA       THR  42  -8.636  -9.946   1.892
  722    HB   THR  42           HB       THR  42  -8.684 -11.398   3.928
  723    HG1  THR  42           HG1      THR  42  -7.763 -10.336   5.855
  724   HG21  THR  42          HG21      THR  42  -6.202  -9.708   3.571
  725   HG22  THR  42          HG22      THR  42  -6.623 -11.146   2.640
  726   HG23  THR  42          HG23      THR  42  -6.263 -11.284   4.360
  727    H    SER  43           H        SER  43 -10.083  -8.388   4.759
  728    HA   SER  43           HA       SER  43 -12.246  -8.130   5.433
  729    HB2  SER  43           HB2      SER  43 -12.685  -7.867   2.452
  730    HB3  SER  43           HB3      SER  43 -13.710  -7.201   3.722
  731    HG   SER  43           HG       SER  43 -10.984  -6.530   3.275
  732    H    ASP  44           H        ASP  44 -14.702  -8.755   4.378
  733    HA   ASP  44           HA       ASP  44 -14.654 -11.500   3.444
  734    HB2  ASP  44           HB2      ASP  44 -15.700 -10.707   6.111
  735    HB3  ASP  44           HB3      ASP  44 -16.661 -11.854   5.186
  736    HA   PRO  45           HA       PRO  45 -18.733  -9.551   2.185
  737    HB2  PRO  45           HB2      PRO  45 -19.907  -7.591   3.549
  738    HB3  PRO  45           HB3      PRO  45 -19.909  -9.211   4.167
  739    HG2  PRO  45           HG2      PRO  45 -18.366  -6.947   4.997
  740    HG3  PRO  45           HG3      PRO  45 -18.991  -8.249   5.969
  741    HD2  PRO  45           HD2      PRO  45 -16.350  -7.984   5.009
  742    HD3  PRO  45           HD3      PRO  45 -17.091  -9.417   5.732
  743    H    ASP  46           H        ASP  46 -19.540  -7.725   0.918
  744    HA   ASP  46           HA       ASP  46 -18.414  -5.154   0.932
  745    HB2  ASP  46           HB2      ASP  46 -16.399  -6.308   0.050
  746    HB3  ASP  46           HB3      ASP  46 -17.359  -6.909  -1.300
  747    H    TYR  47           H        TYR  47 -19.409  -7.543  -1.493
  748    HA   TYR  47           HA       TYR  47 -21.247  -5.628  -2.662
  749    HB2  TYR  47           HB2      TYR  47 -20.561  -8.443  -3.461
  750    HB3  TYR  47           HB3      TYR  47 -21.608  -7.370  -4.372
  751    HD1  TYR  47           HD1      TYR  47 -20.627  -5.283  -5.374
  752    HD2  TYR  47           HD2      TYR  47 -18.210  -8.353  -3.693
  753    HE1  TYR  47           HE1      TYR  47 -18.677  -4.399  -6.581
  754    HE2  TYR  47           HE2      TYR  47 -16.253  -7.478  -4.895
  755    HH   TYR  47           HH       TYR  47 -16.176  -4.440  -6.301
  756    H    ALA  48           H        ALA  48 -23.024  -5.386  -1.441
  757    HA   ALA  48           HA       ALA  48 -24.349  -7.766  -0.368
  758    HB1  ALA  48           HB1      ALA  48 -23.949  -5.931   1.197
  759    HB2  ALA  48           HB2      ALA  48 -25.676  -6.201   0.962
  760    HB3  ALA  48           HB3      ALA  48 -24.880  -4.843   0.167
  Start of MODEL   15
    1    H1   SER   0           H1       SER   0  -3.037  19.221   7.193
    2    H2   SER   0           H2       SER   0  -3.508  18.862   5.607
    3    H3   SER   0           H3       SER   0  -3.735  20.422   6.227
    4    HA   SER   0           HA       SER   0  -1.866  20.344   4.722
    5    HB2  SER   0           HB2      SER   0  -1.866  21.949   6.600
    6    HB3  SER   0           HB3      SER   0  -1.057  20.756   7.612
    7    HG   SER   0           HG       SER   0  -0.040  21.931   5.232
    8    H    MET   1           H        MET   1  -0.877  18.663   7.724
    9    HA   MET   1           HA       MET   1   1.216  17.274   6.310
   10    HB2  MET   1           HB2      MET   1   0.224  16.963   9.152
   11    HB3  MET   1           HB3      MET   1   1.680  16.228   8.499
   12    HG2  MET   1           HG2      MET   1   2.684  18.384   8.176
   13    HG3  MET   1           HG3      MET   1   1.194  19.192   8.662
   14    HE1  MET   1           HE1      MET   1   2.894  15.993  10.254
   15    HE2  MET   1           HE2      MET   1   3.879  16.742  11.510
   16    HE3  MET   1           HE3      MET   1   4.247  17.032   9.809
   17    H    ASP   2           H        ASP   2  -1.324  15.986   8.435
   18    HA   ASP   2           HA       ASP   2  -1.376  13.532   6.874
   19    HB2  ASP   2           HB2      ASP   2  -1.320  13.432   9.349
   20    HB3  ASP   2           HB3      ASP   2  -2.866  14.268   9.403
   21    H    GLU   3           H        GLU   3  -2.332  14.195   4.987
   22    HA   GLU   3           HA       GLU   3  -4.609  15.874   4.889
   23    HB2  GLU   3           HB2      GLU   3  -3.205  14.220   2.819
   24    HB3  GLU   3           HB3      GLU   3  -4.621  15.201   2.451
   25    HG2  GLU   3           HG2      GLU   3  -2.056  16.241   3.629
   26    HG3  GLU   3           HG3      GLU   3  -2.514  16.332   1.935
   27    H    THR   4           H        THR   4  -6.697  15.439   4.273
   28    HA   THR   4           HA       THR   4  -7.562  12.641   4.566
   29    HB   THR   4           HB       THR   4  -9.710  13.679   5.507
   30    HG1  THR   4           HG1      THR   4  -7.903  15.877   5.754
   31   HG21  THR   4          HG21      THR   4  -8.126  12.439   6.896
   32   HG22  THR   4          HG22      THR   4  -8.784  13.817   7.778
   33   HG23  THR   4          HG23      THR   4  -7.155  13.896   7.106
   34    H    VAL   5           H        VAL   5  -8.789  11.869   2.945
   35    HA   VAL   5           HA       VAL   5  -9.965  13.804   1.071
   36    HB   VAL   5           HB       VAL   5  -9.941  11.941  -0.607
   37   HG11  VAL   5          HG11      VAL   5  -7.539  12.165  -1.108
   38   HG12  VAL   5          HG12      VAL   5  -7.284  12.851   0.496
   39   HG13  VAL   5          HG13      VAL   5  -8.280  13.708  -0.681
   40   HG21  VAL   5          HG21      VAL   5  -9.762  10.066   0.905
   41   HG22  VAL   5          HG22      VAL   5  -8.196  10.639   1.470
   42   HG23  VAL   5          HG23      VAL   5  -8.382  10.081  -0.193
   43    H    LYS   6           H        LYS   6 -12.018  13.199   0.090
   44    HA   LYS   6           HA       LYS   6 -13.646  11.470   1.820
   45    HB2  LYS   6           HB2      LYS   6 -13.851  13.910   2.397
   46    HB3  LYS   6           HB3      LYS   6 -14.498  14.153   0.794
   47    HG2  LYS   6           HG2      LYS   6 -16.379  12.723   1.289
   48    HG3  LYS   6           HG3      LYS   6 -15.713  12.413   2.887
   49    HD2  LYS   6           HD2      LYS   6 -15.920  14.764   3.452
   50    HD3  LYS   6           HD3      LYS   6 -16.530  15.114   1.840
   51    HE2  LYS   6           HE2      LYS   6 -18.468  13.729   2.267
   52    HE3  LYS   6           HE3      LYS   6 -17.848  13.311   3.859
   53    HZ1  LYS   6           HZ1      LYS   6 -18.574  16.046   2.963
   54    HZ2  LYS   6           HZ2      LYS   6 -18.015  15.622   4.503
   55    HZ3  LYS   6           HZ3      LYS   6 -19.516  15.062   3.965
   56    H    LEU   7           H        LEU   7 -15.822  10.992   0.773
   57    HA   LEU   7           HA       LEU   7 -17.056  10.147  -0.932
   58    HB2  LEU   7           HB2      LEU   7 -15.501  11.987  -2.691
   59    HB3  LEU   7           HB3      LEU   7 -17.023  11.240  -3.081
   60    HG   LEU   7           HG       LEU   7 -16.594  13.305  -0.924
   61   HD11  LEU   7          HD11      LEU   7 -16.323  14.242  -3.160
   62   HD12  LEU   7          HD12      LEU   7 -17.822  14.800  -2.416
   63   HD13  LEU   7          HD13      LEU   7 -17.865  13.540  -3.648
   64   HD21  LEU   7          HD21      LEU   7 -19.042  13.351  -0.849
   65   HD22  LEU   7          HD22      LEU   7 -18.394  11.771  -0.407
   66   HD23  LEU   7          HD23      LEU   7 -19.088  12.022  -2.007
   67    H    ASN   8           H        ASN   8 -15.400  10.310  -3.726
   68    HA   ASN   8           HA       ASN   8 -14.283   7.671  -3.568
   69    HB2  ASN   8           HB2      ASN   8 -13.701   9.848  -5.596
   70    HB3  ASN   8           HB3      ASN   8 -13.272   8.170  -5.767
   71   HD21  ASN   8          HD21      ASN   8 -14.893   9.834  -7.472
   72   HD22  ASN   8          HD22      ASN   8 -16.417   9.037  -7.593
   73    H    HIS   9           H        HIS   9 -12.814   7.549  -1.982
   74    HA   HIS   9           HA       HIS   9 -10.989   9.507  -1.222
   75    HB2  HIS   9           HB2      HIS   9 -10.791   6.498  -0.964
   76    HB3  HIS   9           HB3      HIS   9  -9.779   7.649  -0.102
   77    HD1  HIS   9           HD1      HIS   9 -13.075   6.000  -0.002
   78    HD2  HIS   9           HD2      HIS   9 -11.193   9.191   1.877
   79    HE1  HIS   9           HE1      HIS   9 -14.491   6.534   2.002
   80    HE2  HIS   9           HE2      HIS   9 -13.421   8.563   3.035
   81    H    THR  10           H        THR  10  -9.435  10.368  -2.383
   82    HA   THR  10           HA       THR  10  -8.539   9.350  -4.829
   83    HB   THR  10           HB       THR  10  -7.075  11.319  -3.046
   84    HG1  THR  10           HG1      THR  10  -8.375  12.752  -4.675
   85   HG21  THR  10          HG21      THR  10  -7.102  10.973  -6.049
   86   HG22  THR  10          HG22      THR  10  -5.774  10.546  -4.970
   87   HG23  THR  10          HG23      THR  10  -6.242  12.235  -5.167
   88    H    CYS  11           H        CYS  11  -6.919   8.044  -5.382
   89    HA   CYS  11           HA       CYS  11  -5.818   6.335  -3.427
   90    HB2  CYS  11           HB2      CYS  11  -6.232   5.707  -5.797
   91    HB3  CYS  11           HB3      CYS  11  -4.904   6.750  -6.245
   92    H    VAL  12           H        VAL  12  -4.267   6.690  -2.143
   93    HA   VAL  12           HA       VAL  12  -2.400   8.648  -2.058
   94    HB   VAL  12           HB       VAL  12  -3.186   6.554  -0.593
   95   HG11  VAL  12          HG11      VAL  12  -1.304   5.107  -0.095
   96   HG12  VAL  12          HG12      VAL  12  -0.455   5.762  -1.500
   97   HG13  VAL  12          HG13      VAL  12  -1.964   4.869  -1.714
   98   HG21  VAL  12          HG21      VAL  12  -0.819   8.279  -0.332
   99   HG22  VAL  12          HG22      VAL  12  -1.287   7.134   0.922
  100   HG23  VAL  12          HG23      VAL  12  -2.405   8.404   0.420
  101    H    ILE  13           H        ILE  13  -2.533   6.066  -4.326
  102    HA   ILE  13           HA       ILE  13   0.322   6.294  -4.907
  103    HB   ILE  13           HB       ILE  13  -1.560   4.272  -6.028
  104   HG12  ILE  13          HG12      ILE  13  -1.513   4.291  -3.521
  105   HG13  ILE  13          HG13      ILE  13  -0.994   2.803  -4.273
  106   HG21  ILE  13          HG21      ILE  13   1.427   4.283  -5.690
  107   HG22  ILE  13          HG22      ILE  13   0.565   4.589  -7.198
  108   HG23  ILE  13          HG23      ILE  13   0.467   3.004  -6.432
  109   HD11  ILE  13          HD11      ILE  13   0.817   4.928  -3.224
  110   HD12  ILE  13          HD12      ILE  13   1.306   3.382  -3.915
  111   HD13  ILE  13          HD13      ILE  13   0.404   3.429  -2.398
  112    H    CYS  14           H        CYS  14  -2.689   5.869  -6.823
  113    HA   CYS  14           HA       CYS  14  -1.240   6.971  -9.053
  114    HB2  CYS  14           HB2      CYS  14  -3.078   6.093 -10.442
  115    HB3  CYS  14           HB3      CYS  14  -2.246   4.869  -9.516
  116    H    ASP  15           H        ASP  15  -2.940   8.314  -6.728
  117    HA   ASP  15           HA       ASP  15  -3.842  10.382  -6.460
  118    HB2  ASP  15           HB2      ASP  15  -1.818  10.851  -7.973
  119    HB3  ASP  15           HB3      ASP  15  -3.013  11.046  -9.238
  120    H    GLN  16           H        GLN  16  -5.400   8.230  -7.745
  121    HA   GLN  16           HA       GLN  16  -7.331   9.800  -9.270
  122    HB2  GLN  16           HB2      GLN  16  -6.948   6.820  -9.120
  123    HB3  GLN  16           HB3      GLN  16  -8.175   7.638 -10.078
  124    HG2  GLN  16           HG2      GLN  16  -5.198   7.848 -10.424
  125    HG3  GLN  16           HG3      GLN  16  -6.318   6.970 -11.459
  126   HE21  GLN  16          HE21      GLN  16  -4.477   9.146 -12.077
  127   HE22  GLN  16          HE22      GLN  16  -5.439  10.414 -12.751
  128    H    GLU  17           H        GLU  17  -9.364   9.945  -8.637
  129    HA   GLU  17           HA       GLU  17 -10.031   9.492  -5.914
  130    HB2  GLU  17           HB2      GLU  17 -11.626  10.568  -8.228
  131    HB3  GLU  17           HB3      GLU  17 -12.232  10.476  -6.584
  132    HG2  GLU  17           HG2      GLU  17 -10.613  12.012  -5.822
  133    HG3  GLU  17           HG3      GLU  17  -9.749  11.944  -7.350
  134    H    LYS  18           H        LYS  18 -10.385   7.533  -5.332
  135    HA   LYS  18           HA       LYS  18 -12.106   5.799  -6.966
  136    HB2  LYS  18           HB2      LYS  18 -10.086   4.657  -5.165
  137    HB3  LYS  18           HB3      LYS  18 -10.798   3.958  -6.585
  138    HG2  LYS  18           HG2      LYS  18  -8.671   6.066  -6.471
  139    HG3  LYS  18           HG3      LYS  18  -8.495   4.400  -7.011
  140    HD2  LYS  18           HD2      LYS  18 -10.402   6.241  -8.364
  141    HD3  LYS  18           HD3      LYS  18  -8.705   6.295  -8.743
  142    HE2  LYS  18           HE2      LYS  18  -9.772   4.916 -10.344
  143    HE3  LYS  18           HE3      LYS  18  -8.826   3.914  -9.276
  144    HZ1  LYS  18           HZ1      LYS  18 -10.790   3.213  -8.146
  145    HZ2  LYS  18           HZ2      LYS  18 -11.034   2.994  -9.802
  146    HZ3  LYS  18           HZ3      LYS  18 -11.744   4.308  -9.011
  147    H    ASN  19           H        ASN  19 -13.799   4.863  -5.960
  148    HA   ASN  19           HA       ASN  19 -13.956   5.217  -3.059
  149    HB2  ASN  19           HB2      ASN  19 -16.332   4.825  -3.249
  150    HB3  ASN  19           HB3      ASN  19 -15.864   6.024  -4.444
  151   HD21  ASN  19          HD21      ASN  19 -15.985   5.547  -6.608
  152   HD22  ASN  19          HD22      ASN  19 -16.816   4.115  -7.210
  153    H    ARG  20           H        ARG  20 -12.408   3.159  -4.677
  154    HA   ARG  20           HA       ARG  20 -13.376   0.781  -3.267
  155    HB2  ARG  20           HB2      ARG  20 -14.109   1.022  -5.774
  156    HB3  ARG  20           HB3      ARG  20 -12.461   0.525  -6.096
  157    HG2  ARG  20           HG2      ARG  20 -12.797  -1.547  -4.961
  158    HG3  ARG  20           HG3      ARG  20 -14.375  -1.025  -4.403
  159    HD2  ARG  20           HD2      ARG  20 -15.320  -1.105  -6.501
  160    HD3  ARG  20           HD3      ARG  20 -13.753  -1.110  -7.271
  161    HE   ARG  20           HE       ARG  20 -13.645  -3.430  -6.005
  162   HH11  ARG  20          HH11      ARG  20 -16.282  -2.016  -7.835
  163   HH12  ARG  20          HH12      ARG  20 -16.912  -3.550  -8.346
  164   HH21  ARG  20          HH21      ARG  20 -14.457  -5.433  -6.697
  165   HH22  ARG  20          HH22      ARG  20 -15.891  -5.489  -7.686
  166    H    GLY  21           H        GLY  21 -11.792   0.022  -2.112
  167    HA2  GLY  21           HA2      GLY  21  -9.357  -0.927  -2.733
  168    HA3  GLY  21           HA3      GLY  21  -9.027   0.789  -2.554
  169    H    ILE  22           H        ILE  22  -7.689   0.228  -0.563
  170    HA   ILE  22           HA       ILE  22  -9.446  -0.513   1.668
  171    HB   ILE  22           HB       ILE  22  -7.830  -1.814   2.631
  172   HG12  ILE  22          HG12      ILE  22  -5.809  -0.250   1.058
  173   HG13  ILE  22          HG13      ILE  22  -6.176  -0.066   2.731
  174   HG21  ILE  22          HG21      ILE  22  -7.396  -1.977  -0.334
  175   HG22  ILE  22          HG22      ILE  22  -8.356  -3.036   0.701
  176   HG23  ILE  22          HG23      ILE  22  -6.590  -3.072   0.787
  177   HD11  ILE  22          HD11      ILE  22  -4.115  -1.287   2.412
  178   HD12  ILE  22          HD12      ILE  22  -4.986  -2.512   1.489
  179   HD13  ILE  22          HD13      ILE  22  -5.337  -2.280   3.204
  180    H    HIS  23           H        HIS  23  -8.044   0.031   3.749
  181    HA   HIS  23           HA       HIS  23  -7.002   2.733   3.669
  182    HB2  HIS  23           HB2      HIS  23  -9.494   2.039   5.252
  183    HB3  HIS  23           HB3      HIS  23  -8.600   3.532   5.402
  184    HD1  HIS  23           HD1      HIS  23  -9.090   5.372   3.732
  185    HD2  HIS  23           HD2      HIS  23 -10.913   1.761   2.868
  186    HE1  HIS  23           HE1      HIS  23 -10.723   5.875   1.889
  187    HE2  HIS  23           HE2      HIS  23 -11.942   3.701   1.501
  188    H    LEU  24           H        LEU  24  -5.271   2.715   4.979
  189    HA   LEU  24           HA       LEU  24  -5.128   0.744   7.103
  190    HB2  LEU  24           HB2      LEU  24  -3.129   2.677   5.969
  191    HB3  LEU  24           HB3      LEU  24  -2.809   1.565   7.248
  192    HG   LEU  24           HG       LEU  24  -3.567   0.754   4.458
  193   HD11  LEU  24          HD11      LEU  24  -1.263   0.005   4.274
  194   HD12  LEU  24          HD12      LEU  24  -0.920   0.614   5.891
  195   HD13  LEU  24          HD13      LEU  24  -1.334   1.736   4.595
  196   HD21  LEU  24          HD21      LEU  24  -4.315  -0.832   6.178
  197   HD22  LEU  24          HD22      LEU  24  -2.670  -0.897   6.820
  198   HD23  LEU  24          HD23      LEU  24  -3.011  -1.499   5.195
  199    H    TYR  25           H        TYR  25  -4.105   4.100   6.809
  200    HA   TYR  25           HA       TYR  25  -4.845   4.525   9.572
  201    HB2  TYR  25           HB2      TYR  25  -3.158   6.172   7.738
  202    HB3  TYR  25           HB3      TYR  25  -3.526   6.623   9.389
  203    HD1  TYR  25           HD1      TYR  25  -2.856   3.139   8.440
  204    HD2  TYR  25           HD2      TYR  25  -1.184   6.699  10.045
  205    HE1  TYR  25           HE1      TYR  25  -0.898   1.873   9.169
  206    HE2  TYR  25           HE2      TYR  25   0.780   5.437  10.796
  207    HH   TYR  25           HH       TYR  25   1.489   2.330   9.712
  208    H    THR  26           H        THR  26  -4.678   7.389   7.793
  209    HA   THR  26           HA       THR  26  -7.599   7.422   7.483
  210    HB   THR  26           HB       THR  26  -6.669   9.237   8.881
  211    HG1  THR  26           HG1      THR  26  -7.880   9.851   6.394
  212   HG21  THR  26          HG21      THR  26  -5.271  10.096   6.348
  213   HG22  THR  26          HG22      THR  26  -4.486   9.407   7.769
  214   HG23  THR  26          HG23      THR  26  -5.288  10.975   7.879
  215    H    LYS  27           H        LYS  27  -5.123   6.495   5.697
  216    HA   LYS  27           HA       LYS  27  -5.867   8.076   3.334
  217    HB2  LYS  27           HB2      LYS  27  -3.691   6.707   2.489
  218    HB3  LYS  27           HB3      LYS  27  -3.648   8.322   3.163
  219    HG2  LYS  27           HG2      LYS  27  -3.326   5.870   4.846
  220    HG3  LYS  27           HG3      LYS  27  -1.981   6.648   4.021
  221    HD2  LYS  27           HD2      LYS  27  -3.825   8.008   5.975
  222    HD3  LYS  27           HD3      LYS  27  -2.220   7.395   6.359
  223    HE2  LYS  27           HE2      LYS  27  -1.636   8.920   4.213
  224    HE3  LYS  27           HE3      LYS  27  -3.044   9.788   4.819
  225    HZ1  LYS  27           HZ1      LYS  27  -0.810  10.537   5.708
  226    HZ2  LYS  27           HZ2      LYS  27  -0.769   9.093   6.591
  227    HZ3  LYS  27           HZ3      LYS  27  -2.004  10.221   6.869
  228    H    PHE  28           H        PHE  28  -5.091   6.635   1.324
  229    HA   PHE  28           HA       PHE  28  -6.655   4.181   1.376
  230    HB2  PHE  28           HB2      PHE  28  -8.289   5.881   0.978
  231    HB3  PHE  28           HB3      PHE  28  -7.242   6.686  -0.177
  232    HD1  PHE  28           HD1      PHE  28  -7.229   6.059  -2.453
  233    HD2  PHE  28           HD2      PHE  28  -9.315   3.695   0.394
  234    HE1  PHE  28           HE1      PHE  28  -8.258   4.794  -4.275
  235    HE2  PHE  28           HE2      PHE  28 -10.362   2.420  -1.431
  236    HZ   PHE  28           HZ       PHE  28  -9.820   2.954  -3.785
  237    H    ILE  29           H        ILE  29  -5.165   2.816   0.476
  238    HA   ILE  29           HA       ILE  29  -3.924   3.630  -2.041
  239    HB   ILE  29           HB       ILE  29  -3.926   0.868  -0.774
  240   HG12  ILE  29          HG12      ILE  29  -1.412   1.442  -0.440
  241   HG13  ILE  29          HG13      ILE  29  -1.942   3.119  -0.550
  242   HG21  ILE  29          HG21      ILE  29  -2.132   0.400  -2.387
  243   HG22  ILE  29          HG22      ILE  29  -2.349   2.011  -3.068
  244   HG23  ILE  29          HG23      ILE  29  -3.659   0.829  -3.172
  245   HD11  ILE  29          HD11      ILE  29  -3.112   1.155   1.390
  246   HD12  ILE  29          HD12      ILE  29  -3.285   2.911   1.382
  247   HD13  ILE  29          HD13      ILE  29  -1.727   2.176   1.762
  248    H    CYS  30           H        CYS  30  -5.121   3.331  -3.931
  249    HA   CYS  30           HA       CYS  30  -7.682   2.091  -3.749
  250    HB2  CYS  30           HB2      CYS  30  -8.038   2.589  -5.970
  251    HB3  CYS  30           HB3      CYS  30  -6.827   3.788  -5.552
  252    H    LEU  31           H        LEU  31  -8.390   0.275  -4.805
  253    HA   LEU  31           HA       LEU  31  -7.229  -1.988  -3.844
  254    HB2  LEU  31           HB2      LEU  31  -9.046  -3.054  -4.727
  255    HB3  LEU  31           HB3      LEU  31  -9.610  -1.421  -4.625
  256    HG   LEU  31           HG       LEU  31  -8.753  -1.343  -7.139
  257   HD11  LEU  31          HD11      LEU  31  -9.540  -4.231  -6.766
  258   HD12  LEU  31          HD12      LEU  31  -7.920  -3.646  -7.150
  259   HD13  LEU  31          HD13      LEU  31  -9.236  -3.425  -8.303
  260   HD21  LEU  31          HD21      LEU  31 -11.040  -1.824  -7.836
  261   HD22  LEU  31          HD22      LEU  31 -10.999  -0.828  -6.383
  262   HD23  LEU  31          HD23      LEU  31 -11.368  -2.548  -6.263
  263    H    ASP  32           H        ASP  32  -6.432  -0.353  -6.675
  264    HA   ASP  32           HA       ASP  32  -5.551  -2.622  -8.235
  265    HB2  ASP  32           HB2      ASP  32  -6.475  -0.651  -9.321
  266    HB3  ASP  32           HB3      ASP  32  -5.239   0.325  -8.591
  267    H    CYS  33           H        CYS  33  -4.229   0.155  -6.731
  268    HA   CYS  33           HA       CYS  33  -1.516  -0.494  -6.988
  269    HB2  CYS  33           HB2      CYS  33  -2.884   1.501  -5.219
  270    HB3  CYS  33           HB3      CYS  33  -1.164   1.383  -5.454
  271    H    GLU  34           H        GLU  34  -3.965  -0.926  -4.649
  272    HA   GLU  34           HA       GLU  34  -2.431  -1.627  -2.446
  273    HB2  GLU  34           HB2      GLU  34  -4.768  -0.981  -2.298
  274    HB3  GLU  34           HB3      GLU  34  -5.241  -2.371  -3.232
  275    HG2  GLU  34           HG2      GLU  34  -3.808  -2.895  -0.735
  276    HG3  GLU  34           HG3      GLU  34  -5.431  -2.281  -0.604
  277    H    ARG  35           H        ARG  35  -3.829  -3.541  -5.024
  278    HA   ARG  35           HA       ARG  35  -2.634  -5.921  -4.002
  279    HB2  ARG  35           HB2      ARG  35  -3.359  -7.068  -5.986
  280    HB3  ARG  35           HB3      ARG  35  -4.657  -6.032  -5.419
  281    HG2  ARG  35           HG2      ARG  35  -4.039  -4.372  -7.132
  282    HG3  ARG  35           HG3      ARG  35  -2.816  -5.487  -7.721
  283    HD2  ARG  35           HD2      ARG  35  -5.748  -5.986  -7.625
  284    HD3  ARG  35           HD3      ARG  35  -4.811  -5.639  -9.067
  285    HE   ARG  35           HE       ARG  35  -3.573  -7.812  -8.164
  286   HH11  ARG  35          HH11      ARG  35  -6.981  -7.139  -8.565
  287   HH12  ARG  35          HH12      ARG  35  -7.416  -8.805  -8.793
  288   HH21  ARG  35          HH21      ARG  35  -4.132 -10.001  -8.473
  289   HH22  ARG  35          HH22      ARG  35  -5.787 -10.434  -8.753
  290    H    LYS  36           H        LYS  36  -1.478  -3.369  -5.957
  291    HA   LYS  36           HA       LYS  36   0.429  -4.732  -7.497
  292    HB2  LYS  36           HB2      LYS  36   0.536  -1.947  -6.467
  293    HB3  LYS  36           HB3      LYS  36   1.538  -2.587  -7.736
  294    HG2  LYS  36           HG2      LYS  36  -0.622  -2.946  -9.004
  295    HG3  LYS  36           HG3      LYS  36  -1.379  -2.029  -7.787
  296    HD2  LYS  36           HD2      LYS  36  -0.751  -0.243  -8.731
  297    HD3  LYS  36           HD3      LYS  36   0.934  -0.699  -8.706
  298    HE2  LYS  36           HE2      LYS  36  -0.029  -0.217 -10.942
  299    HE3  LYS  36           HE3      LYS  36   0.712  -1.798 -10.802
  300    HZ1  LYS  36           HZ1      LYS  36  -2.201  -1.192 -10.675
  301    HZ2  LYS  36           HZ2      LYS  36  -1.511  -2.734 -10.512
  302    HZ3  LYS  36           HZ3      LYS  36  -1.388  -1.907 -11.980
  303    H    VAL  37           H        VAL  37   0.392  -3.222  -4.409
  304    HA   VAL  37           HA       VAL  37   3.071  -3.262  -3.808
  305    HB   VAL  37           HB       VAL  37   2.430  -3.110  -1.469
  306   HG11  VAL  37          HG11      VAL  37   2.177  -1.158  -3.139
  307   HG12  VAL  37          HG12      VAL  37   1.415  -1.006  -1.557
  308   HG13  VAL  37          HG13      VAL  37   0.441  -1.445  -2.964
  309   HG21  VAL  37          HG21      VAL  37  -0.092  -2.954  -1.046
  310   HG22  VAL  37          HG22      VAL  37   0.702  -4.526  -1.085
  311   HG23  VAL  37          HG23      VAL  37  -0.221  -3.968  -2.490
  312    H    ILE  38           H        ILE  38   0.603  -5.599  -3.101
  313    HA   ILE  38           HA       ILE  38   2.043  -7.486  -1.636
  314    HB   ILE  38           HB       ILE  38  -0.160  -8.200  -3.557
  315   HG12  ILE  38          HG12      ILE  38  -0.342  -6.597  -1.043
  316   HG13  ILE  38          HG13      ILE  38  -1.098  -6.302  -2.590
  317   HG21  ILE  38          HG21      ILE  38   0.865 -10.042  -2.375
  318   HG22  ILE  38          HG22      ILE  38  -0.795  -9.808  -1.827
  319   HG23  ILE  38          HG23      ILE  38   0.548  -9.256  -0.832
  320   HD11  ILE  38          HD11      ILE  38  -2.581  -8.234  -2.191
  321   HD12  ILE  38          HD12      ILE  38  -2.768  -6.936  -1.012
  322   HD13  ILE  38          HD13      ILE  38  -1.878  -8.392  -0.581
  323    H    SER  39           H        SER  39   1.615  -6.808  -4.971
  324    HA   SER  39           HA       SER  39   2.747  -9.240  -5.864
  325    HB2  SER  39           HB2      SER  39   1.079  -7.971  -7.196
  326    HB3  SER  39           HB3      SER  39   2.281  -6.708  -7.440
  327    HG   SER  39           HG       SER  39   2.815  -9.386  -8.159
  328    H    THR  40           H        THR  40   3.918  -6.180  -4.938
  329    HA   THR  40           HA       THR  40   6.408  -6.319  -6.385
  330    HB   THR  40           HB       THR  40   5.502  -4.386  -4.245
  331    HG1  THR  40           HG1      THR  40   4.211  -4.465  -6.223
  332   HG21  THR  40          HG21      THR  40   7.226  -2.907  -5.132
  333   HG22  THR  40          HG22      THR  40   7.716  -4.146  -6.286
  334   HG23  THR  40          HG23      THR  40   7.941  -4.413  -4.558
  335    H    SER  41           H        SER  41   5.375  -6.650  -2.988
  336    HA   SER  41           HA       SER  41   8.120  -6.708  -2.093
  337    HB2  SER  41           HB2      SER  41   7.022  -6.921   0.165
  338    HB3  SER  41           HB3      SER  41   6.594  -5.477  -0.754
  339    HG   SER  41           HG       SER  41   4.704  -6.334   0.023
  340    H    THR  42           H        THR  42   5.775  -9.083  -2.928
  341    HA   THR  42           HA       THR  42   6.641 -11.046  -1.026
  342    HB   THR  42           HB       THR  42   5.177 -12.593  -2.376
  343    HG1  THR  42           HG1      THR  42   3.963 -10.453  -3.635
  344   HG21  THR  42          HG21      THR  42   3.098 -11.518  -1.620
  345   HG22  THR  42          HG22      THR  42   3.976 -10.004  -1.380
  346   HG23  THR  42          HG23      THR  42   4.363 -11.417  -0.394
  347    H    SER  43           H        SER  43   8.706 -10.002  -2.752
  348    HA   SER  43           HA       SER  43   9.899 -12.545  -3.428
  349    HB2  SER  43           HB2      SER  43   8.811 -11.856  -5.555
  350    HB3  SER  43           HB3      SER  43   9.700 -10.335  -5.500
  351    HG   SER  43           HG       SER  43  11.644 -11.611  -5.547
  352    H    ASP  44           H        ASP  44  10.164 -10.456  -1.440
  353    HA   ASP  44           HA       ASP  44  12.943  -9.673  -1.937
  354    HB2  ASP  44           HB2      ASP  44  11.654  -7.695  -2.423
  355    HB3  ASP  44           HB3      ASP  44  10.734  -7.872  -0.932
  356    HA   PRO  45           HA       PRO  45  13.148 -11.390   2.199
  357    HB2  PRO  45           HB2      PRO  45  15.781 -11.823   2.197
  358    HB3  PRO  45           HB3      PRO  45  14.713 -12.776   1.170
  359    HG2  PRO  45           HG2      PRO  45  16.496 -10.501   0.486
  360    HG3  PRO  45           HG3      PRO  45  16.129 -11.968  -0.392
  361    HD2  PRO  45           HD2      PRO  45  14.985  -9.486  -0.866
  362    HD3  PRO  45           HD3      PRO  45  14.369 -11.042  -1.458
  363    H    ASP  46           H        ASP  46  12.776  -8.743   2.056
  364    HA   ASP  46           HA       ASP  46  14.414  -6.794   2.798
  365    HB2  ASP  46           HB2      ASP  46  12.021  -6.440   2.773
  366    HB3  ASP  46           HB3      ASP  46  11.817  -7.443   4.206
  367    H    TYR  47           H        TYR  47  13.004  -8.804   5.401
  368    HA   TYR  47           HA       TYR  47  15.431  -8.228   6.941
  369    HB2  TYR  47           HB2      TYR  47  14.050  -8.612   8.974
  370    HB3  TYR  47           HB3      TYR  47  13.539  -7.229   8.024
  371    HD1  TYR  47           HD1      TYR  47  11.516  -7.531   6.488
  372    HD2  TYR  47           HD2      TYR  47  12.541 -10.298   9.549
  373    HE1  TYR  47           HE1      TYR  47   9.212  -8.393   6.469
  374    HE2  TYR  47           HE2      TYR  47  10.244 -11.174   9.534
  375    HH   TYR  47           HH       TYR  47   8.053 -10.578   7.100
  376    H    ALA  48           H        ALA  48  16.731  -9.835   7.335
  377    HA   ALA  48           HA       ALA  48  15.748 -12.504   7.846
  378    HB1  ALA  48           HB1      ALA  48  17.628 -11.987   5.539
  379    HB2  ALA  48           HB2      ALA  48  15.946 -12.500   5.404
  380    HB3  ALA  48           HB3      ALA  48  17.138 -13.571   6.142
  381    H1   SER   0           H1       SER   0   3.286  19.161  -7.481
  382    H2   SER   0           H2       SER   0   3.756  18.799  -5.894
  383    H3   SER   0           H3       SER   0   4.008  20.352  -6.522
  384    HA   SER   0           HA       SER   0   2.143  20.309  -5.009
  385    HB2  SER   0           HB2      SER   0   2.166  21.912  -6.889
  386    HB3  SER   0           HB3      SER   0   1.331  20.735  -7.898
  387    HG   SER   0           HG       SER   0   0.347  21.936  -5.512
  388    H    MET   1           H        MET   1   1.116  18.641  -8.008
  389    HA   MET   1           HA       MET   1  -0.997  17.295  -6.587
  390    HB2  MET   1           HB2      MET   1  -0.020  16.962  -9.431
  391    HB3  MET   1           HB3      MET   1  -1.487  16.254  -8.772
  392    HG2  MET   1           HG2      MET   1  -2.450  18.430  -8.448
  393    HG3  MET   1           HG3      MET   1  -0.948  19.208  -8.940
  394    HE1  MET   1           HE1      MET   1  -2.709  16.041 -10.523
  395    HE2  MET   1           HE2      MET   1  -3.684  16.803 -11.777
  396    HE3  MET   1           HE3      MET   1  -4.043  17.102 -10.078
  397    H    ASP   2           H        ASP   2   1.514  15.954  -8.718
  398    HA   ASP   2           HA       ASP   2   1.521  13.505  -7.146
  399    HB2  ASP   2           HB2      ASP   2   1.463  13.397  -9.623
  400    HB3  ASP   2           HB3      ASP   2   3.025  14.203  -9.682
  401    H    GLU   3           H        GLU   3   2.495  14.156  -5.262
  402    HA   GLU   3           HA       GLU   3   4.803  15.792  -5.172
  403    HB2  GLU   3           HB2      GLU   3   3.373  14.170  -3.094
  404    HB3  GLU   3           HB3      GLU   3   4.807  15.125  -2.733
  405    HG2  GLU   3           HG2      GLU   3   2.259  16.210  -3.907
  406    HG3  GLU   3           HG3      GLU   3   2.724  16.298  -2.214
  407    H    THR   4           H        THR   4   6.886  15.317  -4.559
  408    HA   THR   4           HA       THR   4   7.692  12.501  -4.843
  409    HB   THR   4           HB       THR   4   9.860  13.494  -5.794
  410    HG1  THR   4           HG1      THR   4   8.097  15.728  -6.047
  411   HG21  THR   4          HG21      THR   4   8.251  12.284  -7.178
  412   HG22  THR   4          HG22      THR   4   8.931  13.650  -8.062
  413   HG23  THR   4          HG23      THR   4   7.307  13.760  -7.386
  414    H    VAL   5           H        VAL   5   8.930  11.711  -3.233
  415    HA   VAL   5           HA       VAL   5  10.125  13.632  -1.357
  416    HB   VAL   5           HB       VAL   5  10.071  11.772   0.325
  417   HG11  VAL   5          HG11      VAL   5   7.675  12.045   0.830
  418   HG12  VAL   5          HG12      VAL   5   7.430  12.730  -0.776
  419   HG13  VAL   5          HG13      VAL   5   8.442  13.572   0.396
  420   HG21  VAL   5          HG21      VAL   5   9.852   9.899  -1.185
  421   HG22  VAL   5          HG22      VAL   5   8.295  10.501  -1.746
  422   HG23  VAL   5          HG23      VAL   5   8.478   9.941  -0.083
  423    H    LYS   6           H        LYS   6  12.171  12.998  -0.376
  424    HA   LYS   6           HA       LYS   6  13.759  11.232  -2.103
  425    HB2  LYS   6           HB2      LYS   6  14.010  13.662  -2.691
  426    HB3  LYS   6           HB3      LYS   6  14.667  13.901  -1.092
  427    HG2  LYS   6           HG2      LYS   6  16.519  12.430  -1.586
  428    HG3  LYS   6           HG3      LYS   6  15.844  12.129  -3.183
  429    HD2  LYS   6           HD2      LYS   6  16.094  14.475  -3.755
  430    HD3  LYS   6           HD3      LYS   6  16.712  14.816  -2.145
  431    HE2  LYS   6           HE2      LYS   6  18.624  13.396  -2.569
  432    HE3  LYS   6           HE3      LYS   6  17.995  12.984  -4.161
  433    HZ1  LYS   6           HZ1      LYS   6  18.776  15.706  -3.270
  434    HZ2  LYS   6           HZ2      LYS   6  18.199  15.293  -4.806
  435    HZ3  LYS   6           HZ3      LYS   6  19.694  14.701  -4.278
  436    H    LEU   7           H        LEU   7  15.922  10.710  -1.067
  437    HA   LEU   7           HA       LEU   7  17.151   9.847   0.638
  438    HB2  LEU   7           HB2      LEU   7  15.636  11.719   2.397
  439    HB3  LEU   7           HB3      LEU   7  17.146  10.945   2.787
  440    HG   LEU   7           HG       LEU   7  16.747  13.012   0.624
  441   HD11  LEU   7          HD11      LEU   7  16.497  13.961   2.856
  442   HD12  LEU   7          HD12      LEU   7  18.004  14.488   2.107
  443   HD13  LEU   7          HD13      LEU   7  18.027  13.231   3.342
  444   HD21  LEU   7          HD21      LEU   7  19.195  13.015   0.545
  445   HD22  LEU   7          HD22      LEU   7  18.518  11.447   0.108
  446   HD23  LEU   7          HD23      LEU   7  19.219  11.689   1.706
  447    H    ASN   8           H        ASN   8  15.510  10.047   3.433
  448    HA   ASN   8           HA       ASN   8  14.343   7.431   3.288
  449    HB2  ASN   8           HB2      ASN   8  13.806   9.625   5.310
  450    HB3  ASN   8           HB3      ASN   8  13.342   7.956   5.485
  451   HD21  ASN   8          HD21      ASN   8  15.000   9.593   7.181
  452   HD22  ASN   8          HD22      ASN   8  16.508   8.766   7.303
  453    H    HIS   9           H        HIS   9  12.865   7.332   1.705
  454    HA   HIS   9           HA       HIS   9  11.078   9.325   0.943
  455    HB2  HIS   9           HB2      HIS   9  10.824   6.322   0.694
  456    HB3  HIS   9           HB3      HIS   9   9.829   7.486  -0.170
  457    HD1  HIS   9           HD1      HIS   9  13.091   5.775  -0.269
  458    HD2  HIS   9           HD2      HIS   9  11.266   8.991  -2.159
  459    HE1  HIS   9           HE1      HIS   9  14.515   6.275  -2.278
  460    HE2  HIS   9           HE2      HIS   9  13.491   8.334  -3.298
  461    H    THR  10           H        THR  10   9.544  10.218   2.105
  462    HA   THR  10           HA       THR  10   8.630   9.220   4.555
  463    HB   THR  10           HB       THR  10   7.201  11.212   2.770
  464    HG1  THR  10           HG1      THR  10   8.521  12.632   4.383
  465   HG21  THR  10          HG21      THR  10   7.226  10.869   5.774
  466   HG22  THR  10          HG22      THR  10   5.890  10.463   4.697
  467   HG23  THR  10          HG23      THR  10   6.386  12.144   4.890
  468    H    CYS  11           H        CYS  11   6.987   7.943   5.114
  469    HA   CYS  11           HA       CYS  11   5.852   6.252   3.166
  470    HB2  CYS  11           HB2      CYS  11   6.259   5.623   5.537
  471    HB3  CYS  11           HB3      CYS  11   4.952   6.690   5.984
  472    H    VAL  12           H        VAL  12   4.304   6.634   1.884
  473    HA   VAL  12           HA       VAL  12   2.472   8.624   1.797
  474    HB   VAL  12           HB       VAL  12   3.219   6.512   0.335
  475   HG11  VAL  12          HG11      VAL  12   1.310   5.099  -0.155
  476   HG12  VAL  12          HG12      VAL  12   0.476   5.772   1.250
  477   HG13  VAL  12          HG13      VAL  12   1.967   4.854   1.463
  478   HG21  VAL  12          HG21      VAL  12   0.884   8.280   0.074
  479   HG22  VAL  12          HG22      VAL  12   1.327   7.122  -1.176
  480   HG23  VAL  12          HG23      VAL  12   2.470   8.373  -0.681
  481    H    ILE  13           H        ILE  13   2.564   6.045   4.074
  482    HA   ILE  13           HA       ILE  13  -0.287   6.326   4.657
  483    HB   ILE  13           HB       ILE  13   1.561   4.273   5.780
  484   HG12  ILE  13          HG12      ILE  13   1.507   4.287   3.272
  485   HG13  ILE  13          HG13      ILE  13   0.964   2.811   4.030
  486   HG21  ILE  13          HG21      ILE  13  -1.425   4.339   5.449
  487   HG22  ILE  13          HG22      ILE  13  -0.555   4.633   6.954
  488   HG23  ILE  13          HG23      ILE  13  -0.489   3.043   6.193
  489   HD11  ILE  13          HD11      ILE  13  -0.810   4.965   2.981
  490   HD12  ILE  13          HD12      ILE  13  -1.325   3.431   3.679
  491   HD13  ILE  13          HD13      ILE  13  -0.429   3.455   2.158
  492    H    CYS  14           H        CYS  14   2.717   5.847   6.572
  493    HA   CYS  14           HA       CYS  14   1.295   6.986   8.803
  494    HB2  CYS  14           HB2      CYS  14   3.120   6.075  10.191
  495    HB3  CYS  14           HB3      CYS  14   2.266   4.865   9.266
  496    H    ASP  15           H        ASP  15   3.014   8.289   6.474
  497    HA   ASP  15           HA       ASP  15   3.956  10.340   6.194
  498    HB2  ASP  15           HB2      ASP  15   1.944  10.854   7.704
  499    HB3  ASP  15           HB3      ASP  15   3.142  11.025   8.970
  500    H    GLN  16           H        GLN  16   5.476   8.166   7.480
  501    HA   GLN  16           HA       GLN  16   7.439   9.703   8.994
  502    HB2  GLN  16           HB2      GLN  16   7.002   6.731   8.854
  503    HB3  GLN  16           HB3      GLN  16   8.244   7.529   9.805
  504    HG2  GLN  16           HG2      GLN  16   5.274   7.796  10.160
  505    HG3  GLN  16           HG3      GLN  16   6.380   6.898  11.194
  506   HE21  GLN  16          HE21      GLN  16   4.579   9.118  11.802
  507   HE22  GLN  16          HE22      GLN  16   5.568  10.366  12.478
  508    H    GLU  17           H        GLU  17   9.475   9.807   8.355
  509    HA   GLU  17           HA       GLU  17  10.127   9.335   5.631
  510    HB2  GLU  17           HB2      GLU  17  11.741  10.387   7.941
  511    HB3  GLU  17           HB3      GLU  17  12.345  10.282   6.297
  512    HG2  GLU  17           HG2      GLU  17  10.755  11.847   5.538
  513    HG3  GLU  17           HG3      GLU  17   9.893  11.799   7.067
  514    H    LYS  18           H        LYS  18  10.448   7.370   5.056
  515    HA   LYS  18           HA       LYS  18  12.141   5.610   6.696
  516    HB2  LYS  18           HB2      LYS  18  10.094   4.501   4.900
  517    HB3  LYS  18           HB3      LYS  18  10.794   3.793   6.321
  518    HG2  LYS  18           HG2      LYS  18   8.706   5.938   6.202
  519    HG3  LYS  18           HG3      LYS  18   8.501   4.276   6.749
  520    HD2  LYS  18           HD2      LYS  18  10.441   6.088   8.093
  521    HD3  LYS  18           HD3      LYS  18   8.746   6.172   8.474
  522    HE2  LYS  18           HE2      LYS  18   9.791   4.781  10.078
  523    HE3  LYS  18           HE3      LYS  18   8.826   3.791   9.013
  524    HZ1  LYS  18           HZ1      LYS  18  10.774   3.051   7.883
  525    HZ2  LYS  18           HZ2      LYS  18  11.021   2.842   9.539
  526    HZ3  LYS  18           HZ3      LYS  18  11.746   4.137   8.740
  527    H    ASN  19           H        ASN  19  13.808   4.630   5.689
  528    HA   ASN  19           HA       ASN  19  13.967   4.982   2.784
  529    HB2  ASN  19           HB2      ASN  19  16.334   4.546   2.968
  530    HB3  ASN  19           HB3      ASN  19  15.893   5.757   4.160
  531   HD21  ASN  19          HD21      ASN  19  16.019   5.288   6.325
  532   HD22  ASN  19          HD22      ASN  19  16.823   3.844   6.929
  533    H    ARG  20           H        ARG  20  12.384   2.958   4.411
  534    HA   ARG  20           HA       ARG  20  13.304   0.559   3.003
  535    HB2  ARG  20           HB2      ARG  20  14.048   0.791   5.507
  536    HB3  ARG  20           HB3      ARG  20  12.392   0.325   5.834
  537    HG2  ARG  20           HG2      ARG  20  12.687  -1.755   4.703
  538    HG3  ARG  20           HG3      ARG  20  14.273  -1.263   4.141
  539    HD2  ARG  20           HD2      ARG  20  15.219  -1.356   6.238
  540    HD3  ARG  20           HD3      ARG  20  13.653  -1.332   7.010
  541    HE   ARG  20           HE       ARG  20  13.503  -3.654   5.748
  542   HH11  ARG  20          HH11      ARG  20  16.160  -2.277   7.577
  543   HH12  ARG  20          HH12      ARG  20  16.770  -3.817   8.087
  544   HH21  ARG  20          HH21      ARG  20  14.275  -5.668   6.448
  545   HH22  ARG  20          HH22      ARG  20  15.713  -5.751   7.428
  546    H    GLY  21           H        GLY  21  11.703  -0.178   1.852
  547    HA2  GLY  21           HA2      GLY  21   9.253  -1.077   2.485
  548    HA3  GLY  21           HA3      GLY  21   8.956   0.644   2.302
  549    H    ILE  22           H        ILE  22   7.604   0.107   0.313
  550    HA   ILE  22           HA       ILE  22   9.344  -0.674  -1.917
  551    HB   ILE  22           HB       ILE  22   7.702  -1.948  -2.875
  552   HG12  ILE  22          HG12      ILE  22   5.711  -0.344  -1.303
  553   HG13  ILE  22          HG13      ILE  22   6.079  -0.171  -2.976
  554   HG21  ILE  22          HG21      ILE  22   7.271  -2.095   0.091
  555   HG22  ILE  22          HG22      ILE  22   8.209  -3.175  -0.942
  556   HG23  ILE  22          HG23      ILE  22   6.442  -3.179  -1.024
  557   HD11  ILE  22          HD11      ILE  22   3.998  -1.354  -2.651
  558   HD12  ILE  22          HD12      ILE  22   4.847  -2.594  -1.728
  559   HD13  ILE  22          HD13      ILE  22   5.200  -2.371  -3.442
  560    H    HIS  23           H        HIS  23   7.947  -0.109  -3.997
  561    HA   HIS  23           HA       HIS  23   6.956   2.611  -3.927
  562    HB2  HIS  23           HB2      HIS  23   9.432   1.867  -5.511
  563    HB3  HIS  23           HB3      HIS  23   8.566   3.376  -5.663
  564    HD1  HIS  23           HD1      HIS  23   9.096   5.211  -4.000
  565    HD2  HIS  23           HD2      HIS  23  10.852   1.568  -3.127
  566    HE1  HIS  23           HE1      HIS  23  10.737   5.685  -2.157
  567    HE2  HIS  23           HE2      HIS  23  11.926   3.492  -1.776
  568    H    LEU  24           H        LEU  24   5.222   2.621  -5.234
  569    HA   LEU  24           HA       LEU  24   5.043   0.648  -7.351
  570    HB2  LEU  24           HB2      LEU  24   3.078   2.620  -6.219
  571    HB3  LEU  24           HB3      LEU  24   2.736   1.509  -7.493
  572    HG   LEU  24           HG       LEU  24   3.484   0.693  -4.702
  573   HD11  LEU  24          HD11      LEU  24   1.169  -0.015  -4.511
  574   HD12  LEU  24          HD12      LEU  24   0.834   0.593  -6.129
  575   HD13  LEU  24          HD13      LEU  24   1.266   1.713  -4.838
  576   HD21  LEU  24          HD21      LEU  24   4.200  -0.912  -6.416
  577   HD22  LEU  24          HD22      LEU  24   2.554  -0.948  -7.055
  578   HD23  LEU  24          HD23      LEU  24   2.885  -1.550  -5.429
  579    H    TYR  25           H        TYR  25   4.079   4.024  -7.061
  580    HA   TYR  25           HA       TYR  25   4.818   4.428  -9.828
  581    HB2  TYR  25           HB2      TYR  25   3.166   6.108  -7.992
  582    HB3  TYR  25           HB3      TYR  25   3.540   6.552  -9.645
  583    HD1  TYR  25           HD1      TYR  25   2.805   3.084  -8.687
  584    HD2  TYR  25           HD2      TYR  25   1.203   6.669 -10.304
  585    HE1  TYR  25           HE1      TYR  25   0.823   1.852  -9.411
  586    HE2  TYR  25           HE2      TYR  25  -0.785   5.443 -11.051
  587    HH   TYR  25           HH       TYR  25  -1.549   2.342  -9.959
  588    H    THR  26           H        THR  26   4.711   7.296  -8.055
  589    HA   THR  26           HA       THR  26   7.632   7.277  -7.751
  590    HB   THR  26           HB       THR  26   6.726   9.104  -9.151
  591    HG1  THR  26           HG1      THR  26   7.959   9.719  -6.674
  592   HG21  THR  26          HG21      THR  26   5.357   9.999  -6.616
  593   HG22  THR  26          HG22      THR  26   4.556   9.318  -8.031
  594   HG23  THR  26          HG23      THR  26   5.386  10.871  -8.151
  595    H    LYS  27           H        LYS  27   5.140   6.403  -5.958
  596    HA   LYS  27           HA       LYS  27   5.920   7.975  -3.602
  597    HB2  LYS  27           HB2      LYS  27   3.721   6.650  -2.748
  598    HB3  LYS  27           HB3      LYS  27   3.707   8.263  -3.427
  599    HG2  LYS  27           HG2      LYS  27   3.335   5.811  -5.101
  600    HG3  LYS  27           HG3      LYS  27   2.009   6.618  -4.276
  601    HD2  LYS  27           HD2      LYS  27   3.871   7.938  -6.238
  602    HD3  LYS  27           HD3      LYS  27   2.254   7.356  -6.615
  603    HE2  LYS  27           HE2      LYS  27   1.704   8.895  -4.471
  604    HE3  LYS  27           HE3      LYS  27   3.125   9.735  -5.084
  605    HZ1  LYS  27           HZ1      LYS  27   0.904  10.520  -5.968
  606    HZ2  LYS  27           HZ2      LYS  27   0.834   9.076  -6.846
  607    HZ3  LYS  27           HZ3      LYS  27   2.088  10.182  -7.131
  608    H    PHE  28           H        PHE  28   5.124   6.557  -1.585
  609    HA   PHE  28           HA       PHE  28   6.638   4.071  -1.636
  610    HB2  PHE  28           HB2      PHE  28   8.305   5.741  -1.245
  611    HB3  PHE  28           HB3      PHE  28   7.274   6.568  -0.088
  612    HD1  PHE  28           HD1      PHE  28   7.255   5.948   2.189
  613    HD2  PHE  28           HD2      PHE  28   9.294   3.536  -0.656
  614    HE1  PHE  28           HE1      PHE  28   8.265   4.668   4.013
  615    HE2  PHE  28           HE2      PHE  28  10.318   2.247   1.172
  616    HZ   PHE  28           HZ       PHE  28   9.792   2.798   3.524
  617    H    ILE  29           H        ILE  29   5.124   2.735  -0.728
  618    HA   ILE  29           HA       ILE  29   3.906   3.579   1.789
  619    HB   ILE  29           HB       ILE  29   3.853   0.813   0.530
  620   HG12  ILE  29          HG12      ILE  29   1.351   1.434   0.199
  621   HG13  ILE  29          HG13      ILE  29   1.910   3.100   0.304
  622   HG21  ILE  29          HG21      ILE  29   2.055   0.385   2.149
  623   HG22  ILE  29          HG22      ILE  29   2.302   1.992   2.824
  624   HG23  ILE  29          HG23      ILE  29   3.590   0.788   2.929
  625   HD11  ILE  29          HD11      ILE  29   3.044   1.109  -1.633
  626   HD12  ILE  29          HD12      ILE  29   3.249   2.863  -1.629
  627   HD13  ILE  29          HD13      ILE  29   1.678   2.155  -2.006
  628    H    CYS  30           H        CYS  30   5.100   3.262   3.677
  629    HA   CYS  30           HA       CYS  30   7.637   1.975   3.494
  630    HB2  CYS  30           HB2      CYS  30   8.007   2.473   5.713
  631    HB3  CYS  30           HB3      CYS  30   6.819   3.692   5.295
  632    H    LEU  31           H        LEU  31   8.313   0.149   4.548
  633    HA   LEU  31           HA       LEU  31   7.112  -2.095   3.600
  634    HB2  LEU  31           HB2      LEU  31   8.910  -3.189   4.486
  635    HB3  LEU  31           HB3      LEU  31   9.503  -1.568   4.379
  636    HG   LEU  31           HG       LEU  31   8.654  -1.468   6.893
  637   HD11  LEU  31          HD11      LEU  31   9.385  -4.372   6.524
  638   HD12  LEU  31          HD12      LEU  31   7.779  -3.755   6.911
  639   HD13  LEU  31          HD13      LEU  31   9.100  -3.556   8.061
  640   HD21  LEU  31          HD21      LEU  31  10.932  -1.991   7.583
  641   HD22  LEU  31          HD22      LEU  31  10.906  -0.997   6.129
  642   HD23  LEU  31          HD23      LEU  31  11.242  -2.723   6.011
  643    H    ASP  32           H        ASP  32   6.348  -0.438   6.429
  644    HA   ASP  32           HA       ASP  32   5.429  -2.689   7.997
  645    HB2  ASP  32           HB2      ASP  32   6.391  -0.731   9.078
  646    HB3  ASP  32           HB3      ASP  32   5.168   0.266   8.350
  647    H    CYS  33           H        CYS  33   4.154   0.111   6.491
  648    HA   CYS  33           HA       CYS  33   1.429  -0.488   6.752
  649    HB2  CYS  33           HB2      CYS  33   2.831   1.479   4.976
  650    HB3  CYS  33           HB3      CYS  33   1.110   1.392   5.217
  651    H    GLU  34           H        GLU  34   3.865  -0.971   4.409
  652    HA   GLU  34           HA       GLU  34   2.316  -1.648   2.210
  653    HB2  GLU  34           HB2      GLU  34   4.664  -1.045   2.057
  654    HB3  GLU  34           HB3      GLU  34   5.112  -2.443   2.992
  655    HG2  GLU  34           HG2      GLU  34   3.663  -2.944   0.501
  656    HG3  GLU  34           HG3      GLU  34   5.298  -2.362   0.364
  657    H    ARG  35           H        ARG  35   3.680  -3.581   4.794
  658    HA   ARG  35           HA       ARG  35   2.442  -5.942   3.777
  659    HB2  ARG  35           HB2      ARG  35   3.150  -7.097   5.763
  660    HB3  ARG  35           HB3      ARG  35   4.466  -6.087   5.190
  661    HG2  ARG  35           HG2      ARG  35   3.884  -4.412   6.898
  662    HG3  ARG  35           HG3      ARG  35   2.641  -5.500   7.493
  663    HD2  ARG  35           HD2      ARG  35   5.564  -6.058   7.392
  664    HD3  ARG  35           HD3      ARG  35   4.637  -5.687   8.834
  665    HE   ARG  35           HE       ARG  35   3.352  -7.836   7.952
  666   HH11  ARG  35          HH11      ARG  35   6.775  -7.228   8.338
  667   HH12  ARG  35          HH12      ARG  35   7.183  -8.902   8.558
  668   HH21  ARG  35          HH21      ARG  35   3.872 -10.035   8.261
  669   HH22  ARG  35          HH22      ARG  35   5.523 -10.501   8.526
  670    H    LYS  36           H        LYS  36   1.337  -3.364   5.729
  671    HA   LYS  36           HA       LYS  36  -0.591  -4.688   7.274
  672    HB2  LYS  36           HB2      LYS  36  -0.648  -1.904   6.238
  673    HB3  LYS  36           HB3      LYS  36  -1.659  -2.524   7.510
  674    HG2  LYS  36           HG2      LYS  36   0.494  -2.919   8.774
  675    HG3  LYS  36           HG3      LYS  36   1.267  -2.017   7.556
  676    HD2  LYS  36           HD2      LYS  36   0.666  -0.217   8.492
  677    HD3  LYS  36           HD3      LYS  36  -1.024  -0.647   8.476
  678    HE2  LYS  36           HE2      LYS  36  -0.042  -0.174  10.709
  679    HE3  LYS  36           HE3      LYS  36  -0.816  -1.743  10.573
  680    HZ1  LYS  36           HZ1      LYS  36   2.109  -1.191  10.437
  681    HZ2  LYS  36           HZ2      LYS  36   1.390  -2.718  10.271
  682    HZ3  LYS  36           HZ3      LYS  36   1.288  -1.895  11.742
  683    H    VAL  37           H        VAL  37  -0.532  -3.187   4.180
  684    HA   VAL  37           HA       VAL  37  -3.211  -3.179   3.588
  685    HB   VAL  37           HB       VAL  37  -2.573  -3.046   1.246
  686   HG11  VAL  37          HG11      VAL  37  -2.282  -1.094   2.911
  687   HG12  VAL  37          HG12      VAL  37  -1.520  -0.960   1.329
  688   HG13  VAL  37          HG13      VAL  37  -0.553  -1.414   2.736
  689   HG21  VAL  37          HG21      VAL  37  -0.050  -2.936   0.819
  690   HG22  VAL  37          HG22      VAL  37  -0.871  -4.494   0.864
  691   HG23  VAL  37          HG23      VAL  37   0.064  -3.947   2.266
  692    H    ILE  38           H        ILE  38  -0.792  -5.563   2.886
  693    HA   ILE  38           HA       ILE  38  -2.267  -7.427   1.423
  694    HB   ILE  38           HB       ILE  38  -0.074  -8.176   3.342
  695   HG12  ILE  38          HG12      ILE  38   0.131  -6.585   0.824
  696   HG13  ILE  38          HG13      ILE  38   0.893  -6.299   2.366
  697   HG21  ILE  38          HG21      ILE  38  -1.135 -10.005   2.168
  698   HG22  ILE  38          HG22      ILE  38   0.527  -9.802   1.618
  699   HG23  ILE  38          HG23      ILE  38  -0.805  -9.229   0.622
  700   HD11  ILE  38          HD11      ILE  38   2.345  -8.257   1.969
  701   HD12  ILE  38          HD12      ILE  38   2.553  -6.965   0.789
  702   HD13  ILE  38          HD13      ILE  38   1.636  -8.407   0.361
  703    H    SER  39           H        SER  39  -1.821  -6.752   4.755
  704    HA   SER  39           HA       SER  39  -2.995  -9.159   5.658
  705    HB2  SER  39           HB2      SER  39  -1.303  -7.916   6.985
  706    HB3  SER  39           HB3      SER  39  -2.481  -6.628   7.222
  707    HG   SER  39           HG       SER  39  -3.063  -9.292   7.957
  708    H    THR  40           H        THR  40  -4.112  -6.076   4.729
  709    HA   THR  40           HA       THR  40  -6.603  -6.167   6.177
  710    HB   THR  40           HB       THR  40  -5.666  -4.254   4.032
  711    HG1  THR  40           HG1      THR  40  -4.377  -4.357   6.021
  712   HG21  THR  40          HG21      THR  40  -7.362  -2.741   4.920
  713   HG22  THR  40          HG22      THR  40  -7.872  -3.970   6.078
  714   HG23  THR  40          HG23      THR  40  -8.103  -4.236   4.349
  715    H    SER  41           H        SER  41  -5.579  -6.524   2.779
  716    HA   SER  41           HA       SER  41  -8.327  -6.533   1.888
  717    HB2  SER  41           HB2      SER  41  -7.233  -6.776  -0.372
  718    HB3  SER  41           HB3      SER  41  -6.783  -5.336   0.542
  719    HG   SER  41           HG       SER  41  -4.912  -6.237  -0.242
  720    H    THR  42           H        THR  42  -6.024  -8.952   2.720
  721    HA   THR  42           HA       THR  42  -6.934 -10.908   0.830
  722    HB   THR  42           HB       THR  42  -5.494 -12.472   2.194
  723    HG1  THR  42           HG1      THR  42  -4.229 -10.357   3.435
  724   HG21  THR  42          HG21      THR  42  -3.398 -11.442   1.423
  725   HG22  THR  42          HG22      THR  42  -4.244  -9.913   1.178
  726   HG23  THR  42          HG23      THR  42  -4.663 -11.320   0.199
  727    H    SER  43           H        SER  43  -8.976  -9.820   2.556
  728    HA   SER  43           HA       SER  43 -10.213 -12.337   3.246
  729    HB2  SER  43           HB2      SER  43  -9.100 -11.655   5.362
  730    HB3  SER  43           HB3      SER  43  -9.964 -10.123   5.305
  731    HG   SER  43           HG       SER  43 -11.927 -11.377   5.368
  732    H    ASP  44           H        ASP  44 -10.445 -10.253   1.253
  733    HA   ASP  44           HA       ASP  44 -13.206  -9.411   1.758
  734    HB2  ASP  44           HB2      ASP  44 -11.877  -7.458   2.239
  735    HB3  ASP  44           HB3      ASP  44 -10.963  -7.656   0.748
  736    HA   PRO  45           HA       PRO  45 -13.452 -11.137  -2.366
  737    HB2  PRO  45           HB2      PRO  45 -16.100 -11.499  -2.376
  738    HB3  PRO  45           HB3      PRO  45 -15.077 -12.460  -1.349
  739    HG2  PRO  45           HG2      PRO  45 -16.759 -10.236  -0.655
  740    HG3  PRO  45           HG3      PRO  45 -16.448 -11.682   0.259
  741    HD2  PRO  45           HD2      PRO  45 -15.259  -9.192   0.682
  742    HD3  PRO  45           HD3      PRO  45 -14.666 -10.747   1.285
  743    H    ASP  46           H        ASP  46 -12.970  -8.490  -2.312
  744    HA   ASP  46           HA       ASP  46 -14.633  -6.527  -2.988
  745    HB2  ASP  46           HB2      ASP  46 -12.239  -6.202  -2.969
  746    HB3  ASP  46           HB3      ASP  46 -12.052  -7.203  -4.407
  747    H    TYR  47           H        TYR  47 -13.266  -8.561  -5.592
  748    HA   TYR  47           HA       TYR  47 -15.684  -7.942  -7.128
  749    HB2  TYR  47           HB2      TYR  47 -14.313  -8.355  -9.162
  750    HB3  TYR  47           HB3      TYR  47 -13.777  -6.979  -8.214
  751    HD1  TYR  47           HD1      TYR  47 -11.757  -7.315  -6.680
  752    HD2  TYR  47           HD2      TYR  47 -12.835 -10.067  -9.734
  753    HE1  TYR  47           HE1      TYR  47  -9.470  -8.221  -6.660
  754    HE2  TYR  47           HE2      TYR  47 -10.555 -10.983  -9.719
  755    HH   TYR  47           HH       TYR  47  -8.355 -10.430  -7.287
  756    H    ALA  48           H        ALA  48 -17.018  -9.524  -7.502
  757    HA   ALA  48           HA       ALA  48 -16.079 -12.213  -8.016
  758    HB1  ALA  48           HB1      ALA  48 -17.951 -11.653  -5.712
  759    HB2  ALA  48           HB2      ALA  48 -16.280 -12.199  -5.575
  760    HB3  ALA  48           HB3      ALA  48 -17.493 -13.248  -6.310
  Start of MODEL   16
    1    H1   SER   0           H1       SER   0  -8.140  11.936   7.142
    2    H2   SER   0           H2       SER   0  -7.847  13.555   7.543
    3    H3   SER   0           H3       SER   0  -9.427  13.028   7.259
    4    HA   SER   0           HA       SER   0  -7.701  12.092   9.464
    5    HB2  SER   0           HB2      SER   0  -8.396  14.475   9.694
    6    HB3  SER   0           HB3      SER   0 -10.078  13.975   9.545
    7    HG   SER   0           HG       SER   0  -8.939  14.238  11.750
    8    H    MET   1           H        MET   1  -9.349  11.210  11.228
    9    HA   MET   1           HA       MET   1 -10.716   9.022  10.011
   10    HB2  MET   1           HB2      MET   1 -10.637  10.017  12.857
   11    HB3  MET   1           HB3      MET   1 -11.534   8.588  12.368
   12    HG2  MET   1           HG2      MET   1  -9.461   7.561  11.584
   13    HG3  MET   1           HG3      MET   1  -8.568   8.992  12.087
   14    HE1  MET   1           HE1      MET   1  -7.895   5.981  12.990
   15    HE2  MET   1           HE2      MET   1  -7.500   6.250  14.686
   16    HE3  MET   1           HE3      MET   1  -6.942   7.388  13.462
   17    H    ASP   2           H        ASP   2 -11.878  11.794  11.922
   18    HA   ASP   2           HA       ASP   2 -14.615  11.317  11.285
   19    HB2  ASP   2           HB2      ASP   2 -13.120  13.533  12.627
   20    HB3  ASP   2           HB3      ASP   2 -14.781  13.807  12.111
   21    H    GLU   3           H        GLU   3 -15.995  12.807  10.106
   22    HA   GLU   3           HA       GLU   3 -16.637  13.713   8.136
   23    HB2  GLU   3           HB2      GLU   3 -13.982  15.071   8.486
   24    HB3  GLU   3           HB3      GLU   3 -14.964  15.348   7.056
   25    HG2  GLU   3           HG2      GLU   3 -15.422  17.094   8.576
   26    HG3  GLU   3           HG3      GLU   3 -16.826  16.041   8.561
   27    H    THR   4           H        THR   4 -15.956  11.197   7.910
   28    HA   THR   4           HA       THR   4 -13.875  10.621   6.059
   29    HB   THR   4           HB       THR   4 -16.282   8.881   6.574
   30    HG1  THR   4           HG1      THR   4 -14.036   9.419   8.237
   31   HG21  THR   4          HG21      THR   4 -13.388   8.241   5.990
   32   HG22  THR   4          HG22      THR   4 -14.718   8.140   4.836
   33   HG23  THR   4          HG23      THR   4 -14.678   7.065   6.234
   34    H    VAL   5           H        VAL   5 -13.904  11.159   3.966
   35    HA   VAL   5           HA       VAL   5 -16.157  12.028   2.548
   36    HB   VAL   5           HB       VAL   5 -14.794  11.795   0.508
   37   HG11  VAL   5          HG11      VAL   5 -13.027  13.364   1.158
   38   HG12  VAL   5          HG12      VAL   5 -13.340  13.007   2.856
   39   HG13  VAL   5          HG13      VAL   5 -14.579  13.794   1.876
   40   HG21  VAL   5          HG21      VAL   5 -12.780  10.553   2.365
   41   HG22  VAL   5          HG22      VAL   5 -12.477  11.020   0.691
   42   HG23  VAL   5          HG23      VAL   5 -13.635   9.741   1.058
   43    H    LYS   6           H        LYS   6 -17.303  11.045   0.803
   44    HA   LYS   6           HA       LYS   6 -17.608   8.155   1.250
   45    HB2  LYS   6           HB2      LYS   6 -19.637  10.265   0.565
   46    HB3  LYS   6           HB3      LYS   6 -19.977   8.549   0.470
   47    HG2  LYS   6           HG2      LYS   6 -19.029   9.890   2.963
   48    HG3  LYS   6           HG3      LYS   6 -20.731   9.674   2.566
   49    HD2  LYS   6           HD2      LYS   6 -20.467   7.281   2.543
   50    HD3  LYS   6           HD3      LYS   6 -18.729   7.433   2.766
   51    HE2  LYS   6           HE2      LYS   6 -20.744   8.437   4.737
   52    HE3  LYS   6           HE3      LYS   6 -20.022   6.835   4.823
   53    HZ1  LYS   6           HZ1      LYS   6 -18.536   9.408   4.914
   54    HZ2  LYS   6           HZ2      LYS   6 -17.851   7.862   5.013
   55    HZ3  LYS   6           HZ3      LYS   6 -18.873   8.412   6.241
   56    H    LEU   7           H        LEU   7 -18.580   6.955  -0.559
   57    HA   LEU   7           HA       LEU   7 -18.451   6.089  -2.626
   58    HB2  LEU   7           HB2      LEU   7 -18.480   9.000  -3.354
   59    HB3  LEU   7           HB3      LEU   7 -18.345   7.760  -4.570
   60    HG   LEU   7           HG       LEU   7 -20.504   6.796  -3.663
   61   HD11  LEU   7          HD11      LEU   7 -20.563   9.482  -2.328
   62   HD12  LEU   7          HD12      LEU   7 -20.491   7.913  -1.529
   63   HD13  LEU   7          HD13      LEU   7 -21.925   8.370  -2.447
   64   HD21  LEU   7          HD21      LEU   7 -20.372   8.038  -5.760
   65   HD22  LEU   7          HD22      LEU   7 -20.550   9.555  -4.877
   66   HD23  LEU   7          HD23      LEU   7 -21.873   8.390  -4.903
   67    H    ASN   8           H        ASN   8 -16.459   8.775  -3.696
   68    HA   ASN   8           HA       ASN   8 -14.342   6.846  -4.194
   69    HB2  ASN   8           HB2      ASN   8 -13.337   9.258  -5.064
   70    HB3  ASN   8           HB3      ASN   8 -14.124   8.078  -6.086
   71   HD21  ASN   8          HD21      ASN   8 -14.987   9.487  -7.509
   72   HD22  ASN   8          HD22      ASN   8 -16.199  10.655  -7.111
   73    H    HIS   9           H        HIS   9 -12.585   6.674  -3.024
   74    HA   HIS   9           HA       HIS   9 -11.666   9.026  -1.503
   75    HB2  HIS   9           HB2      HIS   9 -11.009   6.099  -1.144
   76    HB3  HIS   9           HB3      HIS   9 -10.128   7.387  -0.349
   77    HD1  HIS   9           HD1      HIS   9 -10.836   7.657   1.982
   78    HD2  HIS   9           HD2      HIS   9 -13.995   6.474  -0.444
   79    HE1  HIS   9           HE1      HIS   9 -12.817   7.446   3.512
   80    HE2  HIS   9           HE2      HIS   9 -14.756   6.967   1.978
   81    H    THR  10           H        THR  10  -9.612   9.769  -1.987
   82    HA   THR  10           HA       THR  10  -8.761   9.033  -4.655
   83    HB   THR  10           HB       THR  10  -7.642  11.171  -2.806
   84    HG1  THR  10           HG1      THR  10  -8.961  12.372  -4.640
   85   HG21  THR  10          HG21      THR  10  -7.373  10.819  -5.794
   86   HG22  THR  10          HG22      THR  10  -6.106  10.505  -4.609
   87   HG23  THR  10          HG23      THR  10  -6.711  12.145  -4.839
   88    H    CYS  11           H        CYS  11  -7.042   7.887  -5.184
   89    HA   CYS  11           HA       CYS  11  -5.756   6.297  -3.208
   90    HB2  CYS  11           HB2      CYS  11  -6.235   5.750  -5.646
   91    HB3  CYS  11           HB3      CYS  11  -4.856   6.752  -6.035
   92    H    VAL  12           H        VAL  12  -3.965   6.640  -2.082
   93    HA   VAL  12           HA       VAL  12  -2.333   8.936  -2.282
   94    HB   VAL  12           HB       VAL  12  -0.733   7.723  -0.850
   95   HG11  VAL  12          HG11      VAL  12  -3.612   7.399  -0.040
   96   HG12  VAL  12          HG12      VAL  12  -2.569   8.790   0.266
   97   HG13  VAL  12          HG13      VAL  12  -2.235   7.244   1.052
   98   HG21  VAL  12          HG21      VAL  12  -1.253   5.431  -0.100
   99   HG22  VAL  12          HG22      VAL  12  -0.870   5.516  -1.819
  100   HG23  VAL  12          HG23      VAL  12  -2.547   5.356  -1.297
  101    H    ILE  13           H        ILE  13  -2.498   6.109  -4.172
  102    HA   ILE  13           HA       ILE  13   0.311   6.178  -4.904
  103    HB   ILE  13           HB       ILE  13  -1.758   4.270  -5.923
  104   HG12  ILE  13          HG12      ILE  13  -1.646   4.226  -3.448
  105   HG13  ILE  13          HG13      ILE  13  -1.088   2.732  -4.190
  106   HG21  ILE  13          HG21      ILE  13   0.188   2.845  -6.352
  107   HG22  ILE  13          HG22      ILE  13   1.242   4.133  -5.768
  108   HG23  ILE  13          HG23      ILE  13   0.280   4.372  -7.227
  109   HD11  ILE  13          HD11      ILE  13   0.708   4.930  -3.280
  110   HD12  ILE  13          HD12      ILE  13   1.167   3.317  -3.830
  111   HD13  ILE  13          HD13      ILE  13   0.276   3.521  -2.316
  112    H    CYS  14           H        CYS  14  -2.744   5.947  -6.715
  113    HA   CYS  14           HA       CYS  14  -1.341   7.037  -8.987
  114    HB2  CYS  14           HB2      CYS  14  -3.250   6.179 -10.305
  115    HB3  CYS  14           HB3      CYS  14  -2.389   4.938  -9.431
  116    H    ASP  15           H        ASP  15  -2.996   8.229  -6.534
  117    HA   ASP  15           HA       ASP  15  -4.072  10.159  -6.068
  118    HB2  ASP  15           HB2      ASP  15  -2.705  10.954  -8.621
  119    HB3  ASP  15           HB3      ASP  15  -3.530  12.074  -7.553
  120    H    GLN  16           H        GLN  16  -5.565   8.230  -7.484
  121    HA   GLN  16           HA       GLN  16  -7.410   9.856  -9.056
  122    HB2  GLN  16           HB2      GLN  16  -6.946   6.882  -9.065
  123    HB3  GLN  16           HB3      GLN  16  -8.124   7.723 -10.056
  124    HG2  GLN  16           HG2      GLN  16  -5.161   8.038 -10.165
  125    HG3  GLN  16           HG3      GLN  16  -6.147   7.154 -11.306
  126   HE21  GLN  16          HE21      GLN  16  -4.351   9.352 -11.754
  127   HE22  GLN  16          HE22      GLN  16  -5.292  10.599 -12.484
  128    H    GLU  17           H        GLU  17  -9.559   9.762  -8.618
  129    HA   GLU  17           HA       GLU  17 -10.390   9.134  -5.951
  130    HB2  GLU  17           HB2      GLU  17 -11.868  10.176  -8.362
  131    HB3  GLU  17           HB3      GLU  17 -12.648   9.868  -6.818
  132    HG2  GLU  17           HG2      GLU  17 -11.247  11.497  -5.738
  133    HG3  GLU  17           HG3      GLU  17 -10.344  11.735  -7.227
  134    H    LYS  18           H        LYS  18 -10.405   7.063  -5.555
  135    HA   LYS  18           HA       LYS  18 -11.836   5.283  -7.391
  136    HB2  LYS  18           HB2      LYS  18 -10.007   4.327  -5.287
  137    HB3  LYS  18           HB3      LYS  18 -10.470   3.539  -6.760
  138    HG2  LYS  18           HG2      LYS  18  -8.563   5.816  -6.428
  139    HG3  LYS  18           HG3      LYS  18  -8.218   4.187  -7.006
  140    HD2  LYS  18           HD2      LYS  18 -10.166   5.879  -8.459
  141    HD3  LYS  18           HD3      LYS  18  -8.470   6.164  -8.666
  142    HE2  LYS  18           HE2      LYS  18  -9.238   4.741 -10.417
  143    HE3  LYS  18           HE3      LYS  18  -8.202   3.848  -9.331
  144    HZ1  LYS  18           HZ1      LYS  18 -10.163   2.584 -10.005
  145    HZ2  LYS  18           HZ2      LYS  18 -11.159   3.748  -9.294
  146    HZ3  LYS  18           HZ3      LYS  18 -10.123   2.821  -8.332
  147    H    ASN  19           H        ASN  19 -13.498   4.048  -6.669
  148    HA   ASN  19           HA       ASN  19 -14.496   4.861  -4.055
  149    HB2  ASN  19           HB2      ASN  19 -16.660   4.198  -4.786
  150    HB3  ASN  19           HB3      ASN  19 -15.924   5.107  -6.093
  151   HD21  ASN  19          HD21      ASN  19 -15.381   4.099  -7.998
  152   HD22  ASN  19          HD22      ASN  19 -15.943   2.480  -8.396
  153    H    ARG  20           H        ARG  20 -12.688   2.374  -5.237
  154    HA   ARG  20           HA       ARG  20 -13.416   0.794  -2.892
  155    HB2  ARG  20           HB2      ARG  20 -14.449  -0.164  -5.049
  156    HB3  ARG  20           HB3      ARG  20 -12.809  -0.620  -5.455
  157    HG2  ARG  20           HG2      ARG  20 -12.637  -1.985  -3.508
  158    HG3  ARG  20           HG3      ARG  20 -14.187  -1.415  -2.928
  159    HD2  ARG  20           HD2      ARG  20 -15.380  -2.523  -4.546
  160    HD3  ARG  20           HD3      ARG  20 -13.953  -2.734  -5.538
  161    HE   ARG  20           HE       ARG  20 -13.401  -4.113  -3.242
  162   HH11  ARG  20          HH11      ARG  20 -15.903  -4.231  -5.679
  163   HH12  ARG  20          HH12      ARG  20 -16.230  -5.919  -5.457
  164   HH21  ARG  20          HH21      ARG  20 -13.827  -6.347  -2.935
  165   HH22  ARG  20          HH22      ARG  20 -15.050  -7.123  -3.888
  166    H    GLY  21           H        GLY  21 -11.792  -0.194  -1.877
  167    HA2  GLY  21           HA2      GLY  21  -9.329  -1.011  -2.562
  168    HA3  GLY  21           HA3      GLY  21  -9.105   0.730  -2.459
  169    H    ILE  22           H        ILE  22  -7.672   0.341  -0.510
  170    HA   ILE  22           HA       ILE  22  -9.321  -0.358   1.811
  171    HB   ILE  22           HB       ILE  22  -7.608  -1.510   2.811
  172   HG12  ILE  22          HG12      ILE  22  -5.732   0.002   1.031
  173   HG13  ILE  22          HG13      ILE  22  -6.002   0.271   2.713
  174   HG21  ILE  22          HG21      ILE  22  -7.193  -1.902  -0.147
  175   HG22  ILE  22          HG22      ILE  22  -8.216  -2.848   0.938
  176   HG23  ILE  22          HG23      ILE  22  -6.455  -2.931   1.083
  177   HD11  ILE  22          HD11      ILE  22  -3.914  -0.922   2.286
  178   HD12  ILE  22          HD12      ILE  22  -4.841  -2.237   1.560
  179   HD13  ILE  22          HD13      ILE  22  -5.037  -1.857   3.273
  180    H    HIS  23           H        HIS  23  -7.879   0.388   3.798
  181    HA   HIS  23           HA       HIS  23  -6.836   3.027   3.565
  182    HB2  HIS  23           HB2      HIS  23  -8.612   4.092   5.011
  183    HB3  HIS  23           HB3      HIS  23  -9.126   3.712   3.384
  184    HD1  HIS  23           HD1      HIS  23  -9.818   2.957   6.952
  185    HD2  HIS  23           HD2      HIS  23 -10.995   1.659   3.204
  186    HE1  HIS  23           HE1      HIS  23 -11.910   1.616   7.338
  187    HE2  HIS  23           HE2      HIS  23 -12.501   0.686   5.074
  188    H    LEU  24           H        LEU  24  -5.200   2.938   4.932
  189    HA   LEU  24           HA       LEU  24  -5.232   1.025   7.086
  190    HB2  LEU  24           HB2      LEU  24  -3.118   2.824   5.933
  191    HB3  LEU  24           HB3      LEU  24  -2.851   1.771   7.271
  192    HG   LEU  24           HG       LEU  24  -3.629   0.852   4.518
  193   HD11  LEU  24          HD11      LEU  24  -1.348  -0.038   4.423
  194   HD12  LEU  24          HD12      LEU  24  -0.996   0.716   5.978
  195   HD13  LEU  24          HD13      LEU  24  -1.360   1.717   4.575
  196   HD21  LEU  24          HD21      LEU  24  -2.882  -0.685   7.001
  197   HD22  LEU  24          HD22      LEU  24  -3.099  -1.386   5.397
  198   HD23  LEU  24          HD23      LEU  24  -4.468  -0.647   6.227
  199    H    TYR  25           H        TYR  25  -4.125   4.358   6.807
  200    HA   TYR  25           HA       TYR  25  -4.850   4.800   9.583
  201    HB2  TYR  25           HB2      TYR  25  -3.164   6.428   7.721
  202    HB3  TYR  25           HB3      TYR  25  -3.514   6.889   9.372
  203    HD1  TYR  25           HD1      TYR  25  -2.914   3.384   8.514
  204    HD2  TYR  25           HD2      TYR  25  -1.114   6.965   9.924
  205    HE1  TYR  25           HE1      TYR  25  -0.970   2.096   9.247
  206    HE2  TYR  25           HE2      TYR  25   0.837   5.683  10.686
  207    HH   TYR  25           HH       TYR  25   1.464   3.445  11.275
  208    H    THR  26           H        THR  26  -4.674   7.600   7.686
  209    HA   THR  26           HA       THR  26  -7.597   7.673   7.442
  210    HB   THR  26           HB       THR  26  -6.893   9.545   8.705
  211    HG1  THR  26           HG1      THR  26  -7.571  10.044   6.042
  212   HG21  THR  26          HG21      THR  26  -4.816  10.134   6.598
  213   HG22  THR  26          HG22      THR  26  -4.494   9.403   8.170
  214   HG23  THR  26          HG23      THR  26  -5.106  11.056   8.073
  215    H    LYS  27           H        LYS  27  -5.096   6.702   5.698
  216    HA   LYS  27           HA       LYS  27  -5.601   8.237   3.277
  217    HB2  LYS  27           HB2      LYS  27  -3.730   6.095   2.905
  218    HB3  LYS  27           HB3      LYS  27  -3.477   7.825   2.772
  219    HG2  LYS  27           HG2      LYS  27  -3.399   6.262   5.320
  220    HG3  LYS  27           HG3      LYS  27  -1.994   6.750   4.381
  221    HD2  LYS  27           HD2      LYS  27  -4.013   8.597   5.615
  222    HD3  LYS  27           HD3      LYS  27  -2.417   8.267   6.252
  223    HE2  LYS  27           HE2      LYS  27  -2.090   8.984   3.544
  224    HE3  LYS  27           HE3      LYS  27  -3.239  10.127   4.223
  225    HZ1  LYS  27           HZ1      LYS  27  -0.971  10.924   4.445
  226    HZ2  LYS  27           HZ2      LYS  27  -0.543   9.558   5.342
  227    HZ3  LYS  27           HZ3      LYS  27  -1.656  10.663   5.963
  228    H    PHE  28           H        PHE  28  -5.120   6.753   1.301
  229    HA   PHE  28           HA       PHE  28  -6.738   4.352   1.355
  230    HB2  PHE  28           HB2      PHE  28  -8.406   6.023   0.964
  231    HB3  PHE  28           HB3      PHE  28  -7.417   6.815  -0.252
  232    HD1  PHE  28           HD1      PHE  28  -7.449   6.149  -2.485
  233    HD2  PHE  28           HD2      PHE  28  -9.385   3.752   0.443
  234    HE1  PHE  28           HE1      PHE  28  -8.471   4.821  -4.264
  235    HE2  PHE  28           HE2      PHE  28 -10.423   2.406  -1.348
  236    HZ   PHE  28           HZ       PHE  28  -9.954   2.933  -3.720
  237    H    ILE  29           H        ILE  29  -5.246   2.982   0.522
  238    HA   ILE  29           HA       ILE  29  -4.083   3.643  -2.084
  239    HB   ILE  29           HB       ILE  29  -3.969   0.992  -0.612
  240   HG12  ILE  29          HG12      ILE  29  -1.414   1.752  -0.589
  241   HG13  ILE  29          HG13      ILE  29  -2.141   3.353  -0.583
  242   HG21  ILE  29          HG21      ILE  29  -3.821   0.795  -3.040
  243   HG22  ILE  29          HG22      ILE  29  -2.284   0.388  -2.265
  244   HG23  ILE  29          HG23      ILE  29  -2.483   1.951  -3.050
  245   HD11  ILE  29          HD11      ILE  29  -1.582   2.390   1.661
  246   HD12  ILE  29          HD12      ILE  29  -2.873   1.217   1.393
  247   HD13  ILE  29          HD13      ILE  29  -3.246   2.939   1.462
  248    H    CYS  30           H        CYS  30  -5.239   3.235  -3.897
  249    HA   CYS  30           HA       CYS  30  -7.814   2.056  -3.645
  250    HB2  CYS  30           HB2      CYS  30  -8.183   2.556  -5.867
  251    HB3  CYS  30           HB3      CYS  30  -6.989   3.766  -5.425
  252    H    LEU  31           H        LEU  31  -8.551   0.268  -4.723
  253    HA   LEU  31           HA       LEU  31  -7.434  -2.011  -3.776
  254    HB2  LEU  31           HB2      LEU  31  -9.236  -3.060  -4.714
  255    HB3  LEU  31           HB3      LEU  31  -9.802  -1.433  -4.557
  256    HG   LEU  31           HG       LEU  31  -8.894  -1.330  -7.081
  257   HD11  LEU  31          HD11      LEU  31  -9.504  -3.365  -8.268
  258   HD12  LEU  31          HD12      LEU  31  -9.852  -4.168  -6.737
  259   HD13  LEU  31          HD13      LEU  31  -8.203  -3.672  -7.119
  260   HD21  LEU  31          HD21      LEU  31 -11.221  -1.704  -7.787
  261   HD22  LEU  31          HD22      LEU  31 -11.091  -0.650  -6.380
  262   HD23  LEU  31          HD23      LEU  31 -11.584  -2.331  -6.179
  263    H    ASP  32           H        ASP  32  -6.645  -0.403  -6.654
  264    HA   ASP  32           HA       ASP  32  -5.743  -2.745  -8.097
  265    HB2  ASP  32           HB2      ASP  32  -6.761  -0.575  -9.081
  266    HB3  ASP  32           HB3      ASP  32  -5.150   0.065  -8.858
  267    H    CYS  33           H        CYS  33  -4.464   0.072  -6.572
  268    HA   CYS  33           HA       CYS  33  -1.732  -0.572  -6.911
  269    HB2  CYS  33           HB2      CYS  33  -3.022   1.480  -5.133
  270    HB3  CYS  33           HB3      CYS  33  -1.310   1.304  -5.411
  271    H    GLU  34           H        GLU  34  -4.145  -0.957  -4.513
  272    HA   GLU  34           HA       GLU  34  -2.635  -1.715  -2.329
  273    HB2  GLU  34           HB2      GLU  34  -4.958  -1.226  -2.102
  274    HB3  GLU  34           HB3      GLU  34  -5.399  -2.456  -3.237
  275    HG2  GLU  34           HG2      GLU  34  -4.004  -3.537  -0.961
  276    HG3  GLU  34           HG3      GLU  34  -5.459  -2.680  -0.522
  277    H    ARG  35           H        ARG  35  -3.896  -3.623  -4.983
  278    HA   ARG  35           HA       ARG  35  -2.546  -5.968  -4.048
  279    HB2  ARG  35           HB2      ARG  35  -3.079  -6.998  -6.245
  280    HB3  ARG  35           HB3      ARG  35  -4.484  -6.377  -5.396
  281    HG2  ARG  35           HG2      ARG  35  -4.530  -4.434  -6.833
  282    HG3  ARG  35           HG3      ARG  35  -3.070  -4.983  -7.640
  283    HD2  ARG  35           HD2      ARG  35  -5.608  -6.532  -7.566
  284    HD3  ARG  35           HD3      ARG  35  -5.162  -5.459  -8.880
  285    HE   ARG  35           HE       ARG  35  -3.056  -7.233  -8.513
  286   HH11  ARG  35          HH11      ARG  35  -6.422  -7.363  -9.440
  287   HH12  ARG  35          HH12      ARG  35  -6.222  -8.751 -10.459
  288   HH21  ARG  35          HH21      ARG  35  -2.784  -9.069  -9.848
  289   HH22  ARG  35          HH22      ARG  35  -4.154  -9.722 -10.693
  290    H    LYS  36           H        LYS  36  -1.584  -3.276  -5.888
  291    HA   LYS  36           HA       LYS  36   0.384  -4.440  -7.525
  292    HB2  LYS  36           HB2      LYS  36  -0.001  -1.653  -6.467
  293    HB3  LYS  36           HB3      LYS  36   1.265  -2.090  -7.572
  294    HG2  LYS  36           HG2      LYS  36  -0.639  -2.865  -9.088
  295    HG3  LYS  36           HG3      LYS  36  -1.669  -1.995  -8.034
  296    HD2  LYS  36           HD2      LYS  36  -0.629  -0.030  -8.566
  297    HD3  LYS  36           HD3      LYS  36   0.723  -0.794  -9.358
  298    HE2  LYS  36           HE2      LYS  36  -0.847  -1.621 -11.080
  299    HE3  LYS  36           HE3      LYS  36  -2.147  -0.736 -10.288
  300    HZ1  LYS  36           HZ1      LYS  36   0.294   0.480 -11.461
  301    HZ2  LYS  36           HZ2      LYS  36  -0.980   1.325 -10.731
  302    HZ3  LYS  36           HZ3      LYS  36  -1.242   0.478 -12.170
  303    H    VAL  37           H        VAL  37   0.277  -2.940  -4.416
  304    HA   VAL  37           HA       VAL  37   2.943  -2.839  -3.784
  305    HB   VAL  37           HB       VAL  37   2.299  -2.888  -1.442
  306   HG11  VAL  37          HG11      VAL  37   1.048  -0.887  -1.372
  307   HG12  VAL  37          HG12      VAL  37   0.238  -1.261  -2.896
  308   HG13  VAL  37          HG13      VAL  37   1.952  -0.824  -2.886
  309   HG21  VAL  37          HG21      VAL  37  -0.266  -3.886  -2.526
  310   HG22  VAL  37          HG22      VAL  37  -0.242  -2.941  -1.035
  311   HG23  VAL  37          HG23      VAL  37   0.683  -4.439  -1.140
  312    H    ILE  38           H        ILE  38   0.664  -5.404  -3.275
  313    HA   ILE  38           HA       ILE  38   2.263  -7.170  -1.794
  314    HB   ILE  38           HB       ILE  38   0.076  -8.082  -3.639
  315   HG12  ILE  38          HG12      ILE  38  -0.159  -6.457  -1.145
  316   HG13  ILE  38          HG13      ILE  38  -0.975  -6.235  -2.673
  317   HG21  ILE  38          HG21      ILE  38   1.234  -9.825  -2.477
  318   HG22  ILE  38          HG22      ILE  38  -0.379  -9.654  -1.785
  319   HG23  ILE  38          HG23      ILE  38   1.018  -8.996  -0.940
  320   HD11  ILE  38          HD11      ILE  38  -2.326  -7.108  -0.679
  321   HD12  ILE  38          HD12      ILE  38  -1.529  -8.647  -1.008
  322   HD13  ILE  38          HD13      ILE  38  -2.524  -7.890  -2.246
  323    H    SER  39           H        SER  39   1.834  -6.461  -5.096
  324    HA   SER  39           HA       SER  39   3.208  -8.747  -6.045
  325    HB2  SER  39           HB2      SER  39   1.530  -7.544  -7.419
  326    HB3  SER  39           HB3      SER  39   2.631  -6.171  -7.510
  327    HG   SER  39           HG       SER  39   3.560  -8.702  -8.292
  328    H    THR  40           H        THR  40   4.038  -5.534  -5.106
  329    HA   THR  40           HA       THR  40   6.739  -5.616  -6.125
  330    HB   THR  40           HB       THR  40   5.475  -3.657  -4.204
  331    HG1  THR  40           HG1      THR  40   4.398  -3.910  -6.317
  332   HG21  THR  40          HG21      THR  40   7.861  -3.400  -6.035
  333   HG22  THR  40          HG22      THR  40   7.913  -3.530  -4.277
  334   HG23  THR  40          HG23      THR  40   7.186  -2.113  -5.036
  335    H    SER  41           H        SER  41   5.084  -6.219  -3.124
  336    HA   SER  41           HA       SER  41   7.280  -6.010  -1.359
  337    HB2  SER  41           HB2      SER  41   5.760  -7.146   0.258
  338    HB3  SER  41           HB3      SER  41   5.051  -5.733  -0.519
  339    HG   SER  41           HG       SER  41   3.552  -7.353  -0.576
  340    H    THR  42           H        THR  42   6.809  -8.239  -3.687
  341    HA   THR  42           HA       THR  42   7.137 -10.715  -2.370
  342    HB   THR  42           HB       THR  42   7.505 -11.619  -4.623
  343    HG1  THR  42           HG1      THR  42   8.729  -9.851  -5.461
  344   HG21  THR  42          HG21      THR  42   5.324  -9.530  -4.494
  345   HG22  THR  42          HG22      THR  42   5.219 -11.176  -3.867
  346   HG23  THR  42          HG23      THR  42   5.369 -10.904  -5.601
  347    H    SER  43           H        SER  43   9.086  -9.201  -1.285
  348    HA   SER  43           HA       SER  43  11.172  -9.564  -0.488
  349    HB2  SER  43           HB2      SER  43  11.588 -11.381  -2.867
  350    HB3  SER  43           HB3      SER  43  12.728 -11.160  -1.540
  351    HG   SER  43           HG       SER  43  10.170 -12.362  -1.508
  352    H    ASP  44           H        ASP  44  11.716  -7.502  -0.670
  353    HA   ASP  44           HA       ASP  44  13.494  -6.830  -2.903
  354    HB2  ASP  44           HB2      ASP  44  11.334  -5.731  -3.365
  355    HB3  ASP  44           HB3      ASP  44  11.376  -4.981  -1.775
  356    HA   PRO  45           HA       PRO  45  15.533  -5.986   1.100
  357    HB2  PRO  45           HB2      PRO  45  17.967  -6.873  -0.144
  358    HB3  PRO  45           HB3      PRO  45  17.066  -7.660   1.129
  359    HG2  PRO  45           HG2      PRO  45  17.359  -8.614  -1.355
  360    HG3  PRO  45           HG3      PRO  45  16.054  -9.067  -0.274
  361    HD2  PRO  45           HD2      PRO  45  16.024  -7.197  -2.592
  362    HD3  PRO  45           HD3      PRO  45  14.749  -8.271  -1.984
  363    H    ASP  46           H        ASP  46  17.277  -4.550   1.617
  364    HA   ASP  46           HA       ASP  46  17.582  -2.442  -0.391
  365    HB2  ASP  46           HB2      ASP  46  16.760  -1.840   1.880
  366    HB3  ASP  46           HB3      ASP  46  18.281  -2.410   2.558
  367    H    TYR  47           H        TYR  47  19.281  -4.960   1.153
  368    HA   TYR  47           HA       TYR  47  21.770  -4.080  -0.127
  369    HB2  TYR  47           HB2      TYR  47  21.439  -5.683   2.392
  370    HB3  TYR  47           HB3      TYR  47  22.973  -5.354   1.612
  371    HD1  TYR  47           HD1      TYR  47  23.870  -3.043   1.582
  372    HD2  TYR  47           HD2      TYR  47  20.360  -4.054   3.762
  373    HE1  TYR  47           HE1      TYR  47  24.073  -0.957   2.866
  374    HE2  TYR  47           HE2      TYR  47  20.552  -1.972   5.049
  375    HH   TYR  47           HH       TYR  47  22.183  -0.334   5.676
  376    H    ALA  48           H        ALA  48  22.136  -5.271  -1.857
  377    HA   ALA  48           HA       ALA  48  22.354  -7.007  -3.287
  378    HB1  ALA  48           HB1      ALA  48  22.942  -9.184  -2.390
  379    HB2  ALA  48           HB2      ALA  48  22.367  -8.703  -0.794
  380    HB3  ALA  48           HB3      ALA  48  23.773  -7.908  -1.501
  381    H1   SER   0           H1       SER   0   8.225  11.768  -7.435
  382    H2   SER   0           H2       SER   0   7.950  13.390  -7.835
  383    H3   SER   0           H3       SER   0   9.525  12.842  -7.555
  384    HA   SER   0           HA       SER   0   7.779  11.927  -9.755
  385    HB2  SER   0           HB2      SER   0   8.512  14.299  -9.987
  386    HB3  SER   0           HB3      SER   0  10.186  13.771  -9.844
  387    HG   SER   0           HG       SER   0   9.049  14.053 -12.048
  388    H    MET   1           H        MET   1   9.417  11.016 -11.521
  389    HA   MET   1           HA       MET   1  10.747   8.805 -10.297
  390    HB2  MET   1           HB2      MET   1  10.677   9.794 -13.147
  391    HB3  MET   1           HB3      MET   1  11.552   8.350 -12.656
  392    HG2  MET   1           HG2      MET   1   9.465   7.360 -11.860
  393    HG3  MET   1           HG3      MET   1   8.592   8.804 -12.366
  394    HE1  MET   1           HE1      MET   1   7.864   5.802 -13.254
  395    HE2  MET   1           HE2      MET   1   7.471   6.069 -14.952
  396    HE3  MET   1           HE3      MET   1   6.935   7.224 -13.732
  397    H    ASP   2           H        ASP   2  11.948  11.551 -12.225
  398    HA   ASP   2           HA       ASP   2  14.679  11.036 -11.589
  399    HB2  ASP   2           HB2      ASP   2  13.217  13.269 -12.938
  400    HB3  ASP   2           HB3      ASP   2  14.884  13.517 -12.426
  401    H    GLU   3           H        GLU   3  16.083  12.504 -10.419
  402    HA   GLU   3           HA       GLU   3  16.747  13.402  -8.455
  403    HB2  GLU   3           HB2      GLU   3  14.116  14.805  -8.798
  404    HB3  GLU   3           HB3      GLU   3  15.108  15.069  -7.373
  405    HG2  GLU   3           HG2      GLU   3  15.590  16.802  -8.899
  406    HG3  GLU   3           HG3      GLU   3  16.976  15.723  -8.888
  407    H    THR   4           H        THR   4  16.027  10.898  -8.219
  408    HA   THR   4           HA       THR   4  13.943  10.364  -6.360
  409    HB   THR   4           HB       THR   4  16.319   8.581  -6.881
  410    HG1  THR   4           HG1      THR   4  14.074   9.155  -8.532
  411   HG21  THR   4          HG21      THR   4  13.416   7.994  -6.283
  412   HG22  THR   4          HG22      THR   4  14.747   7.874  -5.133
  413   HG23  THR   4          HG23      THR   4  14.685   6.792  -6.525
  414    H    VAL   5           H        VAL   5  13.989  10.918  -4.272
  415    HA   VAL   5           HA       VAL   5  16.259  11.748  -2.862
  416    HB   VAL   5           HB       VAL   5  14.897  11.541  -0.818
  417   HG11  VAL   5          HG11      VAL   5  13.155  13.137  -1.465
  418   HG12  VAL   5          HG12      VAL   5  13.458  12.771  -3.162
  419   HG13  VAL   5          HG13      VAL   5  14.712  13.539  -2.189
  420   HG21  VAL   5          HG21      VAL   5  12.859  10.328  -2.665
  421   HG22  VAL   5          HG22      VAL   5  12.568  10.803  -0.992
  422   HG23  VAL   5          HG23      VAL   5  13.703   9.503  -1.358
  423    H    LYS   6           H        LYS   6  17.397  10.752  -1.116
  424    HA   LYS   6           HA       LYS   6  17.653   7.859  -1.553
  425    HB2  LYS   6           HB2      LYS   6  19.708   9.930  -0.880
  426    HB3  LYS   6           HB3      LYS   6  20.028   8.208  -0.771
  427    HG2  LYS   6           HG2      LYS   6  19.095   9.562  -3.286
  428    HG3  LYS   6           HG3      LYS   6  20.795   9.316  -2.882
  429    HD2  LYS   6           HD2      LYS   6  20.495   6.928  -2.854
  430    HD3  LYS   6           HD3      LYS   6  18.758   7.105  -3.069
  431    HE2  LYS   6           HE2      LYS   6  20.780   8.070  -5.053
  432    HE3  LYS   6           HE3      LYS   6  20.026   6.484  -5.132
  433    HZ1  LYS   6           HZ1      LYS   6  18.586   9.083  -5.217
  434    HZ2  LYS   6           HZ2      LYS   6  17.876   7.548  -5.313
  435    HZ3  LYS   6           HZ3      LYS   6  18.898   8.081  -6.547
  436    H    LEU   7           H        LEU   7  18.603   6.644   0.255
  437    HA   LEU   7           HA       LEU   7  18.468   5.784   2.325
  438    HB2  LEU   7           HB2      LEU   7  18.550   8.695   3.046
  439    HB3  LEU   7           HB3      LEU   7  18.397   7.463   4.266
  440    HG   LEU   7           HG       LEU   7  20.538   6.457   3.353
  441   HD11  LEU   7          HD11      LEU   7  20.635   9.138   2.012
  442   HD12  LEU   7          HD12      LEU   7  20.539   7.569   1.217
  443   HD13  LEU   7          HD13      LEU   7  21.982   8.008   2.131
  444   HD21  LEU   7          HD21      LEU   7  20.435   7.707   5.446
  445   HD22  LEU   7          HD22      LEU   7  20.634   9.218   4.559
  446   HD23  LEU   7          HD23      LEU   7  21.938   8.031   4.583
  447    H    ASN   8           H        ASN   8  16.526   8.506   3.397
  448    HA   ASN   8           HA       ASN   8  14.377   6.614   3.903
  449    HB2  ASN   8           HB2      ASN   8  13.414   9.044   4.772
  450    HB3  ASN   8           HB3      ASN   8  14.186   7.854   5.793
  451   HD21  ASN   8          HD21      ASN   8  15.081   9.256   7.210
  452   HD22  ASN   8          HD22      ASN   8  16.308  10.403   6.800
  453    H    HIS   9           H        HIS   9  12.619   6.466   2.734
  454    HA   HIS   9           HA       HIS   9  11.729   8.830   1.215
  455    HB2  HIS   9           HB2      HIS   9  11.024   5.911   0.867
  456    HB3  HIS   9           HB3      HIS   9  10.163   7.212   0.071
  457    HD1  HIS   9           HD1      HIS   9  10.866   7.465  -2.269
  458    HD2  HIS   9           HD2      HIS   9  14.013   6.232   0.154
  459    HE1  HIS   9           HE1      HIS   9  12.842   7.217  -3.802
  460    HE2  HIS   9           HE2      HIS   9  14.778   6.698  -2.272
  461    H    THR  10           H        THR  10   9.684   9.603   1.699
  462    HA   THR  10           HA       THR  10   8.834   8.893   4.375
  463    HB   THR  10           HB       THR  10   7.749  11.045   2.523
  464    HG1  THR  10           HG1      THR  10   9.091  12.231   4.348
  465   HG21  THR  10          HG21      THR  10   7.479  10.707   5.515
  466   HG22  THR  10          HG22      THR  10   6.205  10.411   4.331
  467   HG23  THR  10          HG23      THR  10   6.838  12.042   4.556
  468    H    CYS  11           H        CYS  11   7.102   7.775   4.908
  469    HA   CYS  11           HA       CYS  11   5.782   6.201   2.943
  470    HB2  CYS  11           HB2      CYS  11   6.257   5.655   5.381
  471    HB3  CYS  11           HB3      CYS  11   4.897   6.681   5.770
  472    H    VAL  12           H        VAL  12   3.990   6.569   1.824
  473    HA   VAL  12           HA       VAL  12   2.402   8.894   2.021
  474    HB   VAL  12           HB       VAL  12   0.776   7.705   0.596
  475   HG11  VAL  12          HG11      VAL  12   3.649   7.333  -0.221
  476   HG12  VAL  12          HG12      VAL  12   2.627   8.738  -0.527
  477   HG13  VAL  12          HG13      VAL  12   2.268   7.198  -1.310
  478   HG21  VAL  12          HG21      VAL  12   1.256   5.402  -0.150
  479   HG22  VAL  12          HG22      VAL  12   0.879   5.498   1.570
  480   HG23  VAL  12          HG23      VAL  12   2.551   5.311   1.044
  481    H    ILE  13           H        ILE  13   2.521   6.070   3.921
  482    HA   ILE  13           HA       ILE  13  -0.287   6.189   4.659
  483    HB   ILE  13           HB       ILE  13   1.758   4.252   5.677
  484   HG12  ILE  13          HG12      ILE  13   1.639   4.201   3.203
  485   HG13  ILE  13          HG13      ILE  13   1.058   2.718   3.950
  486   HG21  ILE  13          HG21      ILE  13  -0.209   2.858   6.118
  487   HG22  ILE  13          HG22      ILE  13  -1.245   4.159   5.534
  488   HG23  ILE  13          HG23      ILE  13  -0.273   4.390   6.988
  489   HD11  ILE  13          HD11      ILE  13  -0.705   4.942   3.036
  490   HD12  ILE  13          HD12      ILE  13  -1.189   3.340   3.594
  491   HD13  ILE  13          HD13      ILE  13  -0.298   3.524   2.077
  492    H    CYS  14           H        CYS  14   2.766   5.909   6.467
  493    HA   CYS  14           HA       CYS  14   1.392   7.032   8.737
  494    HB2  CYS  14           HB2      CYS  14   3.291   6.146  10.054
  495    HB3  CYS  14           HB3      CYS  14   2.408   4.918   9.182
  496    H    ASP  15           H        ASP  15   3.061   8.186   6.272
  497    HA   ASP  15           HA       ASP  15   4.166  10.099   5.796
  498    HB2  ASP  15           HB2      ASP  15   2.815  10.917   8.348
  499    HB3  ASP  15           HB3      ASP  15   3.662  12.023   7.285
  500    H    GLN  16           H        GLN  16   5.632   8.149   7.219
  501    HA   GLN  16           HA       GLN  16   7.509   9.753   8.776
  502    HB2  GLN  16           HB2      GLN  16   6.997   6.785   8.796
  503    HB3  GLN  16           HB3      GLN  16   8.191   7.610   9.782
  504    HG2  GLN  16           HG2      GLN  16   5.236   7.977   9.897
  505    HG3  GLN  16           HG3      GLN  16   6.210   7.076  11.036
  506   HE21  GLN  16          HE21      GLN  16   4.454   9.306  11.482
  507   HE22  GLN  16          HE22      GLN  16   5.420  10.533  12.214
  508    H    GLU  17           H        GLU  17   9.656   9.617   8.333
  509    HA   GLU  17           HA       GLU  17  10.469   8.971   5.663
  510    HB2  GLU  17           HB2      GLU  17  11.970   9.995   8.070
  511    HB3  GLU  17           HB3      GLU  17  12.741   9.673   6.522
  512    HG2  GLU  17           HG2      GLU  17  11.365  11.323   5.445
  513    HG3  GLU  17           HG3      GLU  17  10.464  11.573   6.933
  514    H    LYS  18           H        LYS  18  10.449   6.897   5.275
  515    HA   LYS  18           HA       LYS  18  11.856   5.098   7.116
  516    HB2  LYS  18           HB2      LYS  18  10.007   4.169   5.016
  517    HB3  LYS  18           HB3      LYS  18  10.459   3.378   6.490
  518    HG2  LYS  18           HG2      LYS  18   8.589   5.685   6.158
  519    HG3  LYS  18           HG3      LYS  18   8.219   4.064   6.742
  520    HD2  LYS  18           HD2      LYS  18  10.199   5.727   8.187
  521    HD3  LYS  18           HD3      LYS  18   8.509   6.043   8.395
  522    HE2  LYS  18           HE2      LYS  18   9.255   4.611  10.149
  523    HE3  LYS  18           HE3      LYS  18   8.201   3.733   9.070
  524    HZ1  LYS  18           HZ1      LYS  18  10.144   2.437   9.737
  525    HZ2  LYS  18           HZ2      LYS  18  11.155   3.586   9.023
  526    HZ3  LYS  18           HZ3      LYS  18  10.102   2.676   8.067
  527    H    ASN  19           H        ASN  19  13.495   3.833   6.387
  528    HA   ASN  19           HA       ASN  19  14.500   4.628   3.770
  529    HB2  ASN  19           HB2      ASN  19  16.656   3.932   4.496
  530    HB3  ASN  19           HB3      ASN  19  15.938   4.854   5.804
  531   HD21  ASN  19          HD21      ASN  19  15.391   3.858   7.715
  532   HD22  ASN  19          HD22      ASN  19  15.921   2.227   8.107
  533    H    ARG  20           H        ARG  20  12.657   2.175   4.966
  534    HA   ARG  20           HA       ARG  20  13.347   0.575   2.623
  535    HB2  ARG  20           HB2      ARG  20  14.373  -0.394   4.779
  536    HB3  ARG  20           HB3      ARG  20  12.727  -0.825   5.193
  537    HG2  ARG  20           HG2      ARG  20  12.526  -2.189   3.244
  538    HG3  ARG  20           HG3      ARG  20  14.085  -1.644   2.663
  539    HD2  ARG  20           HD2      ARG  20  15.262  -2.771   4.280
  540    HD3  ARG  20           HD3      ARG  20  13.833  -2.953   5.274
  541    HE   ARG  20           HE       ARG  20  13.257  -4.333   2.984
  542   HH11  ARG  20          HH11      ARG  20  15.761  -4.472   5.418
  543   HH12  ARG  20          HH12      ARG  20  16.058  -6.167   5.204
  544   HH21  ARG  20          HH21      ARG  20  13.648  -6.572   2.681
  545   HH22  ARG  20          HH22      ARG  20  14.862  -7.362   3.638
  546    H    GLY  21           H        GLY  21  11.703  -0.385   1.618
  547    HA2  GLY  21           HA2      GLY  21   9.230  -1.165   2.312
  548    HA3  GLY  21           HA3      GLY  21   9.032   0.578   2.205
  549    H    ILE  22           H        ILE  22   7.591   0.208   0.259
  550    HA   ILE  22           HA       ILE  22   9.222  -0.525  -2.064
  551    HB   ILE  22           HB       ILE  22   7.487  -1.650  -3.058
  552   HG12  ILE  22          HG12      ILE  22   5.642  -0.103  -1.275
  553   HG13  ILE  22          HG13      ILE  22   5.912   0.156  -2.959
  554   HG21  ILE  22          HG21      ILE  22   7.075  -2.029  -0.096
  555   HG22  ILE  22          HG22      ILE  22   8.078  -2.994  -1.183
  556   HG23  ILE  22          HG23      ILE  22   6.317  -3.048  -1.321
  557   HD11  ILE  22          HD11      ILE  22   3.808  -1.001  -2.520
  558   HD12  ILE  22          HD12      ILE  22   4.714  -2.328  -1.795
  559   HD13  ILE  22          HD13      ILE  22   4.912  -1.954  -3.509
  560    H    HIS  23           H        HIS  23   7.784   0.237  -4.050
  561    HA   HIS  23           HA       HIS  23   6.791   2.894  -3.821
  562    HB2  HIS  23           HB2      HIS  23   8.581   3.924  -5.274
  563    HB3  HIS  23           HB3      HIS  23   9.092   3.540  -3.648
  564    HD1  HIS  23           HD1      HIS  23   9.769   2.770  -7.213
  565    HD2  HIS  23           HD2      HIS  23  10.926   1.453  -3.466
  566    HE1  HIS  23           HE1      HIS  23  11.831   1.390  -7.603
  567    HE2  HIS  23           HE2      HIS  23  12.407   0.446  -5.340
  568    H    LEU  24           H        LEU  24   5.148   2.828  -5.182
  569    HA   LEU  24           HA       LEU  24   5.143   0.910  -7.331
  570    HB2  LEU  24           HB2      LEU  24   3.060   2.746  -6.176
  571    HB3  LEU  24           HB3      LEU  24   2.773   1.696  -7.511
  572    HG   LEU  24           HG       LEU  24   3.544   0.770  -4.760
  573   HD11  LEU  24          HD11      LEU  24   1.248  -0.082  -4.656
  574   HD12  LEU  24          HD12      LEU  24   0.904   0.673  -6.210
  575   HD13  LEU  24          HD13      LEU  24   1.289   1.672  -4.811
  576   HD21  LEU  24          HD21      LEU  24   2.773  -0.761  -7.238
  577   HD22  LEU  24          HD22      LEU  24   2.976  -1.461  -5.633
  578   HD23  LEU  24          HD23      LEU  24   4.357  -0.745  -6.463
  579    H    TYR  25           H        TYR  25   4.088   4.260  -7.063
  580    HA   TYR  25           HA       TYR  25   4.815   4.682  -9.842
  581    HB2  TYR  25           HB2      TYR  25   3.162   6.343  -7.978
  582    HB3  TYR  25           HB3      TYR  25   3.514   6.794  -9.631
  583    HD1  TYR  25           HD1      TYR  25   2.859   3.302  -8.762
  584    HD2  TYR  25           HD2      TYR  25   1.116   6.906 -10.180
  585    HE1  TYR  25           HE1      TYR  25   0.893   2.046  -9.481
  586    HE2  TYR  25           HE2      TYR  25  -0.859   5.654 -10.929
  587    HH   TYR  25           HH       TYR  25  -1.517   3.413 -11.517
  588    H    THR  26           H        THR  26   4.691   7.490  -7.950
  589    HA   THR  26           HA       THR  26   7.615   7.520  -7.714
  590    HB   THR  26           HB       THR  26   6.939   9.403  -8.975
  591    HG1  THR  26           HG1      THR  26   7.646   9.880  -6.323
  592   HG21  THR  26          HG21      THR  26   4.871  10.027  -6.870
  593   HG22  THR  26          HG22      THR  26   4.536   9.294  -8.439
  594   HG23  THR  26          HG23      THR  26   5.173  10.939  -8.348
  595    H    LYS  27           H        LYS  27   5.103   6.594  -5.961
  596    HA   LYS  27           HA       LYS  27   5.640   8.127  -3.544
  597    HB2  LYS  27           HB2      LYS  27   3.737   6.018  -3.162
  598    HB3  LYS  27           HB3      LYS  27   3.512   7.752  -3.033
  599    HG2  LYS  27           HG2      LYS  27   3.401   6.180  -5.576
  600    HG3  LYS  27           HG3      LYS  27   2.011   6.694  -4.634
  601    HD2  LYS  27           HD2      LYS  27   4.049   8.504  -5.883
  602    HD3  LYS  27           HD3      LYS  27   2.443   8.196  -6.512
  603    HE2  LYS  27           HE2      LYS  27   2.141   8.926  -3.808
  604    HE3  LYS  27           HE3      LYS  27   3.306  10.050  -4.495
  605    HZ1  LYS  27           HZ1      LYS  27   1.049  10.882  -4.706
  606    HZ2  LYS  27           HZ2      LYS  27   0.597   9.522  -5.600
  607    HZ3  LYS  27           HZ3      LYS  27   1.725  10.608  -6.227
  608    H    PHE  28           H        PHE  28   5.139   6.653  -1.563
  609    HA   PHE  28           HA       PHE  28   6.718   4.227  -1.616
  610    HB2  PHE  28           HB2      PHE  28   8.415   5.871  -1.236
  611    HB3  PHE  28           HB3      PHE  28   7.443   6.682  -0.018
  612    HD1  PHE  28           HD1      PHE  28   7.470   6.024   2.216
  613    HD2  PHE  28           HD2      PHE  28   9.358   3.586  -0.709
  614    HE1  PHE  28           HE1      PHE  28   8.476   4.686   3.998
  615    HE2  PHE  28           HE2      PHE  28  10.380   2.230   1.083
  616    HZ   PHE  28           HZ       PHE  28   9.926   2.773   3.455
  617    H    ILE  29           H        ILE  29   5.208   2.883  -0.774
  618    HA   ILE  29           HA       ILE  29   4.062   3.572   1.832
  619    HB   ILE  29           HB       ILE  29   3.899   0.921   0.369
  620   HG12  ILE  29          HG12      ILE  29   1.357   1.724   0.352
  621   HG13  ILE  29          HG13      ILE  29   2.112   3.311   0.338
  622   HG21  ILE  29          HG21      ILE  29   3.754   0.734   2.798
  623   HG22  ILE  29          HG22      ILE  29   2.207   0.348   2.027
  624   HG23  ILE  29          HG23      ILE  29   2.436   1.911   2.807
  625   HD11  ILE  29          HD11      ILE  29   1.532   2.346  -1.901
  626   HD12  ILE  29          HD12      ILE  29   2.804   1.157  -1.631
  627   HD13  ILE  29          HD13      ILE  29   3.203   2.873  -1.709
  628    H    CYS  30           H        CYS  30   5.218   3.152   3.645
  629    HA   CYS  30           HA       CYS  30   7.770   1.929   3.388
  630    HB2  CYS  30           HB2      CYS  30   8.154   2.433   5.606
  631    HB3  CYS  30           HB3      CYS  30   6.978   3.659   5.163
  632    H    LEU  31           H        LEU  31   8.481   0.133   4.464
  633    HA   LEU  31           HA       LEU  31   7.326  -2.130   3.532
  634    HB2  LEU  31           HB2      LEU  31   9.115  -3.205   4.468
  635    HB3  LEU  31           HB3      LEU  31   9.705  -1.587   4.305
  636    HG   LEU  31           HG       LEU  31   8.805  -1.462   6.830
  637   HD11  LEU  31          HD11      LEU  31   9.387  -3.503   8.022
  638   HD12  LEU  31          HD12      LEU  31   9.716  -4.317   6.492
  639   HD13  LEU  31          HD13      LEU  31   8.076  -3.793   6.878
  640   HD21  LEU  31          HD21      LEU  31  11.127  -1.871   7.534
  641   HD22  LEU  31          HD22      LEU  31  11.010  -0.819   6.125
  642   HD23  LEU  31          HD23      LEU  31  11.476  -2.509   5.927
  643    H    ASP  32           H        ASP  32   6.567  -0.502   6.407
  644    HA   ASP  32           HA       ASP  32   5.632  -2.827   7.855
  645    HB2  ASP  32           HB2      ASP  32   6.701  -0.682   8.847
  646    HB3  ASP  32           HB3      ASP  32   5.097  -0.008   8.626
  647    H    CYS  33           H        CYS  33   4.390   0.011   6.319
  648    HA   CYS  33           HA       CYS  33   1.652  -0.589   6.680
  649    HB2  CYS  33           HB2      CYS  33   2.971   1.436   4.892
  650    HB3  CYS  33           HB3      CYS  33   1.260   1.290   5.178
  651    H    GLU  34           H        GLU  34   4.055  -1.021   4.278
  652    HA   GLU  34           HA       GLU  34   2.526  -1.761   2.098
  653    HB2  GLU  34           HB2      GLU  34   4.855  -1.309   1.863
  654    HB3  GLU  34           HB3      GLU  34   5.281  -2.542   3.003
  655    HG2  GLU  34           HG2      GLU  34   3.863  -3.608   0.732
  656    HG3  GLU  34           HG3      GLU  34   5.336  -2.780   0.291
  657    H    ARG  35           H        ARG  35   3.767  -3.681   4.755
  658    HA   ARG  35           HA       ARG  35   2.375  -6.006   3.832
  659    HB2  ARG  35           HB2      ARG  35   2.900  -7.037   6.029
  660    HB3  ARG  35           HB3      ARG  35   4.312  -6.439   5.174
  661    HG2  ARG  35           HG2      ARG  35   4.391  -4.495   6.605
  662    HG3  ARG  35           HG3      ARG  35   2.925  -5.015   7.416
  663    HD2  ARG  35           HD2      ARG  35   5.435  -6.606   7.340
  664    HD3  ARG  35           HD3      ARG  35   5.009  -5.526   8.654
  665    HE   ARG  35           HE       ARG  35   2.877  -7.267   8.291
  666   HH11  ARG  35          HH11      ARG  35   6.244  -7.445   9.208
  667   HH12  ARG  35          HH12      ARG  35   6.029  -8.827  10.234
  668   HH21  ARG  35          HH21      ARG  35   2.575  -9.095   9.638
  669   HH22  ARG  35          HH22      ARG  35   3.936  -9.768  10.476
  670    H    LYS  36           H        LYS  36   1.461  -3.291   5.664
  671    HA   LYS  36           HA       LYS  36  -0.520  -4.417   7.312
  672    HB2  LYS  36           HB2      LYS  36  -0.093  -1.641   6.243
  673    HB3  LYS  36           HB3      LYS  36  -1.364  -2.055   7.352
  674    HG2  LYS  36           HG2      LYS  36   0.530  -2.857   8.867
  675    HG3  LYS  36           HG3      LYS  36   1.573  -2.007   7.809
  676    HD2  LYS  36           HD2      LYS  36   0.557  -0.022   8.332
  677    HD3  LYS  36           HD3      LYS  36  -0.797  -0.765   9.136
  678    HE2  LYS  36           HE2      LYS  36   0.763  -1.604  10.853
  679    HE3  LYS  36           HE3      LYS  36   2.079  -0.749  10.055
  680    HZ1  LYS  36           HZ1      LYS  36  -0.339   0.512  11.228
  681    HZ2  LYS  36           HZ2      LYS  36   0.945   1.333  10.490
  682    HZ3  LYS  36           HZ3      LYS  36   1.197   0.487  11.933
  683    H    VAL  37           H        VAL  37  -0.399  -2.932   4.197
  684    HA   VAL  37           HA       VAL  37  -3.067  -2.787   3.572
  685    HB   VAL  37           HB       VAL  37  -2.429  -2.856   1.229
  686   HG11  VAL  37          HG11      VAL  37  -1.148  -0.874   1.148
  687   HG12  VAL  37          HG12      VAL  37  -0.338  -1.257   2.670
  688   HG13  VAL  37          HG13      VAL  37  -2.045  -0.793   2.665
  689   HG21  VAL  37          HG21      VAL  37   0.124  -3.892   2.310
  690   HG22  VAL  37          HG22      VAL  37   0.110  -2.951   0.816
  691   HG23  VAL  37          HG23      VAL  37  -0.840  -4.433   0.927
  692    H    ILE  38           H        ILE  38  -0.831  -5.392   3.063
  693    HA   ILE  38           HA       ILE  38  -2.462  -7.134   1.593
  694    HB   ILE  38           HB       ILE  38  -0.286  -8.075   3.433
  695   HG12  ILE  38          HG12      ILE  38  -0.028  -6.464   0.935
  696   HG13  ILE  38          HG13      ILE  38   0.794  -6.249   2.461
  697   HG21  ILE  38          HG21      ILE  38  -1.471  -9.804   2.280
  698   HG22  ILE  38          HG22      ILE  38   0.142  -9.660   1.584
  699   HG23  ILE  38          HG23      ILE  38  -1.247  -8.983   0.739
  700   HD11  ILE  38          HD11      ILE  38   2.125  -7.150   0.466
  701   HD12  ILE  38          HD12      ILE  38   1.306  -8.676   0.803
  702   HD13  ILE  38          HD13      ILE  38   2.316  -7.929   2.035
  703    H    SER  39           H        SER  39  -2.012  -6.425   4.892
  704    HA   SER  39           HA       SER  39  -3.420  -8.687   5.849
  705    HB2  SER  39           HB2      SER  39  -1.716  -7.505   7.213
  706    HB3  SER  39           HB3      SER  39  -2.796  -6.116   7.307
  707    HG   SER  39           HG       SER  39  -3.777  -8.618   8.096
  708    H    THR  40           H        THR  40  -4.200  -5.462   4.905
  709    HA   THR  40           HA       THR  40  -6.898  -5.495   5.932
  710    HB   THR  40           HB       THR  40  -5.606  -3.563   4.005
  711    HG1  THR  40           HG1      THR  40  -4.526  -3.824   6.105
  712   HG21  THR  40          HG21      THR  40  -7.982  -3.260   5.841
  713   HG22  THR  40          HG22      THR  40  -8.044  -3.398   4.083
  714   HG23  THR  40          HG23      THR  40  -7.289  -1.990   4.833
  715    H    SER  41           H        SER  41  -5.262  -6.136   2.931
  716    HA   SER  41           HA       SER  41  -7.458  -5.894   1.172
  717    HB2  SER  41           HB2      SER  41  -5.964  -7.058  -0.448
  718    HB3  SER  41           HB3      SER  41  -5.227  -5.656   0.324
  719    HG   SER  41           HG       SER  41  -3.759  -7.307   0.372
  720    H    THR  42           H        THR  42  -7.017  -8.123   3.507
  721    HA   THR  42           HA       THR  42  -7.389 -10.599   2.199
  722    HB   THR  42           HB       THR  42  -7.766 -11.490   4.459
  723    HG1  THR  42           HG1      THR  42  -8.958  -9.699   5.304
  724   HG21  THR  42          HG21      THR  42  -5.552  -9.436   4.311
  725   HG22  THR  42          HG22      THR  42  -5.477 -11.087   3.690
  726   HG23  THR  42          HG23      THR  42  -5.614 -10.804   5.424
  727    H    SER  43           H        SER  43  -9.317  -9.061   1.112
  728    HA   SER  43           HA       SER  43 -11.412  -9.392   0.323
  729    HB2  SER  43           HB2      SER  43 -11.852 -11.193   2.712
  730    HB3  SER  43           HB3      SER  43 -12.991 -10.959   1.389
  731    HG   SER  43           HG       SER  43 -10.451 -12.200   1.354
  732    H    ASP  44           H        ASP  44 -11.914  -7.316   0.499
  733    HA   ASP  44           HA       ASP  44 -13.680  -6.610   2.732
  734    HB2  ASP  44           HB2      ASP  44 -11.502  -5.540   3.187
  735    HB3  ASP  44           HB3      ASP  44 -11.539  -4.793   1.594
  736    HA   PRO  45           HA       PRO  45 -15.720  -5.733  -1.261
  737    HB2  PRO  45           HB2      PRO  45 -18.147  -6.622  -0.033
  738    HB3  PRO  45           HB3      PRO  45 -17.249  -7.397  -1.304
  739    HG2  PRO  45           HG2      PRO  45 -17.589  -8.325   1.244
  740    HG3  PRO  45           HG3      PRO  45 -16.332  -8.777   0.132
  741    HD2  PRO  45           HD2      PRO  45 -16.202  -6.950   2.426
  742    HD3  PRO  45           HD3      PRO  45 -14.955  -8.043   1.810
  743    H    ASP  46           H        ASP  46 -17.428  -4.270  -1.783
  744    HA   ASP  46           HA       ASP  46 -17.706  -2.160   0.221
  745    HB2  ASP  46           HB2      ASP  46 -16.883  -1.576  -2.052
  746    HB3  ASP  46           HB3      ASP  46 -18.415  -2.126  -2.723
  747    H    TYR  47           H        TYR  47 -19.450  -4.655  -1.309
  748    HA   TYR  47           HA       TYR  47 -21.922  -3.732  -0.027
  749    HB2  TYR  47           HB2      TYR  47 -21.622  -5.347  -2.543
  750    HB3  TYR  47           HB3      TYR  47 -23.148  -4.992  -1.760
  751    HD1  TYR  47           HD1      TYR  47 -24.010  -2.668  -1.733
  752    HD2  TYR  47           HD2      TYR  47 -20.522  -3.735  -3.918
  753    HE1  TYR  47           HE1      TYR  47 -24.183  -0.580  -3.020
  754    HE2  TYR  47           HE2      TYR  47 -20.683  -1.652  -5.210
  755    HH   TYR  47           HH       TYR  47 -22.317   0.006  -5.840
  756    H    ALA  48           H        ALA  48 -22.299  -4.915   1.708
  757    HA   ALA  48           HA       ALA  48 -22.540  -6.642   3.144
  758    HB1  ALA  48           HB1      ALA  48 -23.163  -8.810   2.256
  759    HB2  ALA  48           HB2      ALA  48 -22.584  -8.343   0.657
  760    HB3  ALA  48           HB3      ALA  48 -23.975  -7.523   1.364
  Start of MODEL   17
    1    H1   SER   0           H1       SER   0  -5.591  14.327  -9.831
    2    H2   SER   0           H2       SER   0  -5.492  13.240  -8.543
    3    H3   SER   0           H3       SER   0  -4.316  13.213  -9.755
    4    HA   SER   0           HA       SER   0  -3.423  14.257  -7.823
    5    HB2  SER   0           HB2      SER   0  -2.826  15.123 -10.104
    6    HB3  SER   0           HB3      SER   0  -4.078  16.349  -9.917
    7    HG   SER   0           HG       SER   0  -1.604  16.096  -8.624
    8    H    MET   1           H        MET   1  -3.622  15.636  -6.100
    9    HA   MET   1           HA       MET   1  -4.604  16.887  -4.494
   10    HB2  MET   1           HB2      MET   1  -6.299  17.892  -6.782
   11    HB3  MET   1           HB3      MET   1  -6.365  18.544  -5.151
   12    HG2  MET   1           HG2      MET   1  -4.032  19.211  -5.305
   13    HG3  MET   1           HG3      MET   1  -3.935  18.523  -6.926
   14    HE1  MET   1           HE1      MET   1  -3.095  21.509  -6.175
   15    HE2  MET   1           HE2      MET   1  -3.774  22.403  -7.535
   16    HE3  MET   1           HE3      MET   1  -2.970  20.859  -7.810
   17    H    ASP   2           H        ASP   2  -5.445  15.419  -3.165
   18    HA   ASP   2           HA       ASP   2  -7.769  13.891  -3.635
   19    HB2  ASP   2           HB2      ASP   2  -7.705  13.458  -1.179
   20    HB3  ASP   2           HB3      ASP   2  -6.162  13.177  -1.973
   21    H    GLU   3           H        GLU   3  -9.768  14.622  -3.841
   22    HA   GLU   3           HA       GLU   3 -10.573  16.965  -2.257
   23    HB2  GLU   3           HB2      GLU   3 -10.003  17.540  -4.637
   24    HB3  GLU   3           HB3      GLU   3 -11.374  16.548  -5.122
   25    HG2  GLU   3           HG2      GLU   3 -12.001  18.864  -5.048
   26    HG3  GLU   3           HG3      GLU   3 -12.862  17.971  -3.803
   27    H    THR   4           H        THR   4 -12.008  14.630  -4.553
   28    HA   THR   4           HA       THR   4 -14.524  14.779  -3.162
   29    HB   THR   4           HB       THR   4 -13.888  12.830  -5.363
   30    HG1  THR   4           HG1      THR   4 -13.148  14.695  -6.249
   31   HG21  THR   4          HG21      THR   4 -16.113  12.732  -4.308
   32   HG22  THR   4          HG22      THR   4 -16.207  13.237  -5.995
   33   HG23  THR   4          HG23      THR   4 -16.365  14.431  -4.707
   34    H    VAL   5           H        VAL   5 -12.642  13.824  -1.413
   35    HA   VAL   5           HA       VAL   5 -12.402  10.982  -1.413
   36    HB   VAL   5           HB       VAL   5 -11.382  11.245   0.798
   37   HG11  VAL   5          HG11      VAL   5  -9.480  12.618   0.124
   38   HG12  VAL   5          HG12      VAL   5 -10.429  13.294  -1.198
   39   HG13  VAL   5          HG13      VAL   5 -10.014  11.581  -1.198
   40   HG21  VAL   5          HG21      VAL   5 -12.104  14.152   0.487
   41   HG22  VAL   5          HG22      VAL   5 -11.132  13.458   1.786
   42   HG23  VAL   5          HG23      VAL   5 -12.833  13.023   1.626
   43    H    LYS   6           H        LYS   6 -14.916  13.022  -0.517
   44    HA   LYS   6           HA       LYS   6 -15.815  11.691   1.824
   45    HB2  LYS   6           HB2      LYS   6 -17.329  13.467  -0.052
   46    HB3  LYS   6           HB3      LYS   6 -17.850  13.014   1.555
   47    HG2  LYS   6           HG2      LYS   6 -15.931  14.148   2.494
   48    HG3  LYS   6           HG3      LYS   6 -15.376  14.587   0.886
   49    HD2  LYS   6           HD2      LYS   6 -17.433  15.885   0.558
   50    HD3  LYS   6           HD3      LYS   6 -17.953  15.464   2.188
   51    HE2  LYS   6           HE2      LYS   6 -15.964  16.572   3.080
   52    HE3  LYS   6           HE3      LYS   6 -15.477  17.018   1.449
   53    HZ1  LYS   6           HZ1      LYS   6 -17.986  17.879   2.781
   54    HZ2  LYS   6           HZ2      LYS   6 -17.464  18.350   1.244
   55    HZ3  LYS   6           HZ3      LYS   6 -16.598  18.828   2.615
   56    H    LEU   7           H        LEU   7 -16.202  11.125  -1.553
   57    HA   LEU   7           HA       LEU   7 -17.871   8.808  -0.874
   58    HB2  LEU   7           HB2      LEU   7 -18.671   8.930  -3.300
   59    HB3  LEU   7           HB3      LEU   7 -19.339  10.074  -2.162
   60    HG   LEU   7           HG       LEU   7 -17.004  10.917  -3.818
   61   HD11  LEU   7          HD11      LEU   7 -18.504  11.599  -5.618
   62   HD12  LEU   7          HD12      LEU   7 -19.858  10.820  -4.799
   63   HD13  LEU   7          HD13      LEU   7 -18.520   9.849  -5.417
   64   HD21  LEU   7          HD21      LEU   7 -18.164  13.071  -3.675
   65   HD22  LEU   7          HD22      LEU   7 -17.868  12.385  -2.077
   66   HD23  LEU   7          HD23      LEU   7 -19.478  12.298  -2.789
   67    H    ASN   8           H        ASN   8 -15.578  10.031  -3.321
   68    HA   ASN   8           HA       ASN   8 -14.559   7.275  -3.595
   69    HB2  ASN   8           HB2      ASN   8 -14.100   9.683  -5.382
   70    HB3  ASN   8           HB3      ASN   8 -13.412   8.094  -5.624
   71   HD21  ASN   8          HD21      ASN   8 -14.314   7.901  -7.612
   72   HD22  ASN   8          HD22      ASN   8 -15.998   7.606  -7.843
   73    H    HIS   9           H        HIS   9 -13.152   7.130  -1.893
   74    HA   HIS   9           HA       HIS   9 -11.453   9.130  -0.940
   75    HB2  HIS   9           HB2      HIS   9 -11.126   6.122  -0.868
   76    HB3  HIS   9           HB3      HIS   9 -10.155   7.254   0.068
   77    HD1  HIS   9           HD1      HIS   9 -13.369   5.458   0.085
   78    HD2  HIS   9           HD2      HIS   9 -11.644   8.664   2.095
   79    HE1  HIS   9           HE1      HIS   9 -14.832   5.871   2.082
   80    HE2  HIS   9           HE2      HIS   9 -13.676   7.700   3.369
   81    H    THR  10           H        THR  10  -9.669  10.026  -1.762
   82    HA   THR  10           HA       THR  10  -8.786   9.257  -4.365
   83    HB   THR  10           HB       THR  10  -7.515  11.252  -2.470
   84    HG1  THR  10           HG1      THR  10  -9.885  11.299  -3.846
   85   HG21  THR  10          HG21      THR  10  -6.685  12.310  -4.524
   86   HG22  THR  10          HG22      THR  10  -7.429  11.034  -5.486
   87   HG23  THR  10          HG23      THR  10  -6.103  10.651  -4.389
   88    H    CYS  11           H        CYS  11  -7.087   8.082  -4.987
   89    HA   CYS  11           HA       CYS  11  -5.807   6.442  -3.051
   90    HB2  CYS  11           HB2      CYS  11  -6.255   5.618  -5.281
   91    HB3  CYS  11           HB3      CYS  11  -5.285   6.906  -5.988
   92    H    VAL  12           H        VAL  12  -3.985   6.727  -1.973
   93    HA   VAL  12           HA       VAL  12  -2.407   9.072  -2.107
   94    HB   VAL  12           HB       VAL  12  -0.790   7.850  -0.678
   95   HG11  VAL  12          HG11      VAL  12  -2.294   7.394   1.225
   96   HG12  VAL  12          HG12      VAL  12  -3.672   7.556   0.133
   97   HG13  VAL  12          HG13      VAL  12  -2.617   8.938   0.433
   98   HG21  VAL  12          HG21      VAL  12  -2.625   5.501  -1.118
   99   HG22  VAL  12          HG22      VAL  12  -1.333   5.567   0.082
  100   HG23  VAL  12          HG23      VAL  12  -0.946   5.642  -1.638
  101    H    ILE  13           H        ILE  13  -2.403   6.163  -3.920
  102    HA   ILE  13           HA       ILE  13   0.377   6.392  -4.702
  103    HB   ILE  13           HB       ILE  13  -1.613   4.393  -5.701
  104   HG12  ILE  13          HG12      ILE  13  -1.482   4.408  -3.220
  105   HG13  ILE  13          HG13      ILE  13  -0.951   2.912  -3.966
  106   HG21  ILE  13          HG21      ILE  13   1.388   4.351  -5.551
  107   HG22  ILE  13          HG22      ILE  13   0.419   4.547  -7.011
  108   HG23  ILE  13          HG23      ILE  13   0.375   3.025  -6.121
  109   HD11  ILE  13          HD11      ILE  13   0.847   5.086  -2.994
  110   HD12  ILE  13          HD12      ILE  13   1.342   3.536  -3.677
  111   HD13  ILE  13          HD13      ILE  13   0.481   3.591  -2.134
  112    H    CYS  14           H        CYS  14  -2.733   6.067  -6.312
  113    HA   CYS  14           HA       CYS  14  -1.522   6.964  -8.803
  114    HB2  CYS  14           HB2      CYS  14  -4.263   5.847  -8.606
  115    HB3  CYS  14           HB3      CYS  14  -3.138   5.731  -9.928
  116    H    ASP  15           H        ASP  15  -2.914   8.392  -6.318
  117    HA   ASP  15           HA       ASP  15  -3.989  10.323  -5.883
  118    HB2  ASP  15           HB2      ASP  15  -3.236  12.227  -7.132
  119    HB3  ASP  15           HB3      ASP  15  -1.952  11.083  -6.833
  120    H    GLN  16           H        GLN  16  -5.581   8.535  -7.304
  121    HA   GLN  16           HA       GLN  16  -7.477  10.369  -8.571
  122    HB2  GLN  16           HB2      GLN  16  -6.688   7.641  -9.236
  123    HB3  GLN  16           HB3      GLN  16  -8.416   7.917  -9.221
  124    HG2  GLN  16           HG2      GLN  16  -7.674   8.240 -11.368
  125    HG3  GLN  16           HG3      GLN  16  -8.049   9.812 -10.744
  126   HE21  GLN  16          HE21      GLN  16  -6.413  11.256 -10.479
  127   HE22  GLN  16          HE22      GLN  16  -4.863  10.986 -11.155
  128    H    GLU  17           H        GLU  17  -9.647  10.056  -8.159
  129    HA   GLU  17           HA       GLU  17 -10.222   9.439  -5.397
  130    HB2  GLU  17           HB2      GLU  17 -11.920  10.717  -7.534
  131    HB3  GLU  17           HB3      GLU  17 -12.309  10.630  -5.822
  132    HG2  GLU  17           HG2      GLU  17 -10.669  12.127  -5.232
  133    HG3  GLU  17           HG3      GLU  17  -9.744  11.868  -6.705
  134    H    LYS  18           H        LYS  18 -10.428   7.369  -5.087
  135    HA   LYS  18           HA       LYS  18 -12.207   5.795  -6.837
  136    HB2  LYS  18           HB2      LYS  18 -10.316   4.359  -5.150
  137    HB3  LYS  18           HB3      LYS  18 -10.806   4.031  -6.779
  138    HG2  LYS  18           HG2      LYS  18  -8.815   6.105  -5.951
  139    HG3  LYS  18           HG3      LYS  18  -8.445   4.520  -6.619
  140    HD2  LYS  18           HD2      LYS  18 -10.190   6.366  -8.147
  141    HD3  LYS  18           HD3      LYS  18  -8.461   6.610  -8.112
  142    HE2  LYS  18           HE2      LYS  18  -9.070   5.350 -10.055
  143    HE3  LYS  18           HE3      LYS  18  -8.149   4.370  -8.941
  144    HZ1  LYS  18           HZ1      LYS  18 -10.154   3.276  -8.234
  145    HZ2  LYS  18           HZ2      LYS  18 -10.038   3.183  -9.915
  146    HZ3  LYS  18           HZ3      LYS  18 -11.094   4.292  -9.203
  147    H    ASN  19           H        ASN  19 -13.857   4.718  -5.904
  148    HA   ASN  19           HA       ASN  19 -14.098   4.956  -3.013
  149    HB2  ASN  19           HB2      ASN  19 -16.020   5.756  -4.059
  150    HB3  ASN  19           HB3      ASN  19 -16.046   4.445  -5.206
  151   HD21  ASN  19          HD21      ASN  19 -16.745   5.436  -1.959
  152   HD22  ASN  19          HD22      ASN  19 -17.810   4.094  -1.563
  153    H    ARG  20           H        ARG  20 -12.851   2.802  -5.152
  154    HA   ARG  20           HA       ARG  20 -13.396   0.556  -3.335
  155    HB2  ARG  20           HB2      ARG  20 -13.148   0.515  -6.329
  156    HB3  ARG  20           HB3      ARG  20 -13.061  -0.931  -5.365
  157    HG2  ARG  20           HG2      ARG  20 -15.282  -0.545  -4.530
  158    HG3  ARG  20           HG3      ARG  20 -15.389   0.930  -5.482
  159    HD2  ARG  20           HD2      ARG  20 -14.923  -0.416  -7.437
  160    HD3  ARG  20           HD3      ARG  20 -14.976  -1.861  -6.478
  161    HE   ARG  20           HE       ARG  20 -17.364  -0.476  -6.078
  162   HH11  ARG  20          HH11      ARG  20 -15.724  -2.236  -8.619
  163   HH12  ARG  20          HH12      ARG  20 -17.193  -2.707  -9.414
  164   HH21  ARG  20          HH21      ARG  20 -19.295  -1.096  -7.109
  165   HH22  ARG  20          HH22      ARG  20 -19.229  -2.063  -8.546
  166    H    GLY  21           H        GLY  21 -11.725  -0.254  -2.376
  167    HA2  GLY  21           HA2      GLY  21  -9.306  -1.094  -3.227
  168    HA3  GLY  21           HA3      GLY  21  -9.010   0.616  -2.923
  169    H    ILE  22           H        ILE  22  -7.683   0.266  -0.957
  170    HA   ILE  22           HA       ILE  22  -9.397  -0.565   1.270
  171    HB   ILE  22           HB       ILE  22  -7.751  -1.793   2.309
  172   HG12  ILE  22          HG12      ILE  22  -5.783  -0.334   0.585
  173   HG13  ILE  22          HG13      ILE  22  -6.081  -0.075   2.267
  174   HG21  ILE  22          HG21      ILE  22  -7.309  -2.178  -0.644
  175   HG22  ILE  22          HG22      ILE  22  -8.358  -3.107   0.431
  176   HG23  ILE  22          HG23      ILE  22  -6.602  -3.229   0.584
  177   HD11  ILE  22          HD11      ILE  22  -4.043  -1.319   1.929
  178   HD12  ILE  22          HD12      ILE  22  -4.942  -2.568   1.068
  179   HD13  ILE  22          HD13      ILE  22  -5.243  -2.287   2.784
  180    H    HIS  23           H        HIS  23  -7.929   0.129   3.328
  181    HA   HIS  23           HA       HIS  23  -6.916   2.786   3.025
  182    HB2  HIS  23           HB2      HIS  23  -8.677   3.898   4.384
  183    HB3  HIS  23           HB3      HIS  23  -9.257   3.346   2.830
  184    HD1  HIS  23           HD1      HIS  23  -9.793   2.988   6.472
  185    HD2  HIS  23           HD2      HIS  23 -11.016   1.185   2.955
  186    HE1  HIS  23           HE1      HIS  23 -11.815   1.622   7.090
  187    HE2  HIS  23           HE2      HIS  23 -12.634   0.661   4.906
  188    H    LEU  24           H        LEU  24  -5.285   2.799   4.327
  189    HA   LEU  24           HA       LEU  24  -5.489   1.575   6.952
  190    HB2  LEU  24           HB2      LEU  24  -3.102   2.596   5.413
  191    HB3  LEU  24           HB3      LEU  24  -3.069   1.799   6.936
  192    HG   LEU  24           HG       LEU  24  -3.993   0.498   4.399
  193   HD11  LEU  24          HD11      LEU  24  -1.363   0.392   5.855
  194   HD12  LEU  24          HD12      LEU  24  -1.663   0.981   4.219
  195   HD13  LEU  24          HD13      LEU  24  -1.843  -0.734   4.586
  196   HD21  LEU  24          HD21      LEU  24  -3.809  -1.575   5.686
  197   HD22  LEU  24          HD22      LEU  24  -4.987  -0.477   6.405
  198   HD23  LEU  24          HD23      LEU  24  -3.385  -0.646   7.123
  199    H    TYR  25           H        TYR  25  -5.313   2.894   8.747
  200    HA   TYR  25           HA       TYR  25  -5.193   4.803   9.991
  201    HB2  TYR  25           HB2      TYR  25  -3.611   6.007   7.752
  202    HB3  TYR  25           HB3      TYR  25  -3.586   6.493   9.428
  203    HD1  TYR  25           HD1      TYR  25  -3.490   2.929   8.713
  204    HD2  TYR  25           HD2      TYR  25  -1.081   6.378   9.310
  205    HE1  TYR  25           HE1      TYR  25  -1.544   1.495   8.996
  206    HE2  TYR  25           HE2      TYR  25   0.888   4.934   9.626
  207    HH   TYR  25           HH       TYR  25   1.658   2.847   9.711
  208    H    THR  26           H        THR  26  -4.862   7.247   7.825
  209    HA   THR  26           HA       THR  26  -7.766   7.500   7.478
  210    HB   THR  26           HB       THR  26  -7.120   9.323   8.762
  211    HG1  THR  26           HG1      THR  26  -7.505   9.869   6.098
  212   HG21  THR  26          HG21      THR  26  -4.701   8.898   8.560
  213   HG22  THR  26          HG22      THR  26  -5.111  10.615   8.486
  214   HG23  THR  26          HG23      THR  26  -4.708   9.740   7.009
  215    H    LYS  27           H        LYS  27  -5.296   6.349   5.763
  216    HA   LYS  27           HA       LYS  27  -5.672   7.989   3.366
  217    HB2  LYS  27           HB2      LYS  27  -3.788   5.860   3.002
  218    HB3  LYS  27           HB3      LYS  27  -3.528   7.595   2.941
  219    HG2  LYS  27           HG2      LYS  27  -3.589   5.968   5.447
  220    HG3  LYS  27           HG3      LYS  27  -2.131   6.426   4.588
  221    HD2  LYS  27           HD2      LYS  27  -4.163   8.311   5.735
  222    HD3  LYS  27           HD3      LYS  27  -2.608   7.928   6.453
  223    HE2  LYS  27           HE2      LYS  27  -2.058   8.665   3.807
  224    HE3  LYS  27           HE3      LYS  27  -3.277   9.803   4.351
  225    HZ1  LYS  27           HZ1      LYS  27  -0.995  10.570   4.768
  226    HZ2  LYS  27           HZ2      LYS  27  -0.756   9.263   5.815
  227    HZ3  LYS  27           HZ3      LYS  27  -1.909  10.441   6.182
  228    H    PHE  28           H        PHE  28  -5.119   6.537   1.376
  229    HA   PHE  28           HA       PHE  28  -6.781   4.157   1.278
  230    HB2  PHE  28           HB2      PHE  28  -8.368   5.965   0.966
  231    HB3  PHE  28           HB3      PHE  28  -7.365   6.670  -0.295
  232    HD1  PHE  28           HD1      PHE  28  -7.511   5.976  -2.488
  233    HD2  PHE  28           HD2      PHE  28  -9.449   3.699   0.524
  234    HE1  PHE  28           HE1      PHE  28  -8.647   4.675  -4.214
  235    HE2  PHE  28           HE2      PHE  28 -10.581   2.366  -1.215
  236    HZ   PHE  28           HZ       PHE  28 -10.157   2.841  -3.611
  237    H    ILE  29           H        ILE  29  -5.321   2.813   0.413
  238    HA   ILE  29           HA       ILE  29  -3.956   3.568  -2.071
  239    HB   ILE  29           HB       ILE  29  -4.055   0.858  -0.701
  240   HG12  ILE  29          HG12      ILE  29  -1.529   1.492  -0.305
  241   HG13  ILE  29          HG13      ILE  29  -2.148   3.138  -0.401
  242   HG21  ILE  29          HG21      ILE  29  -2.224   0.230  -2.181
  243   HG22  ILE  29          HG22      ILE  29  -2.260   1.822  -2.940
  244   HG23  ILE  29          HG23      ILE  29  -3.645   0.730  -3.114
  245   HD11  ILE  29          HD11      ILE  29  -2.029   2.328   1.901
  246   HD12  ILE  29          HD12      ILE  29  -3.132   1.016   1.490
  247   HD13  ILE  29          HD13      ILE  29  -3.685   2.688   1.419
  248    H    CYS  30           H        CYS  30  -5.072   3.262  -4.014
  249    HA   CYS  30           HA       CYS  30  -7.634   2.016  -3.706
  250    HB2  CYS  30           HB2      CYS  30  -8.209   2.656  -5.869
  251    HB3  CYS  30           HB3      CYS  30  -7.284   3.954  -5.194
  252    H    LEU  31           H        LEU  31  -8.323   0.452  -5.344
  253    HA   LEU  31           HA       LEU  31  -7.310  -1.863  -4.328
  254    HB2  LEU  31           HB2      LEU  31  -9.026  -2.901  -5.460
  255    HB3  LEU  31           HB3      LEU  31  -9.614  -1.295  -5.220
  256    HG   LEU  31           HG       LEU  31  -8.680  -0.915  -7.649
  257   HD11  LEU  31          HD11      LEU  31  -9.281  -3.869  -7.671
  258   HD12  LEU  31          HD12      LEU  31  -7.691  -3.140  -7.890
  259   HD13  LEU  31          HD13      LEU  31  -8.960  -2.859  -9.081
  260   HD21  LEU  31          HD21      LEU  31 -10.997  -0.641  -6.939
  261   HD22  LEU  31          HD22      LEU  31 -11.248  -2.382  -7.076
  262   HD23  LEU  31          HD23      LEU  31 -10.898  -1.424  -8.516
  263    H    ASP  32           H        ASP  32  -6.106  -0.114  -6.974
  264    HA   ASP  32           HA       ASP  32  -5.296  -2.403  -8.489
  265    HB2  ASP  32           HB2      ASP  32  -4.666  -0.850 -10.050
  266    HB3  ASP  32           HB3      ASP  32  -6.068  -0.135  -9.369
  267    H    CYS  33           H        CYS  33  -3.784   0.185  -6.816
  268    HA   CYS  33           HA       CYS  33  -1.144  -0.661  -6.912
  269    HB2  CYS  33           HB2      CYS  33  -0.972   1.157  -5.087
  270    HB3  CYS  33           HB3      CYS  33  -1.481   1.621  -6.681
  271    H    GLU  34           H        GLU  34  -3.727  -0.887  -4.742
  272    HA   GLU  34           HA       GLU  34  -2.473  -1.815  -2.467
  273    HB2  GLU  34           HB2      GLU  34  -4.841  -1.243  -2.497
  274    HB3  GLU  34           HB3      GLU  34  -5.173  -2.574  -3.566
  275    HG2  GLU  34           HG2      GLU  34  -3.887  -3.386  -1.107
  276    HG3  GLU  34           HG3      GLU  34  -5.449  -2.645  -0.876
  277    H    ARG  35           H        ARG  35  -3.707  -3.739  -5.178
  278    HA   ARG  35           HA       ARG  35  -2.451  -6.083  -4.143
  279    HB2  ARG  35           HB2      ARG  35  -3.129  -7.232  -6.122
  280    HB3  ARG  35           HB3      ARG  35  -4.441  -6.152  -5.681
  281    HG2  ARG  35           HG2      ARG  35  -3.575  -4.542  -7.384
  282    HG3  ARG  35           HG3      ARG  35  -2.453  -5.791  -7.894
  283    HD2  ARG  35           HD2      ARG  35  -5.424  -5.882  -7.974
  284    HD3  ARG  35           HD3      ARG  35  -4.325  -5.883  -9.342
  285    HE   ARG  35           HE       ARG  35  -3.700  -8.104  -7.807
  286   HH11  ARG  35          HH11      ARG  35  -6.406  -6.931  -9.683
  287   HH12  ARG  35          HH12      ARG  35  -7.043  -8.514  -9.997
  288   HH21  ARG  35          HH21      ARG  35  -4.527 -10.197  -8.230
  289   HH22  ARG  35          HH22      ARG  35  -5.967 -10.370  -9.181
  290    H    LYS  36           H        LYS  36  -1.327  -3.456  -5.987
  291    HA   LYS  36           HA       LYS  36   0.644  -4.706  -7.548
  292    HB2  LYS  36           HB2      LYS  36   0.368  -1.899  -6.510
  293    HB3  LYS  36           HB3      LYS  36   1.605  -2.404  -7.620
  294    HG2  LYS  36           HG2      LYS  36  -0.353  -3.126  -9.100
  295    HG3  LYS  36           HG3      LYS  36  -1.325  -2.182  -8.056
  296    HD2  LYS  36           HD2      LYS  36  -0.141  -0.283  -8.644
  297    HD3  LYS  36           HD3      LYS  36   1.072  -1.170  -9.528
  298    HE2  LYS  36           HE2      LYS  36  -0.669  -1.897 -11.103
  299    HE3  LYS  36           HE3      LYS  36  -1.861  -0.949 -10.218
  300    HZ1  LYS  36           HZ1      LYS  36  -1.052   0.197 -12.186
  301    HZ2  LYS  36           HZ2      LYS  36   0.529   0.148 -11.594
  302    HZ3  LYS  36           HZ3      LYS  36  -0.654   1.049 -10.779
  303    H    VAL  37           H        VAL  37   0.505  -3.157  -4.458
  304    HA   VAL  37           HA       VAL  37   3.146  -3.250  -3.722
  305    HB   VAL  37           HB       VAL  37   2.433  -3.183  -1.419
  306   HG11  VAL  37          HG11      VAL  37   2.181  -1.156  -2.950
  307   HG12  VAL  37          HG12      VAL  37   1.304  -1.125  -1.420
  308   HG13  VAL  37          HG13      VAL  37   0.446  -1.511  -2.920
  309   HG21  VAL  37          HG21      VAL  37  -0.121  -3.089  -1.067
  310   HG22  VAL  37          HG22      VAL  37   0.748  -4.623  -1.065
  311   HG23  VAL  37          HG23      VAL  37  -0.148  -4.117  -2.507
  312    H    ILE  38           H        ILE  38   0.654  -5.621  -3.221
  313    HA   ILE  38           HA       ILE  38   2.118  -7.547  -1.793
  314    HB   ILE  38           HB       ILE  38  -0.168  -8.215  -3.630
  315   HG12  ILE  38          HG12      ILE  38  -0.262  -6.655  -1.075
  316   HG13  ILE  38          HG13      ILE  38  -1.066  -6.332  -2.586
  317   HG21  ILE  38          HG21      ILE  38  -0.721  -9.877  -1.961
  318   HG22  ILE  38          HG22      ILE  38   0.582  -9.302  -0.930
  319   HG23  ILE  38          HG23      ILE  38   0.957 -10.056  -2.475
  320   HD11  ILE  38          HD11      ILE  38  -2.479  -8.360  -2.145
  321   HD12  ILE  38          HD12      ILE  38  -2.722  -6.993  -1.058
  322   HD13  ILE  38          HD13      ILE  38  -1.780  -8.382  -0.525
  323    H    SER  39           H        SER  39   1.719  -6.721  -5.103
  324    HA   SER  39           HA       SER  39   2.835  -9.130  -6.098
  325    HB2  SER  39           HB2      SER  39   1.213  -7.765  -7.401
  326    HB3  SER  39           HB3      SER  39   2.428  -6.495  -7.522
  327    HG   SER  39           HG       SER  39   3.201  -9.035  -8.348
  328    H    THR  40           H        THR  40   3.970  -6.177  -4.903
  329    HA   THR  40           HA       THR  40   6.561  -6.235  -6.169
  330    HB   THR  40           HB       THR  40   5.485  -4.480  -3.959
  331    HG1  THR  40           HG1      THR  40   4.406  -4.352  -6.056
  332   HG21  THR  40          HG21      THR  40   7.306  -2.974  -4.497
  333   HG22  THR  40          HG22      THR  40   7.894  -4.084  -5.735
  334   HG23  THR  40          HG23      THR  40   7.947  -4.550  -4.035
  335    H    SER  41           H        SER  41   5.321  -6.623  -2.837
  336    HA   SER  41           HA       SER  41   8.014  -6.875  -1.837
  337    HB2  SER  41           HB2      SER  41   6.811  -7.017   0.381
  338    HB3  SER  41           HB3      SER  41   6.554  -5.541  -0.547
  339    HG   SER  41           HG       SER  41   4.594  -6.379   0.279
  340    H    THR  42           H        THR  42   5.735  -9.142  -2.934
  341    HA   THR  42           HA       THR  42   6.373 -11.155  -0.980
  342    HB   THR  42           HB       THR  42   5.033 -12.669  -2.479
  343    HG1  THR  42           HG1      THR  42   3.956 -10.500  -3.822
  344   HG21  THR  42          HG21      THR  42   3.762 -10.085  -1.562
  345   HG22  THR  42          HG22      THR  42   4.034 -11.524  -0.574
  346   HG23  THR  42          HG23      THR  42   2.895 -11.580  -1.918
  347    H    SER  43           H        SER  43   8.638 -10.153  -2.199
  348    HA   SER  43           HA       SER  43   9.826 -12.668  -3.030
  349    HB2  SER  43           HB2      SER  43  10.210 -10.111  -4.619
  350    HB3  SER  43           HB3      SER  43  11.059 -11.631  -4.895
  351    HG   SER  43           HG       SER  43   8.333 -11.902  -4.849
  352    H    ASP  44           H        ASP  44   9.693 -10.545  -0.818
  353    HA   ASP  44           HA       ASP  44  12.333  -9.421  -0.689
  354    HB2  ASP  44           HB2      ASP  44  10.506  -8.175   0.284
  355    HB3  ASP  44           HB3      ASP  44  10.069  -9.534   1.313
  356    HA   PRO  45           HA       PRO  45  14.175 -13.099   0.981
  357    HB2  PRO  45           HB2      PRO  45  16.595 -11.960   1.562
  358    HB3  PRO  45           HB3      PRO  45  16.118 -12.453  -0.032
  359    HG2  PRO  45           HG2      PRO  45  16.143  -9.825   1.113
  360    HG3  PRO  45           HG3      PRO  45  16.567 -10.298  -0.505
  361    HD2  PRO  45           HD2      PRO  45  14.214  -9.105   0.127
  362    HD3  PRO  45           HD3      PRO  45  14.394 -10.267  -1.193
  363    H    ASP  46           H        ASP  46  13.920 -10.062   2.705
  364    HA   ASP  46           HA       ASP  46  13.923  -9.505   4.911
  365    HB2  ASP  46           HB2      ASP  46  11.941 -10.941   4.910
  366    HB3  ASP  46           HB3      ASP  46  12.945 -12.355   5.198
  367    H    TYR  47           H        TYR  47  16.197  -9.277   4.939
  368    HA   TYR  47           HA       TYR  47  18.313  -9.607   5.571
  369    HB2  TYR  47           HB2      TYR  47  17.030 -11.004   7.886
  370    HB3  TYR  47           HB3      TYR  47  18.582 -10.207   7.844
  371    HD1  TYR  47           HD1      TYR  47  15.028  -9.766   8.257
  372    HD2  TYR  47           HD2      TYR  47  18.716  -7.728   7.685
  373    HE1  TYR  47           HE1      TYR  47  13.979  -7.673   9.001
  374    HE2  TYR  47           HE2      TYR  47  17.674  -5.625   8.428
  375    HH   TYR  47           HH       TYR  47  14.683  -5.521   9.995
  376    H    ALA  48           H        ALA  48  18.254 -11.188   3.673
  377    HA   ALA  48           HA       ALA  48  19.271 -12.966   2.718
  378    HB1  ALA  48           HB1      ALA  48  20.861 -14.292   3.968
  379    HB2  ALA  48           HB2      ALA  48  20.230 -13.657   5.487
  380    HB3  ALA  48           HB3      ALA  48  21.052 -12.582   4.357
  381    H1   SER   0           H1       SER   0   5.749  14.262   9.527
  382    H2   SER   0           H2       SER   0   5.633  13.173   8.240
  383    H3   SER   0           H3       SER   0   4.454  13.169   9.453
  384    HA   SER   0           HA       SER   0   3.580  14.228   7.523
  385    HB2  SER   0           HB2      SER   0   3.003  15.108   9.800
  386    HB3  SER   0           HB3      SER   0   4.283  16.303   9.619
  387    HG   SER   0           HG       SER   0   1.810  16.112   8.310
  388    H    MET   1           H        MET   1   3.808  15.592   5.797
  389    HA   MET   1           HA       MET   1   4.813  16.817   4.187
  390    HB2  MET   1           HB2      MET   1   6.520  17.804   6.473
  391    HB3  MET   1           HB3      MET   1   6.599  18.447   4.838
  392    HG2  MET   1           HG2      MET   1   4.277  19.151   4.986
  393    HG3  MET   1           HG3      MET   1   4.168  18.474   6.611
  394    HE1  MET   1           HE1      MET   1   3.377  21.472   5.845
  395    HE2  MET   1           HE2      MET   1   4.072  22.356   7.202
  396    HE3  MET   1           HE3      MET   1   3.240  20.828   7.480
  397    H    ASP   2           H        ASP   2   5.632  15.338   2.864
  398    HA   ASP   2           HA       ASP   2   7.923  13.764   3.345
  399    HB2  ASP   2           HB2      ASP   2   7.854  13.322   0.893
  400    HB3  ASP   2           HB3      ASP   2   6.302  13.076   1.682
  401    H    GLU   3           H        GLU   3   9.938  14.459   3.548
  402    HA   GLU   3           HA       GLU   3  10.784  16.786   1.956
  403    HB2  GLU   3           HB2      GLU   3  10.219  17.377   4.334
  404    HB3  GLU   3           HB3      GLU   3  11.572  16.364   4.825
  405    HG2  GLU   3           HG2      GLU   3  12.236  18.671   4.744
  406    HG3  GLU   3           HG3      GLU   3  13.087  17.756   3.508
  407    H    THR   4           H        THR   4  12.175  14.431   4.260
  408    HA   THR   4           HA       THR   4  14.695  14.530   2.870
  409    HB   THR   4           HB       THR   4  14.021  12.610   5.085
  410    HG1  THR   4           HG1      THR   4  13.319  14.501   5.957
  411   HG21  THR   4          HG21      THR   4  16.244  12.464   4.025
  412   HG22  THR   4          HG22      THR   4  16.346  12.974   5.709
  413   HG23  THR   4          HG23      THR   4  16.528  14.160   4.418
  414    H    VAL   5           H        VAL   5  12.795  13.605   1.128
  415    HA   VAL   5           HA       VAL   5  12.509  10.767   1.135
  416    HB   VAL   5           HB       VAL   5  11.496  11.041  -1.078
  417   HG11  VAL   5          HG11      VAL   5   9.618  12.448  -0.411
  418   HG12  VAL   5          HG12      VAL   5  10.577  13.113   0.910
  419   HG13  VAL   5          HG13      VAL   5  10.134  11.407   0.916
  420   HG21  VAL   5          HG21      VAL   5  12.269  13.935  -0.776
  421   HG22  VAL   5          HG22      VAL   5  11.286  13.256  -2.074
  422   HG23  VAL   5          HG23      VAL   5  12.980  12.790  -1.910
  423    H    LYS   6           H        LYS   6  15.054  12.766   0.230
  424    HA   LYS   6           HA       LYS   6  15.941  11.409  -2.096
  425    HB2  LYS   6           HB2      LYS   6  17.476  13.170  -0.223
  426    HB3  LYS   6           HB3      LYS   6  17.997  12.699  -1.825
  427    HG2  LYS   6           HG2      LYS   6  16.098  13.856  -2.778
  428    HG3  LYS   6           HG3      LYS   6  15.545  14.314  -1.175
  429    HD2  LYS   6           HD2      LYS   6  17.624  15.578  -0.847
  430    HD3  LYS   6           HD3      LYS   6  18.141  15.141  -2.471
  431    HE2  LYS   6           HE2      LYS   6  16.171  16.281  -3.372
  432    HE3  LYS   6           HE3      LYS   6  15.694  16.745  -1.746
  433    HZ1  LYS   6           HZ1      LYS   6  18.221  17.549  -3.080
  434    HZ2  LYS   6           HZ2      LYS   6  17.708  18.036  -1.547
  435    HZ3  LYS   6           HZ3      LYS   6  16.853  18.528  -2.916
  436    H    LEU   7           H        LEU   7  16.309  10.843   1.284
  437    HA   LEU   7           HA       LEU   7  17.943   8.498   0.612
  438    HB2  LEU   7           HB2      LEU   7  18.743   8.616   3.037
  439    HB3  LEU   7           HB3      LEU   7  19.429   9.745   1.896
  440    HG   LEU   7           HG       LEU   7  17.109  10.633   3.549
  441   HD11  LEU   7          HD11      LEU   7  18.618  11.298   5.348
  442   HD12  LEU   7          HD12      LEU   7  19.959  10.492   4.532
  443   HD13  LEU   7          HD13      LEU   7  18.607   9.545   5.154
  444   HD21  LEU   7          HD21      LEU   7  18.305  12.767   3.398
  445   HD22  LEU   7          HD22      LEU   7  18.000  12.080   1.803
  446   HD23  LEU   7          HD23      LEU   7  19.606  11.966   2.517
  447    H    ASN   8           H        ASN   8  15.670   9.767   3.052
  448    HA   ASN   8           HA       ASN   8  14.599   7.031   3.337
  449    HB2  ASN   8           HB2      ASN   8  14.181   9.456   5.113
  450    HB3  ASN   8           HB3      ASN   8  13.464   7.881   5.360
  451   HD21  ASN   8          HD21      ASN   8  14.360   7.684   7.354
  452   HD22  ASN   8          HD22      ASN   8  16.041   7.359   7.587
  453    H    HIS   9           H        HIS   9  13.194   6.905   1.634
  454    HA   HIS   9           HA       HIS   9  11.530   8.930   0.670
  455    HB2  HIS   9           HB2      HIS   9  11.154   5.926   0.605
  456    HB3  HIS   9           HB3      HIS   9  10.201   7.072  -0.336
  457    HD1  HIS   9           HD1      HIS   9  13.387   5.229  -0.339
  458    HD2  HIS   9           HD2      HIS   9  11.718   8.451  -2.365
  459    HE1  HIS   9           HE1      HIS   9  14.862   5.606  -2.337
  460    HE2  HIS   9           HE2      HIS   9  13.734   7.444  -3.636
  461    H    THR  10           H        THR  10   9.762   9.863   1.486
  462    HA   THR  10           HA       THR  10   8.859   9.121   4.091
  463    HB   THR  10           HB       THR  10   7.623  11.128   2.185
  464    HG1  THR  10           HG1      THR  10   9.990  11.137   3.567
  465   HG21  THR  10          HG21      THR  10   6.812  12.207   4.237
  466   HG22  THR  10          HG22      THR  10   7.536  10.921   5.203
  467   HG23  THR  10          HG23      THR  10   6.203  10.557   4.108
  468    H    CYS  11           H        CYS  11   7.143   7.976   4.714
  469    HA   CYS  11           HA       CYS  11   5.838   6.352   2.784
  470    HB2  CYS  11           HB2      CYS  11   6.273   5.528   5.016
  471    HB3  CYS  11           HB3      CYS  11   5.322   6.833   5.720
  472    H    VAL  12           H        VAL  12   4.021   6.663   1.702
  473    HA   VAL  12           HA       VAL  12   2.481   9.034   1.828
  474    HB   VAL  12           HB       VAL  12   0.845   7.834   0.400
  475   HG11  VAL  12          HG11      VAL  12   2.345   7.345  -1.498
  476   HG12  VAL  12          HG12      VAL  12   3.724   7.488  -0.405
  477   HG13  VAL  12          HG13      VAL  12   2.695   8.886  -0.712
  478   HG21  VAL  12          HG21      VAL  12   2.640   5.458   0.851
  479   HG22  VAL  12          HG22      VAL  12   1.351   5.541  -0.349
  480   HG23  VAL  12          HG23      VAL  12   0.964   5.629   1.371
  481    H    ILE  13           H        ILE  13   2.428   6.135   3.655
  482    HA   ILE  13           HA       ILE  13  -0.346   6.415   4.437
  483    HB   ILE  13           HB       ILE  13   1.605   4.380   5.441
  484   HG12  ILE  13          HG12      ILE  13   1.478   4.391   2.956
  485   HG13  ILE  13          HG13      ILE  13   0.920   2.907   3.707
  486   HG21  ILE  13          HG21      ILE  13  -1.396   4.393   5.284
  487   HG22  ILE  13          HG22      ILE  13  -0.426   4.577   6.745
  488   HG23  ILE  13          HG23      ILE  13  -0.407   3.052   5.862
  489   HD11  ILE  13          HD11      ILE  13  -0.841   5.109   2.727
  490   HD12  ILE  13          HD12      ILE  13  -1.362   3.569   3.417
  491   HD13  ILE  13          HD13      ILE  13  -0.500   3.605   1.873
  492    H    CYS  14           H        CYS  14   2.756   6.028   6.059
  493    HA   CYS  14           HA       CYS  14   1.578   6.954   8.535
  494    HB2  CYS  14           HB2      CYS  14   4.306   5.813   8.316
  495    HB3  CYS  14           HB3      CYS  14   3.179   5.723   9.645
  496    H    ASP  15           H        ASP  15   2.970   8.366   6.040
  497    HA   ASP  15           HA       ASP  15   4.084  10.275   5.602
  498    HB2  ASP  15           HB2      ASP  15   3.360  12.195   6.845
  499    HB3  ASP  15           HB3      ASP  15   2.059  11.072   6.549
  500    H    GLN  16           H        GLN  16   5.644   8.464   7.027
  501    HA   GLN  16           HA       GLN  16   7.568  10.271   8.292
  502    HB2  GLN  16           HB2      GLN  16   6.732   7.559   8.962
  503    HB3  GLN  16           HB3      GLN  16   8.463   7.805   8.951
  504    HG2  GLN  16           HG2      GLN  16   7.724   8.146  11.095
  505    HG3  GLN  16           HG3      GLN  16   8.125   9.710  10.468
  506   HE21  GLN  16          HE21      GLN  16   6.520  11.178  10.198
  507   HE22  GLN  16          HE22      GLN  16   4.965  10.942  10.880
  508    H    GLU  17           H        GLU  17   9.737   9.910   7.889
  509    HA   GLU  17           HA       GLU  17  10.300   9.281   5.126
  510    HB2  GLU  17           HB2      GLU  17  12.018  10.534   7.262
  511    HB3  GLU  17           HB3      GLU  17  12.406  10.435   5.549
  512    HG2  GLU  17           HG2      GLU  17  10.792  11.958   4.953
  513    HG3  GLU  17           HG3      GLU  17   9.864  11.720   6.428
  514    H    LYS  18           H        LYS  18  10.469   7.206   4.824
  515    HA   LYS  18           HA       LYS  18  12.219   5.609   6.577
  516    HB2  LYS  18           HB2      LYS  18  10.306   4.199   4.897
  517    HB3  LYS  18           HB3      LYS  18  10.789   3.873   6.525
  518    HG2  LYS  18           HG2      LYS  18   8.835   5.975   5.692
  519    HG3  LYS  18           HG3      LYS  18   8.437   4.398   6.363
  520    HD2  LYS  18           HD2      LYS  18  10.212   6.216   7.886
  521    HD3  LYS  18           HD3      LYS  18   8.490   6.494   7.848
  522    HE2  LYS  18           HE2      LYS  18   9.069   5.228   9.797
  523    HE3  LYS  18           HE3      LYS  18   8.134   4.262   8.684
  524    HZ1  LYS  18           HZ1      LYS  18  10.114   3.124   7.986
  525    HZ2  LYS  18           HZ2      LYS  18  10.001   3.048   9.670
  526    HZ3  LYS  18           HZ3      LYS  18  11.078   4.131   8.945
  527    H    ASN  19           H        ASN  19  13.848   4.500   5.649
  528    HA   ASN  19           HA       ASN  19  14.105   4.719   2.759
  529    HB2  ASN  19           HB2      ASN  19  16.038   5.489   3.807
  530    HB3  ASN  19           HB3      ASN  19  16.036   4.182   4.959
  531   HD21  ASN  19          HD21      ASN  19  16.757   5.150   1.713
  532   HD22  ASN  19          HD22      ASN  19  17.795   3.784   1.317
  533    H    ARG  20           H        ARG  20  12.822   2.597   4.919
  534    HA   ARG  20           HA       ARG  20  13.303   0.350   3.085
  535    HB2  ARG  20           HB2      ARG  20  13.060   0.215   6.089
  536    HB3  ARG  20           HB3      ARG  20  12.970  -1.178   5.043
  537    HG2  ARG  20           HG2      ARG  20  15.221  -0.800   4.302
  538    HG3  ARG  20           HG3      ARG  20  15.298   0.681   5.248
  539    HD2  ARG  20           HD2      ARG  20  14.879  -0.561   7.267
  540    HD3  ARG  20           HD3      ARG  20  14.803  -2.008   6.311
  541    HE   ARG  20           HE       ARG  20  17.267  -0.780   5.838
  542   HH11  ARG  20          HH11      ARG  20  15.590  -2.481   8.395
  543   HH12  ARG  20          HH12      ARG  20  17.047  -2.972   9.195
  544   HH21  ARG  20          HH21      ARG  20  19.179  -1.412   6.886
  545   HH22  ARG  20          HH22      ARG  20  19.098  -2.364   8.335
  546    H    GLY  21           H        GLY  21  11.634  -0.449   2.148
  547    HA2  GLY  21           HA2      GLY  21   9.201  -1.246   2.994
  548    HA3  GLY  21           HA3      GLY  21   8.934   0.469   2.685
  549    H    ILE  22           H        ILE  22   7.606   0.135   0.718
  550    HA   ILE  22           HA       ILE  22   9.310  -0.735  -1.504
  551    HB   ILE  22           HB       ILE  22   7.644  -1.939  -2.541
  552   HG12  ILE  22          HG12      ILE  22   5.699  -0.438  -0.825
  553   HG13  ILE  22          HG13      ILE  22   6.003  -0.192  -2.508
  554   HG21  ILE  22          HG21      ILE  22   7.192  -2.306   0.413
  555   HG22  ILE  22          HG22      ILE  22   8.225  -3.256  -0.658
  556   HG23  ILE  22          HG23      ILE  22   6.467  -3.348  -0.811
  557   HD11  ILE  22          HD11      ILE  22   3.943  -1.397  -2.165
  558   HD12  ILE  22          HD12      ILE  22   4.819  -2.659  -1.300
  559   HD13  ILE  22          HD13      ILE  22   5.125  -2.391  -3.018
  560    H    HIS  23           H        HIS  23   7.857  -0.027  -3.568
  561    HA   HIS  23           HA       HIS  23   6.888   2.648  -3.277
  562    HB2  HIS  23           HB2      HIS  23   8.671   3.726  -4.632
  563    HB3  HIS  23           HB3      HIS  23   9.238   3.167  -3.077
  564    HD1  HIS  23           HD1      HIS  23   9.770   2.793  -6.715
  565    HD2  HIS  23           HD2      HIS  23  10.964   0.980  -3.195
  566    HE1  HIS  23           HE1      HIS  23  11.768   1.393  -7.329
  567    HE2  HIS  23           HE2      HIS  23  12.560   0.407  -5.152
  568    H    LEU  24           H        LEU  24   5.261   2.688  -4.581
  569    HA   LEU  24           HA       LEU  24   5.442   1.452  -7.206
  570    HB2  LEU  24           HB2      LEU  24   3.076   2.517  -5.667
  571    HB3  LEU  24           HB3      LEU  24   3.028   1.717  -7.186
  572    HG   LEU  24           HG       LEU  24   3.929   0.407  -4.645
  573   HD11  LEU  24          HD11      LEU  24   1.298   0.342  -6.102
  574   HD12  LEU  24          HD12      LEU  24   1.607   0.934  -4.468
  575   HD13  LEU  24          HD13      LEU  24   1.757  -0.786  -4.829
  576   HD21  LEU  24          HD21      LEU  24   3.705  -1.668  -5.923
  577   HD22  LEU  24          HD22      LEU  24   4.906  -0.596  -6.646
  578   HD23  LEU  24          HD23      LEU  24   3.302  -0.737  -7.367
  579    H    TYR  25           H        TYR  25   5.287   2.771  -9.002
  580    HA   TYR  25           HA       TYR  25   5.197   4.671 -10.253
  581    HB2  TYR  25           HB2      TYR  25   3.638   5.918  -8.018
  582    HB3  TYR  25           HB3      TYR  25   3.619   6.394  -9.697
  583    HD1  TYR  25           HD1      TYR  25   3.468   2.835  -8.970
  584    HD2  TYR  25           HD2      TYR  25   1.084   6.316  -9.564
  585    HE1  TYR  25           HE1      TYR  25   1.502   1.429  -9.251
  586    HE2  TYR  25           HE2      TYR  25  -0.887   4.905  -9.877
  587    HH   TYR  25           HH       TYR  25  -1.675   2.819  -9.979
  588    H    THR  26           H        THR  26   4.919   7.131  -8.096
  589    HA   THR  26           HA       THR  26   7.824   7.333  -7.745
  590    HB   THR  26           HB       THR  26   7.213   9.165  -9.031
  591    HG1  THR  26           HG1      THR  26   7.607   9.700  -6.370
  592   HG21  THR  26          HG21      THR  26   4.783   8.774  -8.839
  593   HG22  THR  26          HG22      THR  26   5.220  10.485  -8.769
  594   HG23  THR  26          HG23      THR  26   4.797   9.623  -7.290
  595    H    LYS  27           H        LYS  27   5.335   6.229  -6.029
  596    HA   LYS  27           HA       LYS  27   5.732   7.875  -3.637
  597    HB2  LYS  27           HB2      LYS  27   3.813   5.778  -3.269
  598    HB3  LYS  27           HB3      LYS  27   3.582   7.518  -3.214
  599    HG2  LYS  27           HG2      LYS  27   3.617   5.881  -5.714
  600    HG3  LYS  27           HG3      LYS  27   2.166   6.370  -4.860
  601    HD2  LYS  27           HD2      LYS  27   4.234   8.211  -6.012
  602    HD3  LYS  27           HD3      LYS  27   2.674   7.851  -6.732
  603    HE2  LYS  27           HE2      LYS  27   2.129   8.608  -4.091
  604    HE3  LYS  27           HE3      LYS  27   3.371   9.719  -4.639
  605    HZ1  LYS  27           HZ1      LYS  27   1.106  10.527  -5.061
  606    HZ2  LYS  27           HZ2      LYS  27   0.845   9.222  -6.107
  607    HZ3  LYS  27           HZ3      LYS  27   2.020  10.379  -6.475
  608    H    PHE  28           H        PHE  28   5.151   6.434  -1.644
  609    HA   PHE  28           HA       PHE  28   6.774   4.032  -1.535
  610    HB2  PHE  28           HB2      PHE  28   8.391   5.813  -1.227
  611    HB3  PHE  28           HB3      PHE  28   7.401   6.541   0.029
  612    HD1  PHE  28           HD1      PHE  28   7.533   5.854   2.228
  613    HD2  PHE  28           HD2      PHE  28   9.431   3.531  -0.774
  614    HE1  PHE  28           HE1      PHE  28   8.646   4.539   3.960
  615    HE2  PHE  28           HE2      PHE  28  10.538   2.186   0.970
  616    HZ   PHE  28           HZ       PHE  28  10.121   2.675   3.365
  617    H    ILE  29           H        ILE  29   5.295   2.713  -0.663
  618    HA   ILE  29           HA       ILE  29   3.935   3.504   1.813
  619    HB   ILE  29           HB       ILE  29   3.993   0.788   0.456
  620   HG12  ILE  29          HG12      ILE  29   1.479   1.464   0.055
  621   HG13  ILE  29          HG13      ILE  29   2.127   3.099   0.145
  622   HG21  ILE  29          HG21      ILE  29   2.148   0.196   1.935
  623   HG22  ILE  29          HG22      ILE  29   2.208   1.791   2.689
  624   HG23  ILE  29          HG23      ILE  29   3.575   0.676   2.870
  625   HD11  ILE  29          HD11      ILE  29   1.991   2.282  -2.153
  626   HD12  ILE  29          HD12      ILE  29   3.071   0.953  -1.741
  627   HD13  ILE  29          HD13      ILE  29   3.653   2.616  -1.674
  628    H    CYS  30           H        CYS  30   5.045   3.185   3.762
  629    HA   CYS  30           HA       CYS  30   7.588   1.895   3.459
  630    HB2  CYS  30           HB2      CYS  30   8.172   2.527   5.624
  631    HB3  CYS  30           HB3      CYS  30   7.275   3.843   4.943
  632    H    LEU  31           H        LEU  31   8.249   0.321   5.098
  633    HA   LEU  31           HA       LEU  31   7.193  -1.978   4.097
  634    HB2  LEU  31           HB2      LEU  31   8.890  -3.042   5.235
  635    HB3  LEU  31           HB3      LEU  31   9.506  -1.445   4.987
  636    HG   LEU  31           HG       LEU  31   8.576  -1.040   7.413
  637   HD11  LEU  31          HD11      LEU  31   9.130  -4.002   7.447
  638   HD12  LEU  31          HD12      LEU  31   7.552  -3.245   7.663
  639   HD13  LEU  31          HD13      LEU  31   8.825  -2.982   8.853
  640   HD21  LEU  31          HD21      LEU  31  10.897  -0.805   6.705
  641   HD22  LEU  31          HD22      LEU  31  11.122  -2.547   6.851
  642   HD23  LEU  31          HD23      LEU  31  10.785  -1.580   8.286
  643    H    ASP  32           H        ASP  32   6.015  -0.196   6.733
  644    HA   ASP  32           HA       ASP  32   5.167  -2.465   8.258
  645    HB2  ASP  32           HB2      ASP  32   4.565  -0.895   9.813
  646    HB3  ASP  32           HB3      ASP  32   5.980  -0.208   9.130
  647    H    CYS  33           H        CYS  33   3.703   0.142   6.571
  648    HA   CYS  33           HA       CYS  33   1.050  -0.657   6.669
  649    HB2  CYS  33           HB2      CYS  33   0.911   1.158   4.837
  650    HB3  CYS  33           HB3      CYS  33   1.425   1.619   6.431
  651    H    GLU  34           H        GLU  34   3.629  -0.939   4.503
  652    HA   GLU  34           HA       GLU  34   2.361  -1.851   2.228
  653    HB2  GLU  34           HB2      GLU  34   4.739  -1.319   2.262
  654    HB3  GLU  34           HB3      GLU  34   5.047  -2.652   3.334
  655    HG2  GLU  34           HG2      GLU  34   3.750  -3.446   0.875
  656    HG3  GLU  34           HG3      GLU  34   5.324  -2.735   0.645
  657    H    ARG  35           H        ARG  35   3.563  -3.789   4.947
  658    HA   ARG  35           HA       ARG  35   2.263  -6.113   3.923
  659    HB2  ARG  35           HB2      ARG  35   2.922  -7.266   5.906
  660    HB3  ARG  35           HB3      ARG  35   4.252  -6.208   5.463
  661    HG2  ARG  35           HG2      ARG  35   3.411  -4.578   7.158
  662    HG3  ARG  35           HG3      ARG  35   2.266  -5.805   7.670
  663    HD2  ARG  35           HD2      ARG  35   5.234  -5.948   7.755
  664    HD3  ARG  35           HD3      ARG  35   4.135  -5.923   9.122
  665    HE   ARG  35           HE       ARG  35   3.471  -8.142   7.596
  666   HH11  ARG  35          HH11      ARG  35   6.198  -7.005   9.475
  667   HH12  ARG  35          HH12      ARG  35   6.798  -8.600   9.801
  668   HH21  ARG  35          HH21      ARG  35   4.265 -10.240   8.022
  669   HH22  ARG  35          HH22      ARG  35   5.704 -10.436   8.976
  670    H    LYS  36           H        LYS  36   1.185  -3.459   5.755
  671    HA   LYS  36           HA       LYS  36  -0.810  -4.666   7.319
  672    HB2  LYS  36           HB2      LYS  36  -0.484  -1.870   6.269
  673    HB3  LYS  36           HB3      LYS  36  -1.731  -2.350   7.380
  674    HG2  LYS  36           HG2      LYS  36   0.213  -3.098   8.864
  675    HG3  LYS  36           HG3      LYS  36   1.201  -2.175   7.818
  676    HD2  LYS  36           HD2      LYS  36   0.052  -0.257   8.396
  677    HD3  LYS  36           HD3      LYS  36  -1.181  -1.116   9.280
  678    HE2  LYS  36           HE2      LYS  36   0.542  -1.870  10.861
  679    HE3  LYS  36           HE3      LYS  36   1.753  -0.944   9.976
  680    HZ1  LYS  36           HZ1      LYS  36   0.959   0.222  11.939
  681    HZ2  LYS  36           HZ2      LYS  36  -0.623   0.195  11.342
  682    HZ3  LYS  36           HZ3      LYS  36   0.575   1.074  10.529
  683    H    VAL  37           H        VAL  37  -0.641  -3.134   4.224
  684    HA   VAL  37           HA       VAL  37  -3.283  -3.185   3.484
  685    HB   VAL  37           HB       VAL  37  -2.567  -3.140   1.182
  686   HG11  VAL  37          HG11      VAL  37  -2.281  -1.111   2.704
  687   HG12  VAL  37          HG12      VAL  37  -1.402  -1.100   1.178
  688   HG13  VAL  37          HG13      VAL  37  -0.554  -1.496   2.678
  689   HG21  VAL  37          HG21      VAL  37  -0.011  -3.091   0.832
  690   HG22  VAL  37          HG22      VAL  37  -0.907  -4.610   0.837
  691   HG23  VAL  37          HG23      VAL  37  -0.004  -4.112   2.278
  692    H    ILE  38           H        ILE  38  -0.831  -5.599   2.998
  693    HA   ILE  38           HA       ILE  38  -2.327  -7.505   1.574
  694    HB   ILE  38           HB       ILE  38  -0.054  -8.206   3.416
  695   HG12  ILE  38          HG12      ILE  38   0.066  -6.659   0.855
  696   HG13  ILE  38          HG13      ILE  38   0.876  -6.343   2.365
  697   HG21  ILE  38          HG21      ILE  38   0.471  -9.883   1.755
  698   HG22  ILE  38          HG22      ILE  38  -0.822  -9.289   0.719
  699   HG23  ILE  38          HG23      ILE  38  -1.211 -10.031   2.267
  700   HD11  ILE  38          HD11      ILE  38   2.251  -8.399   1.933
  701   HD12  ILE  38          HD12      ILE  38   2.521  -7.039   0.843
  702   HD13  ILE  38          HD13      ILE  38   1.556  -8.412   0.313
  703    H    SER  39           H        SER  39  -1.918  -6.674   4.881
  704    HA   SER  39           HA       SER  39  -3.074  -9.060   5.886
  705    HB2  SER  39           HB2      SER  39  -1.436  -7.718   7.189
  706    HB3  SER  39           HB3      SER  39  -2.626  -6.425   7.299
  707    HG   SER  39           HG       SER  39  -3.460  -8.938   8.134
  708    H    THR  40           H        THR  40  -4.162  -6.093   4.678
  709    HA   THR  40           HA       THR  40  -6.756  -6.104   5.942
  710    HB   THR  40           HB       THR  40  -5.642  -4.369   3.731
  711    HG1  THR  40           HG1      THR  40  -4.568  -4.250   5.826
  712   HG21  THR  40          HG21      THR  40  -7.441  -2.833   4.256
  713   HG22  THR  40          HG22      THR  40  -8.051  -3.928   5.499
  714   HG23  THR  40          HG23      THR  40  -8.109  -4.401   3.799
  715    H    SER  41           H        SER  41  -5.516  -6.522   2.610
  716    HA   SER  41           HA       SER  41  -8.211  -6.731   1.609
  717    HB2  SER  41           HB2      SER  41  -7.003  -6.906  -0.605
  718    HB3  SER  41           HB3      SER  41  -6.728  -5.428   0.316
  719    HG   SER  41           HG       SER  41  -4.784  -6.315  -0.512
  720    H    THR  42           H        THR  42  -5.967  -9.031   2.711
  721    HA   THR  42           HA       THR  42  -6.643 -11.045   0.767
  722    HB   THR  42           HB       THR  42  -5.332 -12.571   2.283
  723    HG1  THR  42           HG1      THR  42  -4.211 -10.425   3.615
  724   HG21  THR  42          HG21      THR  42  -4.016 -10.013   1.349
  725   HG22  THR  42          HG22      THR  42  -4.310 -11.451   0.369
  726   HG23  THR  42          HG23      THR  42  -3.175 -11.522   1.715
  727    H    SER  43           H        SER  43  -8.892  -9.996   1.976
  728    HA   SER  43           HA       SER  43 -10.125 -12.485   2.823
  729    HB2  SER  43           HB2      SER  43 -10.477  -9.912   4.391
  730    HB3  SER  43           HB3      SER  43 -11.330 -11.426   4.687
  731    HG   SER  43           HG       SER  43  -8.628 -11.766   4.635
  732    H    ASP  44           H        ASP  44  -9.953 -10.381   0.598
  733    HA   ASP  44           HA       ASP  44 -12.570  -9.206   0.461
  734    HB2  ASP  44           HB2      ASP  44 -10.721  -8.001  -0.517
  735    HB3  ASP  44           HB3      ASP  44 -10.306  -9.373  -1.537
  736    HA   PRO  45           HA       PRO  45 -14.474 -12.861  -1.197
  737    HB2  PRO  45           HB2      PRO  45 -16.882 -11.691  -1.759
  738    HB3  PRO  45           HB3      PRO  45 -16.398 -12.205  -0.152
  739    HG2  PRO  45           HG2      PRO  45 -16.379  -9.505  -1.384
  740    HG3  PRO  45           HG3      PRO  45 -16.832 -10.007   0.245
  741    HD2  PRO  45           HD2      PRO  45 -14.441  -8.861  -0.340
  742    HD3  PRO  45           HD3      PRO  45 -14.651 -10.028   0.982
  743    H    ASP  46           H        ASP  46 -14.171  -9.834  -2.926
  744    HA   ASP  46           HA       ASP  46 -14.159  -9.287  -5.135
  745    HB2  ASP  46           HB2      ASP  46 -12.204 -10.757  -5.120
  746    HB3  ASP  46           HB3      ASP  46 -13.233 -12.156  -5.409
  747    H    TYR  47           H        TYR  47 -16.423  -9.015  -5.173
  748    HA   TYR  47           HA       TYR  47 -18.547  -9.315  -5.800
  749    HB2  TYR  47           HB2      TYR  47 -17.285 -10.742  -8.108
  750    HB3  TYR  47           HB3      TYR  47 -18.825  -9.919  -8.073
  751    HD1  TYR  47           HD1      TYR  47 -15.261  -9.544  -8.484
  752    HD2  TYR  47           HD2      TYR  47 -18.913  -7.437  -7.920
  753    HE1  TYR  47           HE1      TYR  47 -14.174  -7.472  -9.235
  754    HE2  TYR  47           HE2      TYR  47 -17.835  -5.358  -8.671
  755    HH   TYR  47           HH       TYR  47 -14.814  -5.321 -10.220
  756    H    ALA  48           H        ALA  48 -18.514 -10.896  -3.894
  757    HA   ALA  48           HA       ALA  48 -19.563 -12.652  -2.934
  758    HB1  ALA  48           HB1      ALA  48 -21.178 -13.949  -4.180
  759    HB2  ALA  48           HB2      ALA  48 -20.538 -13.332  -5.702
  760    HB3  ALA  48           HB3      ALA  48 -21.339 -12.238  -4.575
  Start of MODEL   18
    1    H1   SER   0           H1       SER   0   4.170  14.959   4.303
    2    H2   SER   0           H2       SER   0   4.356  14.032   2.903
    3    H3   SER   0           H3       SER   0   3.504  13.401   4.225
    4    HA   SER   0           HA       SER   0   2.700  15.681   2.516
    5    HB2  SER   0           HB2      SER   0   2.381  13.467   1.482
    6    HB3  SER   0           HB3      SER   0   1.501  12.922   2.908
    7    HG   SER   0           HG       SER   0   0.678  15.166   1.388
    8    H    MET   1           H        MET   1   2.245  13.833   5.437
    9    HA   MET   1           HA       MET   1   1.246  14.297   7.403
   10    HB2  MET   1           HB2      MET   1   2.232  16.577   7.061
   11    HB3  MET   1           HB3      MET   1   0.709  17.069   6.336
   12    HG2  MET   1           HG2      MET   1  -0.447  16.572   8.435
   13    HG3  MET   1           HG3      MET   1   1.089  16.098   9.160
   14    HE1  MET   1           HE1      MET   1   0.515  19.070   6.634
   15    HE2  MET   1           HE2      MET   1   0.153  20.390   7.743
   16    HE3  MET   1           HE3      MET   1  -0.970  19.040   7.584
   17    H    ASP   2           H        ASP   2  -0.163  12.802   6.006
   18    HA   ASP   2           HA       ASP   2  -2.180  12.042   5.332
   19    HB2  ASP   2           HB2      ASP   2  -3.951  12.248   7.092
   20    HB3  ASP   2           HB3      ASP   2  -2.404  11.629   7.634
   21    H    GLU   3           H        GLU   3  -2.663  13.011   3.446
   22    HA   GLU   3           HA       GLU   3  -4.171  15.426   3.272
   23    HB2  GLU   3           HB2      GLU   3  -3.537  13.227   1.331
   24    HB3  GLU   3           HB3      GLU   3  -4.596  14.567   0.907
   25    HG2  GLU   3           HG2      GLU   3  -1.773  14.872   1.895
   26    HG3  GLU   3           HG3      GLU   3  -2.256  14.878   0.206
   27    H    THR   4           H        THR   4  -6.375  15.675   2.870
   28    HA   THR   4           HA       THR   4  -8.043  13.611   4.016
   29    HB   THR   4           HB       THR   4  -9.870  15.345   3.608
   30    HG1  THR   4           HG1      THR   4  -8.410  16.458   2.000
   31   HG21  THR   4          HG21      THR   4  -8.828  15.034   5.790
   32   HG22  THR   4          HG22      THR   4  -9.132  16.745   5.488
   33   HG23  THR   4          HG23      THR   4  -7.501  16.096   5.322
   34    H    VAL   5           H        VAL   5  -9.549  12.395   2.993
   35    HA   VAL   5           HA       VAL   5  -9.700  12.642   0.064
   36    HB   VAL   5           HB       VAL   5 -10.142  10.199   0.015
   37   HG11  VAL   5          HG11      VAL   5  -7.819   9.513   0.402
   38   HG12  VAL   5          HG12      VAL   5  -7.526  11.019   1.271
   39   HG13  VAL   5          HG13      VAL   5  -7.910  11.054  -0.450
   40   HG21  VAL   5          HG21      VAL   5  -9.606   8.858   1.976
   41   HG22  VAL   5          HG22      VAL   5 -10.944   9.960   2.305
   42   HG23  VAL   5          HG23      VAL   5  -9.330  10.328   2.908
   43    H    LYS   6           H        LYS   6 -11.706  12.310  -0.940
   44    HA   LYS   6           HA       LYS   6 -13.961  12.861   0.845
   45    HB2  LYS   6           HB2      LYS   6 -13.435  13.513  -2.017
   46    HB3  LYS   6           HB3      LYS   6 -15.057  13.598  -1.371
   47    HG2  LYS   6           HG2      LYS   6 -14.137  15.781  -1.315
   48    HG3  LYS   6           HG3      LYS   6 -14.189  15.181   0.336
   49    HD2  LYS   6           HD2      LYS   6 -11.788  14.551   0.115
   50    HD3  LYS   6           HD3      LYS   6 -11.782  15.343  -1.456
   51    HE2  LYS   6           HE2      LYS   6 -12.493  16.695   1.122
   52    HE3  LYS   6           HE3      LYS   6 -10.900  16.751   0.385
   53    HZ1  LYS   6           HZ1      LYS   6 -12.191  18.717  -0.143
   54    HZ2  LYS   6           HZ2      LYS   6 -13.410  17.770  -0.834
   55    HZ3  LYS   6           HZ3      LYS   6 -11.876  17.825  -1.546
   56    H    LEU   7           H        LEU   7 -15.991  12.258  -1.142
   57    HA   LEU   7           HA       LEU   7 -16.801   9.817  -0.262
   58    HB2  LEU   7           HB2      LEU   7 -18.397   9.729  -2.091
   59    HB3  LEU   7           HB3      LEU   7 -18.314  11.322  -1.389
   60    HG   LEU   7           HG       LEU   7 -16.833  10.663  -3.921
   61   HD11  LEU   7          HD11      LEU   7 -19.685  11.604  -3.653
   62   HD12  LEU   7          HD12      LEU   7 -19.157  10.051  -4.300
   63   HD13  LEU   7          HD13      LEU   7 -18.763  11.543  -5.154
   64   HD21  LEU   7          HD21      LEU   7 -16.216  12.717  -2.828
   65   HD22  LEU   7          HD22      LEU   7 -17.908  13.187  -2.691
   66   HD23  LEU   7          HD23      LEU   7 -17.148  13.089  -4.278
   67    H    ASN   8           H        ASN   8 -15.302  10.275  -3.502
   68    HA   ASN   8           HA       ASN   8 -14.519   7.459  -3.465
   69    HB2  ASN   8           HB2      ASN   8 -13.864   9.658  -5.448
   70    HB3  ASN   8           HB3      ASN   8 -13.325   8.006  -5.596
   71   HD21  ASN   8          HD21      ASN   8 -14.320   7.774  -7.559
   72   HD22  ASN   8          HD22      ASN   8 -16.034   7.609  -7.722
   73    H    HIS   9           H        HIS   9 -12.993   7.151  -1.939
   74    HA   HIS   9           HA       HIS   9 -11.211   9.112  -1.047
   75    HB2  HIS   9           HB2      HIS   9 -10.931   6.117  -0.909
   76    HB3  HIS   9           HB3      HIS   9  -9.940   7.253  -0.021
   77    HD1  HIS   9           HD1      HIS   9 -10.633   6.828   2.341
   78    HD2  HIS   9           HD2      HIS   9 -13.892   7.337  -0.191
   79    HE1  HIS   9           HE1      HIS   9 -12.646   6.905   3.837
   80    HE2  HIS   9           HE2      HIS   9 -14.579   7.386   2.300
   81    H    THR  10           H        THR  10  -9.249   9.716  -1.705
   82    HA   THR  10           HA       THR  10  -8.584   8.988  -4.422
   83    HB   THR  10           HB       THR  10  -7.269  11.023  -2.595
   84    HG1  THR  10           HG1      THR  10  -8.759  12.092  -4.562
   85   HG21  THR  10          HG21      THR  10  -6.470  12.028  -4.720
   86   HG22  THR  10          HG22      THR  10  -7.128  10.646  -5.594
   87   HG23  THR  10          HG23      THR  10  -5.814  10.416  -4.443
   88    H    CYS  11           H        CYS  11  -6.899   7.839  -5.063
   89    HA   CYS  11           HA       CYS  11  -5.583   6.167  -3.180
   90    HB2  CYS  11           HB2      CYS  11  -6.136   5.686  -5.620
   91    HB3  CYS  11           HB3      CYS  11  -4.748   6.678  -6.024
   92    H    VAL  12           H        VAL  12  -3.878   6.632  -1.979
   93    HA   VAL  12           HA       VAL  12  -2.224   8.878  -2.224
   94    HB   VAL  12           HB       VAL  12  -0.586   7.606  -0.837
   95   HG11  VAL  12          HG11      VAL  12  -2.054   7.346   1.134
   96   HG12  VAL  12          HG12      VAL  12  -3.453   7.566   0.081
   97   HG13  VAL  12          HG13      VAL  12  -2.285   8.873   0.283
   98   HG21  VAL  12          HG21      VAL  12  -0.955   5.379  -1.717
   99   HG22  VAL  12          HG22      VAL  12  -2.605   5.382  -1.092
  100   HG23  VAL  12          HG23      VAL  12  -1.239   5.399   0.024
  101    H    ILE  13           H        ILE  13  -2.350   6.011  -4.071
  102    HA   ILE  13           HA       ILE  13   0.439   6.135  -4.841
  103    HB   ILE  13           HB       ILE  13  -1.620   4.265  -5.941
  104   HG12  ILE  13          HG12      ILE  13  -1.605   4.110  -3.481
  105   HG13  ILE  13          HG13      ILE  13  -0.970   2.659  -4.245
  106   HG21  ILE  13          HG21      ILE  13   0.307   2.849  -6.389
  107   HG22  ILE  13          HG22      ILE  13   1.368   4.074  -5.693
  108   HG23  ILE  13          HG23      ILE  13   0.469   4.420  -7.171
  109   HD11  ILE  13          HD11      ILE  13   0.288   3.401  -2.290
  110   HD12  ILE  13          HD12      ILE  13   0.707   4.874  -3.162
  111   HD13  ILE  13          HD13      ILE  13   1.252   3.307  -3.765
  112    H    CYS  14           H        CYS  14  -2.634   5.958  -6.646
  113    HA   CYS  14           HA       CYS  14  -1.240   7.167  -8.871
  114    HB2  CYS  14           HB2      CYS  14  -3.072   6.284 -10.255
  115    HB3  CYS  14           HB3      CYS  14  -2.214   5.038  -9.386
  116    H    ASP  15           H        ASP  15  -2.899   8.243  -6.390
  117    HA   ASP  15           HA       ASP  15  -4.063  10.103  -5.866
  118    HB2  ASP  15           HB2      ASP  15  -2.428  10.911  -8.175
  119    HB3  ASP  15           HB3      ASP  15  -3.626  12.044  -7.587
  120    H    GLN  16           H        GLN  16  -5.503   8.175  -7.421
  121    HA   GLN  16           HA       GLN  16  -7.350   9.882  -8.889
  122    HB2  GLN  16           HB2      GLN  16  -6.947   6.895  -8.936
  123    HB3  GLN  16           HB3      GLN  16  -8.173   7.751  -9.854
  124    HG2  GLN  16           HG2      GLN  16  -5.220   8.056 -10.134
  125    HG3  GLN  16           HG3      GLN  16  -6.278   7.226 -11.229
  126   HE21  GLN  16          HE21      GLN  16  -5.089  10.214 -10.201
  127   HE22  GLN  16          HE22      GLN  16  -5.837  11.138 -11.431
  128    H    GLU  17           H        GLU  17  -9.501   9.780  -8.449
  129    HA   GLU  17           HA       GLU  17 -10.183   9.298  -5.698
  130    HB2  GLU  17           HB2      GLU  17 -11.782  10.492  -7.968
  131    HB3  GLU  17           HB3      GLU  17 -12.308  10.420  -6.294
  132    HG2  GLU  17           HG2      GLU  17 -10.720  11.948  -5.602
  133    HG3  GLU  17           HG3      GLU  17  -9.739  11.720  -7.042
  134    H    LYS  18           H        LYS  18 -10.586   7.308  -5.232
  135    HA   LYS  18           HA       LYS  18 -12.258   5.668  -7.021
  136    HB2  LYS  18           HB2      LYS  18 -10.405   4.353  -5.181
  137    HB3  LYS  18           HB3      LYS  18 -10.915   3.862  -6.766
  138    HG2  LYS  18           HG2      LYS  18  -8.878   5.962  -6.127
  139    HG3  LYS  18           HG3      LYS  18  -8.558   4.346  -6.746
  140    HD2  LYS  18           HD2      LYS  18 -10.302   6.226  -8.247
  141    HD3  LYS  18           HD3      LYS  18  -8.572   6.355  -8.351
  142    HE2  LYS  18           HE2      LYS  18  -9.231   5.058 -10.184
  143    HE3  LYS  18           HE3      LYS  18  -8.566   3.960  -8.999
  144    HZ1  LYS  18           HZ1      LYS  18 -10.776   3.313  -8.350
  145    HZ2  LYS  18           HZ2      LYS  18 -10.588   3.108 -10.011
  146    HZ3  LYS  18           HZ3      LYS  18 -11.452   4.432  -9.421
  147    H    ASN  19           H        ASN  19 -13.899   4.491  -6.095
  148    HA   ASN  19           HA       ASN  19 -14.271   4.976  -3.227
  149    HB2  ASN  19           HB2      ASN  19 -16.595   4.586  -3.528
  150    HB3  ASN  19           HB3      ASN  19 -16.092   5.618  -4.856
  151   HD21  ASN  19          HD21      ASN  19 -18.359   3.749  -4.543
  152   HD22  ASN  19          HD22      ASN  19 -18.251   2.672  -5.927
  153    H    ARG  20           H        ARG  20 -12.780   2.794  -4.986
  154    HA   ARG  20           HA       ARG  20 -13.514   0.584  -3.210
  155    HB2  ARG  20           HB2      ARG  20 -13.181   0.501  -6.191
  156    HB3  ARG  20           HB3      ARG  20 -13.007  -0.942  -5.209
  157    HG2  ARG  20           HG2      ARG  20 -15.276  -0.599  -4.362
  158    HG3  ARG  20           HG3      ARG  20 -15.451   0.785  -5.428
  159    HD2  ARG  20           HD2      ARG  20 -14.742  -0.898  -7.221
  160    HD3  ARG  20           HD3      ARG  20 -15.204  -2.116  -6.059
  161    HE   ARG  20           HE       ARG  20 -17.362  -0.484  -6.138
  162   HH11  ARG  20          HH11      ARG  20 -15.541  -2.176  -8.598
  163   HH12  ARG  20          HH12      ARG  20 -16.902  -2.380  -9.654
  164   HH21  ARG  20          HH21      ARG  20 -19.169  -0.762  -7.528
  165   HH22  ARG  20          HH22      ARG  20 -18.962  -1.588  -9.038
  166    H    GLY  21           H        GLY  21 -11.876  -0.244  -2.173
  167    HA2  GLY  21           HA2      GLY  21  -9.413  -1.045  -2.779
  168    HA3  GLY  21           HA3      GLY  21  -9.162   0.691  -2.694
  169    H    ILE  22           H        ILE  22  -7.760   0.293  -0.717
  170    HA   ILE  22           HA       ILE  22  -9.448  -0.391   1.583
  171    HB   ILE  22           HB       ILE  22  -7.776  -1.609   2.575
  172   HG12  ILE  22          HG12      ILE  22  -5.827  -0.095   0.873
  173   HG13  ILE  22          HG13      ILE  22  -6.151   0.169   2.545
  174   HG21  ILE  22          HG21      ILE  22  -6.558  -2.957   0.811
  175   HG22  ILE  22          HG22      ILE  22  -7.342  -1.921  -0.384
  176   HG23  ILE  22          HG23      ILE  22  -8.318  -2.920   0.691
  177   HD11  ILE  22          HD11      ILE  22  -4.964  -2.330   1.397
  178   HD12  ILE  22          HD12      ILE  22  -5.255  -2.006   3.108
  179   HD13  ILE  22          HD13      ILE  22  -4.072  -1.048   2.216
  180    H    HIS  23           H        HIS  23  -8.043   0.320   3.586
  181    HA   HIS  23           HA       HIS  23  -6.892   2.924   3.356
  182    HB2  HIS  23           HB2      HIS  23  -8.571   4.121   4.695
  183    HB3  HIS  23           HB3      HIS  23  -9.263   3.551   3.195
  184    HD1  HIS  23           HD1      HIS  23  -9.740   3.504   6.824
  185    HD2  HIS  23           HD2      HIS  23 -10.967   1.297   3.545
  186    HE1  HIS  23           HE1      HIS  23 -11.709   2.163   7.625
  187    HE2  HIS  23           HE2      HIS  23 -12.430   0.802   5.629
  188    H    LEU  24           H        LEU  24  -5.281   2.857   4.758
  189    HA   LEU  24           HA       LEU  24  -5.332   0.941   6.905
  190    HB2  LEU  24           HB2      LEU  24  -3.231   2.807   5.835
  191    HB3  LEU  24           HB3      LEU  24  -2.978   1.744   7.168
  192    HG   LEU  24           HG       LEU  24  -3.618   0.857   4.371
  193   HD11  LEU  24          HD11      LEU  24  -1.066   0.695   5.967
  194   HD12  LEU  24          HD12      LEU  24  -1.360   1.743   4.581
  195   HD13  LEU  24          HD13      LEU  24  -1.329  -0.006   4.373
  196   HD21  LEU  24          HD21      LEU  24  -3.003  -0.723   6.863
  197   HD22  LEU  24          HD22      LEU  24  -3.119  -1.395   5.236
  198   HD23  LEU  24          HD23      LEU  24  -4.541  -0.682   5.997
  199    H    TYR  25           H        TYR  25  -4.324   4.302   6.645
  200    HA   TYR  25           HA       TYR  25  -5.129   4.730   9.399
  201    HB2  TYR  25           HB2      TYR  25  -3.469   6.428   7.578
  202    HB3  TYR  25           HB3      TYR  25  -3.837   6.834   9.239
  203    HD1  TYR  25           HD1      TYR  25  -3.238   3.337   8.542
  204    HD2  TYR  25           HD2      TYR  25  -1.342   6.999   9.558
  205    HE1  TYR  25           HE1      TYR  25  -1.260   2.091   9.251
  206    HE2  TYR  25           HE2      TYR  25   0.644   5.763  10.297
  207    HH   TYR  25           HH       TYR  25   1.318   3.597  11.004
  208    H    THR  26           H        THR  26  -4.998   7.581   7.633
  209    HA   THR  26           HA       THR  26  -7.898   7.551   7.174
  210    HB   THR  26           HB       THR  26  -7.208   9.423   8.531
  211    HG1  THR  26           HG1      THR  26  -8.032   9.921   5.902
  212   HG21  THR  26          HG21      THR  26  -5.276  10.129   6.326
  213   HG22  THR  26          HG22      THR  26  -4.844   9.447   7.894
  214   HG23  THR  26          HG23      THR  26  -5.561  11.058   7.799
  215    H    LYS  27           H        LYS  27  -5.325   6.596   5.604
  216    HA   LYS  27           HA       LYS  27  -5.633   8.160   3.160
  217    HB2  LYS  27           HB2      LYS  27  -3.797   5.992   2.857
  218    HB3  LYS  27           HB3      LYS  27  -3.484   7.719   2.812
  219    HG2  LYS  27           HG2      LYS  27  -3.630   6.083   5.324
  220    HG3  LYS  27           HG3      LYS  27  -2.158   6.487   4.459
  221    HD2  LYS  27           HD2      LYS  27  -4.096   8.515   5.521
  222    HD3  LYS  27           HD3      LYS  27  -2.656   7.986   6.381
  223    HE2  LYS  27           HE2      LYS  27  -1.759   8.645   3.832
  224    HE3  LYS  27           HE3      LYS  27  -2.950   9.888   4.217
  225    HZ1  LYS  27           HZ1      LYS  27  -0.647   9.126   5.944
  226    HZ2  LYS  27           HZ2      LYS  27  -1.743  10.376   6.247
  227    HZ3  LYS  27           HZ3      LYS  27  -0.680  10.483   4.932
  228    H    PHE  28           H        PHE  28  -5.093   6.652   1.199
  229    HA   PHE  28           HA       PHE  28  -6.765   4.283   1.200
  230    HB2  PHE  28           HB2      PHE  28  -8.346   6.075   0.781
  231    HB3  PHE  28           HB3      PHE  28  -7.326   6.727  -0.493
  232    HD1  PHE  28           HD1      PHE  28  -9.491   3.866   0.410
  233    HD2  PHE  28           HD2      PHE  28  -7.366   5.886  -2.662
  234    HE1  PHE  28           HE1      PHE  28 -10.594   2.457  -1.286
  235    HE2  PHE  28           HE2      PHE  28  -8.457   4.492  -4.353
  236    HZ   PHE  28           HZ       PHE  28 -10.063   2.758  -3.682
  237    H    ILE  29           H        ILE  29  -5.365   2.846   0.335
  238    HA   ILE  29           HA       ILE  29  -4.082   3.583  -2.203
  239    HB   ILE  29           HB       ILE  29  -3.938   0.914  -0.766
  240   HG12  ILE  29          HG12      ILE  29  -1.398   1.717  -0.679
  241   HG13  ILE  29          HG13      ILE  29  -2.140   3.307  -0.687
  242   HG21  ILE  29          HG21      ILE  29  -2.460   1.956  -3.174
  243   HG22  ILE  29          HG22      ILE  29  -3.748   0.746  -3.189
  244   HG23  ILE  29          HG23      ILE  29  -2.197   0.391  -2.408
  245   HD11  ILE  29          HD11      ILE  29  -3.239   2.920   1.349
  246   HD12  ILE  29          HD12      ILE  29  -1.600   2.293   1.566
  247   HD13  ILE  29          HD13      ILE  29  -2.938   1.184   1.266
  248    H    CYS  30           H        CYS  30  -5.185   3.158  -4.053
  249    HA   CYS  30           HA       CYS  30  -7.773   1.982  -3.833
  250    HB2  CYS  30           HB2      CYS  30  -8.104   2.476  -6.078
  251    HB3  CYS  30           HB3      CYS  30  -6.944   3.702  -5.596
  252    H    LEU  31           H        LEU  31  -8.482   0.174  -4.876
  253    HA   LEU  31           HA       LEU  31  -7.327  -2.089  -3.927
  254    HB2  LEU  31           HB2      LEU  31  -9.128  -3.171  -4.871
  255    HB3  LEU  31           HB3      LEU  31  -9.712  -1.564  -4.627
  256    HG   LEU  31           HG       LEU  31  -8.911  -1.312  -7.160
  257   HD11  LEU  31          HD11      LEU  31  -9.456  -3.297  -8.440
  258   HD12  LEU  31          HD12      LEU  31  -9.755  -4.197  -6.955
  259   HD13  LEU  31          HD13      LEU  31  -8.129  -3.626  -7.327
  260   HD21  LEU  31          HD21      LEU  31 -11.124  -0.795  -6.303
  261   HD22  LEU  31          HD22      LEU  31 -11.529  -2.510  -6.278
  262   HD23  LEU  31          HD23      LEU  31 -11.232  -1.698  -7.813
  263    H    ASP  32           H        ASP  32  -6.517  -0.443  -6.746
  264    HA   ASP  32           HA       ASP  32  -5.628  -2.703  -8.309
  265    HB2  ASP  32           HB2      ASP  32  -6.579  -0.677  -9.333
  266    HB3  ASP  32           HB3      ASP  32  -5.254   0.237  -8.677
  267    H    CYS  33           H        CYS  33  -4.329   0.049  -6.724
  268    HA   CYS  33           HA       CYS  33  -1.604  -0.602  -7.016
  269    HB2  CYS  33           HB2      CYS  33  -2.902   1.438  -5.231
  270    HB3  CYS  33           HB3      CYS  33  -1.195   1.267  -5.507
  271    H    GLU  34           H        GLU  34  -4.033  -1.021  -4.643
  272    HA   GLU  34           HA       GLU  34  -2.505  -1.737  -2.455
  273    HB2  GLU  34           HB2      GLU  34  -4.861  -1.225  -2.299
  274    HB3  GLU  34           HB3      GLU  34  -5.263  -2.584  -3.300
  275    HG2  GLU  34           HG2      GLU  34  -3.837  -3.189  -0.824
  276    HG3  GLU  34           HG3      GLU  34  -5.480  -2.626  -0.670
  277    H    ARG  35           H        ARG  35  -3.778  -3.692  -5.078
  278    HA   ARG  35           HA       ARG  35  -2.443  -6.023  -4.081
  279    HB2  ARG  35           HB2      ARG  35  -3.070  -7.173  -6.117
  280    HB3  ARG  35           HB3      ARG  35  -4.447  -6.301  -5.470
  281    HG2  ARG  35           HG2      ARG  35  -4.069  -4.531  -7.135
  282    HG3  ARG  35           HG3      ARG  35  -2.750  -5.479  -7.800
  283    HD2  ARG  35           HD2      ARG  35  -5.613  -6.280  -7.652
  284    HD3  ARG  35           HD3      ARG  35  -4.742  -5.823  -9.104
  285    HE   ARG  35           HE       ARG  35  -3.363  -7.948  -7.997
  286   HH11  ARG  35          HH11      ARG  35  -6.553  -7.369  -9.309
  287   HH12  ARG  35          HH12      ARG  35  -6.782  -9.013  -9.817
  288   HH21  ARG  35          HH21      ARG  35  -3.662 -10.116  -8.670
  289   HH22  ARG  35          HH22      ARG  35  -5.135 -10.571  -9.469
  290    H    LYS  36           H        LYS  36  -1.484  -3.371  -5.962
  291    HA   LYS  36           HA       LYS  36   0.510  -4.556  -7.561
  292    HB2  LYS  36           HB2      LYS  36   0.301  -1.768  -6.540
  293    HB3  LYS  36           HB3      LYS  36   1.463  -2.288  -7.728
  294    HG2  LYS  36           HG2      LYS  36  -0.546  -2.907  -9.138
  295    HG3  LYS  36           HG3      LYS  36  -1.500  -2.055  -8.001
  296    HD2  LYS  36           HD2      LYS  36  -0.487  -0.092  -8.531
  297    HD3  LYS  36           HD3      LYS  36   0.870  -0.837  -9.327
  298    HE2  LYS  36           HE2      LYS  36  -0.624  -1.581 -11.111
  299    HE3  LYS  36           HE3      LYS  36  -1.986  -0.820 -10.294
  300    HZ1  LYS  36           HZ1      LYS  36  -1.132   0.560 -12.076
  301    HZ2  LYS  36           HZ2      LYS  36   0.395   0.592 -11.361
  302    HZ3  LYS  36           HZ3      LYS  36  -0.914   1.328 -10.583
  303    H    VAL  37           H        VAL  37   0.360  -3.108  -4.436
  304    HA   VAL  37           HA       VAL  37   3.038  -2.937  -3.843
  305    HB   VAL  37           HB       VAL  37   2.406  -2.950  -1.487
  306   HG11  VAL  37          HG11      VAL  37   2.088  -0.917  -2.963
  307   HG12  VAL  37          HG12      VAL  37   1.146  -0.942  -1.473
  308   HG13  VAL  37          HG13      VAL  37   0.372  -1.345  -3.010
  309   HG21  VAL  37          HG21      VAL  37  -0.122  -2.981  -1.053
  310   HG22  VAL  37          HG22      VAL  37   0.772  -4.496  -1.172
  311   HG23  VAL  37          HG23      VAL  37  -0.188  -3.927  -2.546
  312    H    ILE  38           H        ILE  38   0.790  -5.512  -3.172
  313    HA   ILE  38           HA       ILE  38   2.432  -7.255  -1.738
  314    HB   ILE  38           HB       ILE  38   0.303  -8.248  -3.607
  315   HG12  ILE  38          HG12      ILE  38  -0.106  -6.617  -1.126
  316   HG13  ILE  38          HG13      ILE  38  -0.816  -6.387  -2.703
  317   HG21  ILE  38          HG21      ILE  38   1.423  -9.950  -2.404
  318   HG22  ILE  38          HG22      ILE  38  -0.165  -9.752  -1.662
  319   HG23  ILE  38          HG23      ILE  38   1.263  -9.070  -0.888
  320   HD11  ILE  38          HD11      ILE  38  -1.440  -8.840  -1.127
  321   HD12  ILE  38          HD12      ILE  38  -2.378  -8.060  -2.402
  322   HD13  ILE  38          HD13      ILE  38  -2.274  -7.324  -0.799
  323    H    SER  39           H        SER  39   1.865  -6.638  -5.072
  324    HA   SER  39           HA       SER  39   3.173  -8.939  -5.986
  325    HB2  SER  39           HB2      SER  39   2.372  -6.433  -7.459
  326    HB3  SER  39           HB3      SER  39   2.800  -7.964  -8.189
  327    HG   SER  39           HG       SER  39   0.556  -7.396  -6.565
  328    H    THR  40           H        THR  40   4.074  -5.749  -5.164
  329    HA   THR  40           HA       THR  40   6.538  -5.678  -6.652
  330    HB   THR  40           HB       THR  40   5.430  -3.833  -4.529
  331    HG1  THR  40           HG1      THR  40   4.208  -3.983  -6.514
  332   HG21  THR  40          HG21      THR  40   7.882  -3.656  -4.766
  333   HG22  THR  40          HG22      THR  40   7.039  -2.202  -5.300
  334   HG23  THR  40          HG23      THR  40   7.673  -3.340  -6.490
  335    H    SER  41           H        SER  41   5.578  -6.088  -3.256
  336    HA   SER  41           HA       SER  41   8.287  -5.912  -2.323
  337    HB2  SER  41           HB2      SER  41   7.223  -6.442  -0.110
  338    HB3  SER  41           HB3      SER  41   6.564  -5.027  -0.929
  339    HG   SER  41           HG       SER  41   4.843  -6.239  -0.225
  340    H    THR  42           H        THR  42   6.271  -8.493  -3.377
  341    HA   THR  42           HA       THR  42   7.445 -10.502  -1.701
  342    HB   THR  42           HB       THR  42   6.179 -12.077  -3.251
  343    HG1  THR  42           HG1      THR  42   4.611  -9.968  -4.120
  344   HG21  THR  42          HG21      THR  42   4.663  -9.874  -1.838
  345   HG22  THR  42          HG22      THR  42   5.312 -11.333  -1.085
  346   HG23  THR  42          HG23      THR  42   4.014 -11.457  -2.270
  347    H    SER  43           H        SER  43   9.436  -9.152  -3.019
  348    HA   SER  43           HA       SER  43  10.931 -11.329  -4.073
  349    HB2  SER  43           HB2      SER  43   9.585 -10.577  -6.092
  350    HB3  SER  43           HB3      SER  43  10.423  -9.030  -5.986
  351    HG   SER  43           HG       SER  43  11.658 -11.567  -6.328
  352    H    ASP  44           H        ASP  44  10.840  -9.208  -1.999
  353    HA   ASP  44           HA       ASP  44  13.326  -7.757  -2.636
  354    HB2  ASP  44           HB2      ASP  44  11.482  -6.192  -2.507
  355    HB3  ASP  44           HB3      ASP  44  10.968  -6.864  -0.966
  356    HA   PRO  45           HA       PRO  45  14.545 -10.149   1.012
  357    HB2  PRO  45           HB2      PRO  45  17.220  -9.984   0.013
  358    HB3  PRO  45           HB3      PRO  45  16.198 -11.388   0.096
  359    HG2  PRO  45           HG2      PRO  45  17.057 -10.138  -2.185
  360    HG3  PRO  45           HG3      PRO  45  15.678 -11.187  -2.032
  361    HD2  PRO  45           HD2      PRO  45  15.763  -8.253  -2.177
  362    HD3  PRO  45           HD3      PRO  45  14.549  -9.361  -2.831
  363    H    ASP  46           H        ASP  46  16.369  -9.674   2.624
  364    HA   ASP  46           HA       ASP  46  16.222  -6.915   3.333
  365    HB2  ASP  46           HB2      ASP  46  17.762  -9.237   4.495
  366    HB3  ASP  46           HB3      ASP  46  17.848  -7.611   5.162
  367    H    TYR  47           H        TYR  47  19.110  -8.931   2.881
  368    HA   TYR  47           HA       TYR  47  20.427  -6.655   1.572
  369    HB2  TYR  47           HB2      TYR  47  21.666  -8.688   3.405
  370    HB3  TYR  47           HB3      TYR  47  22.526  -7.403   2.587
  371    HD1  TYR  47           HD1      TYR  47  20.465  -8.297   5.424
  372    HD2  TYR  47           HD2      TYR  47  22.150  -5.038   3.270
  373    HE1  TYR  47           HE1      TYR  47  20.059  -6.824   7.346
  374    HE2  TYR  47           HE2      TYR  47  21.746  -3.556   5.190
  375    HH   TYR  47           HH       TYR  47  20.337  -3.417   7.144
  376    H    ALA  48           H        ALA  48  18.923  -8.886   0.467
  377    HA   ALA  48           HA       ALA  48  18.983 -10.501  -1.115
  378    HB1  ALA  48           HB1      ALA  48  20.708 -10.375  -2.825
  379    HB2  ALA  48           HB2      ALA  48  21.681  -9.332  -1.791
  380    HB3  ALA  48           HB3      ALA  48  20.134  -8.759  -2.410
  381    H1   SER   0           H1       SER   0  -3.979  15.025  -4.593
  382    H2   SER   0           H2       SER   0  -4.187  14.118  -3.185
  383    H3   SER   0           H3       SER   0  -3.350  13.454  -4.503
  384    HA   SER   0           HA       SER   0  -2.494  15.724  -2.806
  385    HB2  SER   0           HB2      SER   0  -2.225  13.506  -1.769
  386    HB3  SER   0           HB3      SER   0  -1.360  12.938  -3.195
  387    HG   SER   0           HG       SER   0  -0.479  15.167  -1.689
  388    H    MET   1           H        MET   1  -2.087  13.863  -5.727
  389    HA   MET   1           HA       MET   1  -1.077  14.296  -7.691
  390    HB2  MET   1           HB2      MET   1  -2.022  16.594  -7.355
  391    HB3  MET   1           HB3      MET   1  -0.490  17.062  -6.634
  392    HG2  MET   1           HG2      MET   1   0.652  16.542  -8.735
  393    HG3  MET   1           HG3      MET   1  -0.892  16.092  -9.455
  394    HE1  MET   1           HE1      MET   1  -0.257  19.062  -6.937
  395    HE2  MET   1           HE2      MET   1   0.124  20.373  -8.053
  396    HE3  MET   1           HE3      MET   1   1.223  19.003  -7.894
  397    H    ASP   2           H        ASP   2   0.304  12.781  -6.301
  398    HA   ASP   2           HA       ASP   2   2.310  11.989  -5.617
  399    HB2  ASP   2           HB2      ASP   2   4.082  12.160  -7.379
  400    HB3  ASP   2           HB3      ASP   2   2.523  11.569  -7.922
  401    H    GLU   3           H        GLU   3   2.811  12.959  -3.734
  402    HA   GLU   3           HA       GLU   3   4.359  15.350  -3.566
  403    HB2  GLU   3           HB2      GLU   3   3.689  13.167  -1.618
  404    HB3  GLU   3           HB3      GLU   3   4.768  14.493  -1.198
  405    HG2  GLU   3           HG2      GLU   3   1.951  14.839  -2.189
  406    HG3  GLU   3           HG3      GLU   3   2.433  14.843  -0.499
  407    H    THR   4           H        THR   4   6.571  15.563  -3.167
  408    HA   THR   4           HA       THR   4   8.197  13.460  -4.305
  409    HB   THR   4           HB       THR   4  10.060  15.161  -3.905
  410    HG1  THR   4           HG1      THR   4   8.618  16.307  -2.299
  411   HG21  THR   4          HG21      THR   4   9.010  14.863  -6.087
  412   HG22  THR   4          HG22      THR   4   9.345  16.569  -5.791
  413   HG23  THR   4          HG23      THR   4   7.701  15.952  -5.621
  414    H    VAL   5           H        VAL   5   9.684  12.224  -3.278
  415    HA   VAL   5           HA       VAL   5   9.846  12.477  -0.352
  416    HB   VAL   5           HB       VAL   5  10.240  10.025  -0.293
  417   HG11  VAL   5          HG11      VAL   5   7.904   9.380  -0.676
  418   HG12  VAL   5          HG12      VAL   5   7.639  10.888  -1.549
  419   HG13  VAL   5          HG13      VAL   5   8.023  10.924   0.170
  420   HG21  VAL   5          HG21      VAL   5   9.678   8.685  -2.248
  421   HG22  VAL   5          HG22      VAL   5  11.034   9.762  -2.584
  422   HG23  VAL   5          HG23      VAL   5   9.425  10.158  -3.185
  423    H    LYS   6           H        LYS   6  11.847  12.111   0.644
  424    HA   LYS   6           HA       LYS   6  14.112  12.613  -1.138
  425    HB2  LYS   6           HB2      LYS   6  13.593  13.281   1.721
  426    HB3  LYS   6           HB3      LYS   6  15.215  13.338   1.077
  427    HG2  LYS   6           HG2      LYS   6  14.335  15.534   1.014
  428    HG3  LYS   6           HG3      LYS   6  14.374  14.929  -0.635
  429    HD2  LYS   6           HD2      LYS   6  11.962  14.344  -0.410
  430    HD3  LYS   6           HD3      LYS   6  11.972  15.140   1.160
  431    HE2  LYS   6           HE2      LYS   6  12.705  16.468  -1.424
  432    HE3  LYS   6           HE3      LYS   6  11.114  16.560  -0.681
  433    HZ1  LYS   6           HZ1      LYS   6  12.451  18.499  -0.161
  434    HZ2  LYS   6           HZ2      LYS   6  13.650  17.529   0.526
  435    HZ3  LYS   6           HZ3      LYS   6  12.122  17.618   1.242
  436    H    LEU   7           H        LEU   7  16.126  11.984   0.853
  437    HA   LEU   7           HA       LEU   7  16.891   9.523  -0.015
  438    HB2  LEU   7           HB2      LEU   7  18.487   9.413   1.813
  439    HB3  LEU   7           HB3      LEU   7  18.434  11.005   1.106
  440    HG   LEU   7           HG       LEU   7  16.941  10.377   3.638
  441   HD11  LEU   7          HD11      LEU   7  19.808  11.271   3.369
  442   HD12  LEU   7          HD12      LEU   7  19.254   9.727   4.017
  443   HD13  LEU   7          HD13      LEU   7  18.884  11.225   4.870
  444   HD21  LEU   7          HD21      LEU   7  16.360  12.440   2.539
  445   HD22  LEU   7          HD22      LEU   7  18.059  12.881   2.406
  446   HD23  LEU   7          HD23      LEU   7  17.294  12.797   3.991
  447    H    ASN   8           H        ASN   8  15.405  10.016   3.230
  448    HA   ASN   8           HA       ASN   8  14.562   7.216   3.194
  449    HB2  ASN   8           HB2      ASN   8  13.952   9.429   5.178
  450    HB3  ASN   8           HB3      ASN   8  13.382   7.789   5.327
  451   HD21  ASN   8          HD21      ASN   8  14.380   7.549   7.293
  452   HD22  ASN   8          HD22      ASN   8  16.091   7.347   7.450
  453    H    HIS   9           H        HIS   9  13.038   6.937   1.671
  454    HA   HIS   9           HA       HIS   9  11.288   8.922   0.773
  455    HB2  HIS   9           HB2      HIS   9  10.959   5.931   0.644
  456    HB3  HIS   9           HB3      HIS   9   9.985   7.080  -0.247
  457    HD1  HIS   9           HD1      HIS   9  10.673   6.631  -2.606
  458    HD2  HIS   9           HD2      HIS   9  13.935   7.100  -0.077
  459    HE1  HIS   9           HE1      HIS   9  12.688   6.669  -4.101
  460    HE2  HIS   9           HE2      HIS   9  14.626   7.124  -2.565
  461    H    THR  10           H        THR  10   9.336   9.559   1.425
  462    HA   THR  10           HA       THR  10   8.661   8.854   4.145
  463    HB   THR  10           HB       THR  10   7.381  10.909   2.316
  464    HG1  THR  10           HG1      THR  10   8.880  11.941   4.298
  465   HG21  THR  10          HG21      THR  10   6.597  11.929   4.436
  466   HG22  THR  10          HG22      THR  10   7.232  10.538   5.314
  467   HG23  THR  10          HG23      THR  10   5.913  10.328   4.163
  468    H    CYS  11           H        CYS  11   6.955   7.739   4.793
  469    HA   CYS  11           HA       CYS  11   5.607   6.082   2.917
  470    HB2  CYS  11           HB2      CYS  11   6.155   5.602   5.359
  471    HB3  CYS  11           HB3      CYS  11   4.786   6.618   5.760
  472    H    VAL  12           H        VAL  12   3.914   6.577   1.714
  473    HA   VAL  12           HA       VAL  12   2.299   8.852   1.953
  474    HB   VAL  12           HB       VAL  12   0.638   7.602   0.573
  475   HG11  VAL  12          HG11      VAL  12   2.097   7.310  -1.399
  476   HG12  VAL  12          HG12      VAL  12   3.501   7.507  -0.350
  477   HG13  VAL  12          HG13      VAL  12   2.357   8.836  -0.555
  478   HG21  VAL  12          HG21      VAL  12   0.968   5.373   1.456
  479   HG22  VAL  12          HG22      VAL  12   2.619   5.345   0.834
  480   HG23  VAL  12          HG23      VAL  12   1.255   5.382  -0.283
  481    H    ILE  13           H        ILE  13   2.376   5.988   3.807
  482    HA   ILE  13           HA       ILE  13  -0.410   6.165   4.579
  483    HB   ILE  13           HB       ILE  13   1.616   4.260   5.685
  484   HG12  ILE  13          HG12      ILE  13   1.595   4.097   3.226
  485   HG13  ILE  13          HG13      ILE  13   0.934   2.661   3.994
  486   HG21  ILE  13          HG21      ILE  13  -0.336   2.881   6.140
  487   HG22  ILE  13          HG22      ILE  13  -1.376   4.121   5.440
  488   HG23  ILE  13          HG23      ILE  13  -0.469   4.458   6.915
  489   HD11  ILE  13          HD11      ILE  13  -0.312   3.417   2.038
  490   HD12  ILE  13          HD12      ILE  13  -0.701   4.901   2.903
  491   HD13  ILE  13          HD13      ILE  13  -1.276   3.349   3.515
  492    H    CYS  14           H        CYS  14   2.659   5.936   6.384
  493    HA   CYS  14           HA       CYS  14   1.289   7.180   8.602
  494    HB2  CYS  14           HB2      CYS  14   3.102   6.270   9.993
  495    HB3  CYS  14           HB3      CYS  14   2.222   5.037   9.128
  496    H    ASP  15           H        ASP  15   2.966   8.215   6.118
  497    HA   ASP  15           HA       ASP  15   4.157  10.055   5.588
  498    HB2  ASP  15           HB2      ASP  15   2.542  10.894   7.899
  499    HB3  ASP  15           HB3      ASP  15   3.757  12.007   7.307
  500    H    GLN  16           H        GLN  16   5.569   8.108   7.147
  501    HA   GLN  16           HA       GLN  16   7.445   9.787   8.613
  502    HB2  GLN  16           HB2      GLN  16   6.991   6.806   8.671
  503    HB3  GLN  16           HB3      GLN  16   8.232   7.645   9.585
  504    HG2  GLN  16           HG2      GLN  16   5.283   8.001   9.866
  505    HG3  GLN  16           HG3      GLN  16   6.329   7.154  10.962
  506   HE21  GLN  16          HE21      GLN  16   5.199  10.166   9.925
  507   HE22  GLN  16          HE22      GLN  16   5.957  11.074  11.161
  508    H    GLU  17           H        GLU  17   9.594   9.648   8.172
  509    HA   GLU  17           HA       GLU  17  10.265   9.138   5.423
  510    HB2  GLU  17           HB2      GLU  17  11.888  10.312   7.685
  511    HB3  GLU  17           HB3      GLU  17  12.409  10.227   6.009
  512    HG2  GLU  17           HG2      GLU  17  10.840  11.780   5.316
  513    HG3  GLU  17           HG3      GLU  17   9.863  11.573   6.762
  514    H    LYS  18           H        LYS  18  10.633   7.142   4.964
  515    HA   LYS  18           HA       LYS  18  12.277   5.478   6.756
  516    HB2  LYS  18           HB2      LYS  18  10.398   4.190   4.923
  517    HB3  LYS  18           HB3      LYS  18  10.899   3.697   6.509
  518    HG2  LYS  18           HG2      LYS  18   8.901   5.831   5.863
  519    HG3  LYS  18           HG3      LYS  18   8.552   4.223   6.489
  520    HD2  LYS  18           HD2      LYS  18  10.333   6.075   7.981
  521    HD3  LYS  18           HD3      LYS  18   8.606   6.237   8.086
  522    HE2  LYS  18           HE2      LYS  18   9.236   4.935   9.922
  523    HE3  LYS  18           HE3      LYS  18   8.557   3.842   8.740
  524    HZ1  LYS  18           HZ1      LYS  18  10.758   3.156   8.100
  525    HZ2  LYS  18           HZ2      LYS  18  10.565   2.963   9.766
  526    HZ3  LYS  18           HZ3      LYS  18  11.450   4.272   9.166
  527    H    ASN  19           H        ASN  19  13.894   4.264   5.832
  528    HA   ASN  19           HA       ASN  19  14.277   4.735   2.962
  529    HB2  ASN  19           HB2      ASN  19  16.594   4.311   3.264
  530    HB3  ASN  19           HB3      ASN  19  16.110   5.350   4.591
  531   HD21  ASN  19          HD21      ASN  19  18.347   3.445   4.280
  532   HD22  ASN  19          HD22      ASN  19  18.219   2.372   5.666
  533    H    ARG  20           H        ARG  20  12.752   2.585   4.742
  534    HA   ARG  20           HA       ARG  20  13.440   0.360   2.964
  535    HB2  ARG  20           HB2      ARG  20  13.106   0.289   5.945
  536    HB3  ARG  20           HB3      ARG  20  12.908  -1.153   4.968
  537    HG2  ARG  20           HG2      ARG  20  15.184  -0.851   4.118
  538    HG3  ARG  20           HG3      ARG  20  15.383   0.534   5.178
  539    HD2  ARG  20           HD2      ARG  20  14.642  -1.125   6.978
  540    HD3  ARG  20           HD3      ARG  20  15.082  -2.359   5.823
  541    HE   ARG  20           HE       ARG  20  17.272  -0.762   5.904
  542   HH11  ARG  20          HH11      ARG  20  15.412  -2.412   8.362
  543   HH12  ARG  20          HH12      ARG  20  16.771  -2.656   9.412
  544   HH21  ARG  20          HH21      ARG  20  19.067  -1.080   7.284
  545   HH22  ARG  20          HH22      ARG  20  18.848  -1.892   8.802
  546    H    GLY  21           H        GLY  21  11.785  -0.444   1.926
  547    HA2  GLY  21           HA2      GLY  21   9.310  -1.198   2.541
  548    HA3  GLY  21           HA3      GLY  21   9.094   0.541   2.452
  549    H    ILE  22           H        ILE  22   7.679   0.164   0.472
  550    HA   ILE  22           HA       ILE  22   9.356  -0.556  -1.824
  551    HB   ILE  22           HB       ILE  22   7.662  -1.747  -2.814
  552   HG12  ILE  22          HG12      ILE  22   5.741  -0.197  -1.117
  553   HG13  ILE  22          HG13      ILE  22   6.067   0.057  -2.789
  554   HG21  ILE  22          HG21      ILE  22   6.425  -3.071  -1.046
  555   HG22  ILE  22          HG22      ILE  22   7.225  -2.045   0.145
  556   HG23  ILE  22          HG23      ILE  22   8.187  -3.063  -0.930
  557   HD11  ILE  22          HD11      ILE  22   4.841  -2.417  -1.633
  558   HD12  ILE  22          HD12      ILE  22   5.138  -2.104  -3.345
  559   HD13  ILE  22          HD13      ILE  22   3.971  -1.124  -2.456
  560    H    HIS  23           H        HIS  23   7.963   0.173  -3.829
  561    HA   HIS  23           HA       HIS  23   6.856   2.799  -3.609
  562    HB2  HIS  23           HB2      HIS  23   8.558   3.959  -4.950
  563    HB3  HIS  23           HB3      HIS  23   9.240   3.381  -3.451
  564    HD1  HIS  23           HD1      HIS  23   9.701   3.300  -7.083
  565    HD2  HIS  23           HD2      HIS  23  10.903   1.099  -3.797
  566    HE1  HIS  23           HE1      HIS  23  11.656   1.936  -7.876
  567    HE2  HIS  23           HE2      HIS  23  12.346   0.565  -5.880
  568    H    LEU  24           H        LEU  24   5.247   2.753  -5.013
  569    HA   LEU  24           HA       LEU  24   5.263   0.828  -7.155
  570    HB2  LEU  24           HB2      LEU  24   3.199   2.736  -6.086
  571    HB3  LEU  24           HB3      LEU  24   2.921   1.675  -7.414
  572    HG   LEU  24           HG       LEU  24   3.549   0.784  -4.615
  573   HD11  LEU  24          HD11      LEU  24   0.996   0.657  -6.213
  574   HD12  LEU  24          HD12      LEU  24   1.304   1.707  -4.831
  575   HD13  LEU  24          HD13      LEU  24   1.247  -0.040  -4.613
  576   HD21  LEU  24          HD21      LEU  24   2.905  -0.793  -7.102
  577   HD22  LEU  24          HD22      LEU  24   3.008  -1.462  -5.473
  578   HD23  LEU  24          HD23      LEU  24   4.443  -0.778  -6.236
  579    H    TYR  25           H        TYR  25   4.322   4.209  -6.899
  580    HA   TYR  25           HA       TYR  25   5.127   4.614  -9.656
  581    HB2  TYR  25           HB2      TYR  25   3.499   6.343  -7.838
  582    HB3  TYR  25           HB3      TYR  25   3.873   6.742  -9.500
  583    HD1  TYR  25           HD1      TYR  25   3.212   3.255  -8.794
  584    HD2  TYR  25           HD2      TYR  25   1.378   6.946  -9.821
  585    HE1  TYR  25           HE1      TYR  25   1.212   2.041  -9.502
  586    HE2  TYR  25           HE2      TYR  25  -0.627   5.744 -10.558
  587    HH   TYR  25           HH       TYR  25  -1.340   3.600 -11.255
  588    H    THR  26           H        THR  26   5.046   7.470  -7.894
  589    HA   THR  26           HA       THR  26   7.948   7.393  -7.440
  590    HB   THR  26           HB       THR  26   7.290   9.271  -8.804
  591    HG1  THR  26           HG1      THR  26   8.131   9.755  -6.180
  592   HG21  THR  26          HG21      THR  26   5.369  10.020  -6.604
  593   HG22  THR  26          HG22      THR  26   4.930   9.338  -8.171
  594   HG23  THR  26          HG23      THR  26   5.672  10.936  -8.080
  595    H    LYS  27           H        LYS  27   5.358   6.487  -5.867
  596    HA   LYS  27           HA       LYS  27   5.694   8.054  -3.429
  597    HB2  LYS  27           HB2      LYS  27   3.821   5.920  -3.119
  598    HB3  LYS  27           HB3      LYS  27   3.537   7.653  -3.079
  599    HG2  LYS  27           HG2      LYS  27   3.652   6.006  -5.586
  600    HG3  LYS  27           HG3      LYS  27   2.187   6.443  -4.720
  601    HD2  LYS  27           HD2      LYS  27   4.162   8.429  -5.792
  602    HD3  LYS  27           HD3      LYS  27   2.712   7.920  -6.646
  603    HE2  LYS  27           HE2      LYS  27   1.826   8.608  -4.103
  604    HE3  LYS  27           HE3      LYS  27   3.040   9.826  -4.492
  605    HZ1  LYS  27           HZ1      LYS  27   0.727   9.101  -6.220
  606    HZ2  LYS  27           HZ2      LYS  27   1.846  10.331  -6.525
  607    HZ3  LYS  27           HZ3      LYS  27   0.782  10.460  -5.215
  608    H    PHE  28           H        PHE  28   5.127   6.561  -1.462
  609    HA   PHE  28           HA       PHE  28   6.757   4.163  -1.457
  610    HB2  PHE  28           HB2      PHE  28   8.370   5.926  -1.045
  611    HB3  PHE  28           HB3      PHE  28   7.363   6.602   0.225
  612    HD1  PHE  28           HD1      PHE  28   9.474   3.700  -0.666
  613    HD2  PHE  28           HD2      PHE  28   7.389   5.772   2.400
  614    HE1  PHE  28           HE1      PHE  28  10.554   2.276   1.034
  615    HE2  PHE  28           HE2      PHE  28   8.455   4.363   4.095
  616    HZ   PHE  28           HZ       PHE  28  10.030   2.597   3.431
  617    H    ILE  29           H        ILE  29   5.332   2.755  -0.587
  618    HA   ILE  29           HA       ILE  29   4.064   3.524   1.949
  619    HB   ILE  29           HB       ILE  29   3.872   0.853   0.521
  620   HG12  ILE  29          HG12      ILE  29   1.346   1.697   0.431
  621   HG13  ILE  29          HG13      ILE  29   2.116   3.276   0.435
  622   HG21  ILE  29          HG21      ILE  29   2.413   1.927   2.926
  623   HG22  ILE  29          HG22      ILE  29   3.680   0.694   2.943
  624   HG23  ILE  29          HG23      ILE  29   2.125   0.364   2.164
  625   HD11  ILE  29          HD11      ILE  29   3.209   2.863  -1.599
  626   HD12  ILE  29          HD12      ILE  29   1.559   2.267  -1.816
  627   HD13  ILE  29          HD13      ILE  29   2.876   1.134  -1.513
  628    H    CYS  30           H        CYS  30   5.160   3.085   3.799
  629    HA   CYS  30           HA       CYS  30   7.724   1.860   3.586
  630    HB2  CYS  30           HB2      CYS  30   8.066   2.356   5.828
  631    HB3  CYS  30           HB3      CYS  30   6.930   3.601   5.343
  632    H    LEU  31           H        LEU  31   8.401   0.046   4.628
  633    HA   LEU  31           HA       LEU  31   7.206  -2.199   3.692
  634    HB2  LEU  31           HB2      LEU  31   8.989  -3.311   4.636
  635    HB3  LEU  31           HB3      LEU  31   9.602  -1.714   4.392
  636    HG   LEU  31           HG       LEU  31   8.806  -1.442   6.925
  637   HD11  LEU  31          HD11      LEU  31   9.316  -3.433   8.211
  638   HD12  LEU  31          HD12      LEU  31   9.599  -4.344   6.727
  639   HD13  LEU  31          HD13      LEU  31   7.982  -3.744   7.099
  640   HD21  LEU  31          HD21      LEU  31  11.027  -0.969   6.061
  641   HD22  LEU  31          HD22      LEU  31  11.399  -2.692   6.042
  642   HD23  LEU  31          HD23      LEU  31  11.119  -1.867   7.576
  643    H    ASP  32           H        ASP  32   6.431  -0.530   6.504
  644    HA   ASP  32           HA       ASP  32   5.499  -2.767   8.076
  645    HB2  ASP  32           HB2      ASP  32   6.489  -0.756   9.090
  646    HB3  ASP  32           HB3      ASP  32   5.181   0.181   8.432
  647    H    CYS  33           H        CYS  33   4.249   0.003   6.480
  648    HA   CYS  33           HA       CYS  33   1.515  -0.601   6.776
  649    HB2  CYS  33           HB2      CYS  33   2.846   1.411   4.984
  650    HB3  CYS  33           HB3      CYS  33   1.137   1.269   5.259
  651    H    GLU  34           H        GLU  34   3.934  -1.067   4.400
  652    HA   GLU  34           HA       GLU  34   2.393  -1.768   2.220
  653    HB2  GLU  34           HB2      GLU  34   4.756  -1.299   2.063
  654    HB3  GLU  34           HB3      GLU  34   5.134  -2.663   3.066
  655    HG2  GLU  34           HG2      GLU  34   3.697  -3.248   0.589
  656    HG3  GLU  34           HG3      GLU  34   5.349  -2.712   0.436
  657    H    ARG  35           H        ARG  35   3.626  -3.736   4.850
  658    HA   ARG  35           HA       ARG  35   2.250  -6.048   3.854
  659    HB2  ARG  35           HB2      ARG  35   2.856  -7.202   5.900
  660    HB3  ARG  35           HB3      ARG  35   4.250  -6.361   5.247
  661    HG2  ARG  35           HG2      ARG  35   3.909  -4.571   6.903
  662    HG3  ARG  35           HG3      ARG  35   2.575  -5.493   7.576
  663    HD2  ARG  35           HD2      ARG  35   5.424  -6.346   7.431
  664    HD3  ARG  35           HD3      ARG  35   4.558  -5.869   8.879
  665    HE   ARG  35           HE       ARG  35   3.146  -7.973   7.781
  666   HH11  ARG  35          HH11      ARG  35   6.351  -7.450   9.088
  667   HH12  ARG  35          HH12      ARG  35   6.548  -9.095   9.599
  668   HH21  ARG  35          HH21      ARG  35   3.404 -10.142   8.462
  669   HH22  ARG  35          HH22      ARG  35   4.869 -10.620   9.260
  670    H    LYS  36           H        LYS  36   1.339  -3.374   5.731
  671    HA   LYS  36           HA       LYS  36  -0.673  -4.517   7.332
  672    HB2  LYS  36           HB2      LYS  36  -0.412  -1.734   6.306
  673    HB3  LYS  36           HB3      LYS  36  -1.584  -2.230   7.494
  674    HG2  LYS  36           HG2      LYS  36   0.412  -2.879   8.907
  675    HG3  LYS  36           HG3      LYS  36   1.384  -2.051   7.767
  676    HD2  LYS  36           HD2      LYS  36   0.407  -0.068   8.287
  677    HD3  LYS  36           HD3      LYS  36  -0.966  -0.785   9.085
  678    HE2  LYS  36           HE2      LYS  36   0.513  -1.554  10.871
  679    HE3  LYS  36           HE3      LYS  36   1.889  -0.814  10.055
  680    HZ1  LYS  36           HZ1      LYS  36   1.056   0.581  11.833
  681    HZ2  LYS  36           HZ2      LYS  36  -0.474   0.634  11.119
  682    HZ3  LYS  36           HZ3      LYS  36   0.848   1.349  10.340
  683    H    VAL  37           H        VAL  37  -0.500  -3.080   4.204
  684    HA   VAL  37           HA       VAL  37  -3.173  -2.865   3.612
  685    HB   VAL  37           HB       VAL  37  -2.542  -2.896   1.258
  686   HG11  VAL  37          HG11      VAL  37  -2.185  -0.864   2.725
  687   HG12  VAL  37          HG12      VAL  37  -1.246  -0.914   1.234
  688   HG13  VAL  37          HG13      VAL  37  -0.477  -1.324   2.772
  689   HG21  VAL  37          HG21      VAL  37  -0.017  -2.973   0.820
  690   HG22  VAL  37          HG22      VAL  37  -0.935  -4.473   0.948
  691   HG23  VAL  37          HG23      VAL  37   0.035  -3.914   2.318
  692    H    ILE  38           H        ILE  38  -0.969  -5.480   2.948
  693    HA   ILE  38           HA       ILE  38  -2.644  -7.194   1.522
  694    HB   ILE  38           HB       ILE  38  -0.527  -8.221   3.389
  695   HG12  ILE  38          HG12      ILE  38  -0.078  -6.615   0.886
  696   HG13  ILE  38          HG13      ILE  38   0.624  -6.380   2.469
  697   HG21  ILE  38          HG21      ILE  38  -1.683  -9.908   2.198
  698   HG22  ILE  38          HG22      ILE  38  -0.092  -9.743   1.451
  699   HG23  ILE  38          HG23      ILE  38  -1.508  -9.039   0.677
  700   HD11  ILE  38          HD11      ILE  38   1.207  -8.858   0.918
  701   HD12  ILE  38          HD12      ILE  38   2.153  -8.087   2.192
  702   HD13  ILE  38          HD13      ILE  38   2.072  -7.360   0.584
  703    H    SER  39           H        SER  39  -2.083  -6.568   4.869
  704    HA   SER  39           HA       SER  39  -3.416  -8.856   5.771
  705    HB2  SER  39           HB2      SER  39  -2.569  -6.364   7.240
  706    HB3  SER  39           HB3      SER  39  -3.018  -7.888   7.975
  707    HG   SER  39           HG       SER  39  -0.770  -7.345   6.350
  708    H    THR  40           H        THR  40  -4.257  -5.653   4.940
  709    HA   THR  40           HA       THR  40  -6.719  -5.531   6.429
  710    HB   THR  40           HB       THR  40  -5.577  -3.714   4.301
  711    HG1  THR  40           HG1      THR  40  -4.354  -3.882   6.271
  712   HG21  THR  40          HG21      THR  40  -8.027  -3.488   4.540
  713   HG22  THR  40          HG22      THR  40  -7.157  -2.051   5.068
  714   HG23  THR  40          HG23      THR  40  -7.809  -3.174   6.263
  715    H    SER  41           H        SER  41  -5.767  -5.969   3.032
  716    HA   SER  41           HA       SER  41  -8.472  -5.748   2.100
  717    HB2  SER  41           HB2      SER  41  -7.414  -6.312  -0.111
  718    HB3  SER  41           HB3      SER  41  -6.735  -4.902   0.700
  719    HG   SER  41           HG       SER  41  -5.029  -6.133   0.014
  720    H    THR  42           H        THR  42  -6.503  -8.360   3.166
  721    HA   THR  42           HA       THR  42  -7.715 -10.352   1.496
  722    HB   THR  42           HB       THR  42  -6.475 -11.948   3.046
  723    HG1  THR  42           HG1      THR  42  -4.876  -9.856   3.909
  724   HG21  THR  42          HG21      THR  42  -4.921  -9.779   1.625
  725   HG22  THR  42          HG22      THR  42  -5.595 -11.229   0.878
  726   HG23  THR  42          HG23      THR  42  -4.299 -11.371   2.065
  727    H    SER  43           H        SER  43  -9.679  -8.963   2.814
  728    HA   SER  43           HA       SER  43 -11.215 -11.112   3.870
  729    HB2  SER  43           HB2      SER  43  -9.859 -10.382   5.887
  730    HB3  SER  43           HB3      SER  43 -10.663  -8.821   5.774
  731    HG   SER  43           HG       SER  43 -11.939 -11.331   6.149
  732    H    ASP  44           H        ASP  44 -11.084  -8.995   1.793
  733    HA   ASP  44           HA       ASP  44 -13.545  -7.502   2.421
  734    HB2  ASP  44           HB2      ASP  44 -11.676  -5.970   2.290
  735    HB3  ASP  44           HB3      ASP  44 -11.173  -6.657   0.750
  736    HA   PRO  45           HA       PRO  45 -14.811  -9.888  -1.216
  737    HB2  PRO  45           HB2      PRO  45 -17.496  -9.623  -0.226
  738    HB3  PRO  45           HB3      PRO  45 -16.520 -11.070  -0.296
  739    HG2  PRO  45           HG2      PRO  45 -17.298  -9.860   1.972
  740    HG3  PRO  45           HG3      PRO  45 -15.904 -10.923   1.847
  741    HD2  PRO  45           HD2      PRO  45 -16.005  -7.944   1.957
  742    HD3  PRO  45           HD3      PRO  45 -14.803  -9.065   2.625
  743    H    ASP  46           H        ASP  46 -16.623  -9.379  -2.827
  744    HA   ASP  46           HA       ASP  46 -16.427  -6.626  -3.551
  745    HB2  ASP  46           HB2      ASP  46 -18.012  -8.926  -4.698
  746    HB3  ASP  46           HB3      ASP  46 -18.063  -7.303  -5.376
  747    H    TYR  47           H        TYR  47 -19.348  -8.593  -3.089
  748    HA   TYR  47           HA       TYR  47 -20.623  -6.290  -1.787
  749    HB2  TYR  47           HB2      TYR  47 -21.901  -8.304  -3.614
  750    HB3  TYR  47           HB3      TYR  47 -22.735  -7.002  -2.799
  751    HD1  TYR  47           HD1      TYR  47 -20.693  -7.942  -5.633
  752    HD2  TYR  47           HD2      TYR  47 -22.318  -4.646  -3.490
  753    HE1  TYR  47           HE1      TYR  47 -20.259  -6.483  -7.563
  754    HE2  TYR  47           HE2      TYR  47 -21.888  -3.176  -5.414
  755    HH   TYR  47           HH       TYR  47 -20.483  -3.070  -7.372
  756    H    ALA  48           H        ALA  48 -19.161  -8.540  -0.671
  757    HA   ALA  48           HA       ALA  48 -19.250 -10.149   0.914
  758    HB1  ALA  48           HB1      ALA  48 -20.973  -9.988   2.623
  759    HB2  ALA  48           HB2      ALA  48 -21.929  -8.931   1.584
  760    HB3  ALA  48           HB3      ALA  48 -20.370  -8.385   2.202
  Start of MODEL   19
    1    H1   SER   0           H1       SER   0 -15.841  15.171  14.042
    2    H2   SER   0           H2       SER   0 -15.603  16.507  13.036
    3    H3   SER   0           H3       SER   0 -14.461  16.130  14.220
    4    HA   SER   0           HA       SER   0 -13.894  14.102  13.120
    5    HB2  SER   0           HB2      SER   0 -16.184  13.735  12.162
    6    HB3  SER   0           HB3      SER   0 -15.839  14.986  10.970
    7    HG   SER   0           HG       SER   0 -15.341  12.486  10.689
    8    H    MET   1           H        MET   1 -11.963  15.205  13.125
    9    HA   MET   1           HA       MET   1 -11.295  16.550  10.629
   10    HB2  MET   1           HB2      MET   1 -11.930  18.377  12.146
   11    HB3  MET   1           HB3      MET   1 -10.785  17.792  13.343
   12    HG2  MET   1           HG2      MET   1  -9.904  19.712  12.154
   13    HG3  MET   1           HG3      MET   1  -8.937  18.274  11.836
   14    HE1  MET   1           HE1      MET   1  -8.647  20.207   8.462
   15    HE2  MET   1           HE2      MET   1  -7.773  19.419   9.776
   16    HE3  MET   1           HE3      MET   1  -8.689  20.895  10.086
   17    H    ASP   2           H        ASP   2 -10.371  14.335  10.553
   18    HA   ASP   2           HA       ASP   2  -7.572  14.460  11.162
   19    HB2  ASP   2           HB2      ASP   2  -8.346  13.643  13.323
   20    HB3  ASP   2           HB3      ASP   2  -9.265  12.363  12.537
   21    H    GLU   3           H        GLU   3 -10.237  12.287  10.308
   22    HA   GLU   3           HA       GLU   3  -8.487  10.900   8.421
   23    HB2  GLU   3           HB2      GLU   3  -9.750   9.516   9.980
   24    HB3  GLU   3           HB3      GLU   3 -11.253  10.236   9.435
   25    HG2  GLU   3           HG2      GLU   3 -10.906   9.273   7.217
   26    HG3  GLU   3           HG3      GLU   3  -9.404   8.537   7.778
   27    H    THR   4           H        THR   4  -8.519  11.423   6.363
   28    HA   THR   4           HA       THR   4 -10.664  13.016   5.245
   29    HB   THR   4           HB       THR   4  -9.274  12.884   3.148
   30    HG1  THR   4           HG1      THR   4  -8.235  10.842   3.914
   31   HG21  THR   4          HG21      THR   4  -7.869  13.841   5.645
   32   HG22  THR   4          HG22      THR   4  -9.051  14.753   4.708
   33   HG23  THR   4          HG23      THR   4  -7.489  14.342   3.998
   34    H    VAL   5           H        VAL   5 -12.486  11.857   4.923
   35    HA   VAL   5           HA       VAL   5 -12.347   9.099   4.065
   36    HB   VAL   5           HB       VAL   5 -14.782  10.827   4.534
   37   HG11  VAL   5          HG11      VAL   5 -14.492   7.835   4.281
   38   HG12  VAL   5          HG12      VAL   5 -15.269   8.912   3.121
   39   HG13  VAL   5          HG13      VAL   5 -15.973   8.684   4.722
   40   HG21  VAL   5          HG21      VAL   5 -13.389   8.881   6.369
   41   HG22  VAL   5          HG22      VAL   5 -14.927   9.676   6.701
   42   HG23  VAL   5          HG23      VAL   5 -13.452  10.633   6.556
   43    H    LYS   6           H        LYS   6 -14.492  11.664   2.862
   44    HA   LYS   6           HA       LYS   6 -15.107  12.312   0.780
   45    HB2  LYS   6           HB2      LYS   6 -12.634  10.913  -0.171
   46    HB3  LYS   6           HB3      LYS   6 -13.592  12.035  -1.108
   47    HG2  LYS   6           HG2      LYS   6 -12.987  13.827   0.345
   48    HG3  LYS   6           HG3      LYS   6 -12.168  12.728   1.447
   49    HD2  LYS   6           HD2      LYS   6 -10.510  13.830   0.116
   50    HD3  LYS   6           HD3      LYS   6 -10.605  12.155  -0.410
   51    HE2  LYS   6           HE2      LYS   6 -11.949  12.809  -2.306
   52    HE3  LYS   6           HE3      LYS   6 -11.957  14.482  -1.761
   53    HZ1  LYS   6           HZ1      LYS   6  -9.600  12.918  -2.669
   54    HZ2  LYS   6           HZ2      LYS   6  -9.516  14.471  -2.007
   55    HZ3  LYS   6           HZ3      LYS   6 -10.323  14.223  -3.468
   56    H    LEU   7           H        LEU   7 -16.162  11.486  -1.163
   57    HA   LEU   7           HA       LEU   7 -17.416   8.993  -0.706
   58    HB2  LEU   7           HB2      LEU   7 -17.380  10.836  -3.076
   59    HB3  LEU   7           HB3      LEU   7 -18.226   9.315  -3.122
   60    HG   LEU   7           HG       LEU   7 -19.534  10.107  -1.106
   61   HD11  LEU   7          HD11      LEU   7 -18.302  12.715  -1.935
   62   HD12  LEU   7          HD12      LEU   7 -18.029  11.866  -0.417
   63   HD13  LEU   7          HD13      LEU   7 -19.623  12.525  -0.782
   64   HD21  LEU   7          HD21      LEU   7 -21.052  11.446  -2.470
   65   HD22  LEU   7          HD22      LEU   7 -20.468  10.040  -3.359
   66   HD23  LEU   7          HD23      LEU   7 -19.796  11.636  -3.691
   67    H    ASN   8           H        ASN   8 -15.580   9.815  -3.655
   68    HA   ASN   8           HA       ASN   8 -14.501   7.102  -3.684
   69    HB2  ASN   8           HB2      ASN   8 -14.011   9.354  -5.641
   70    HB3  ASN   8           HB3      ASN   8 -13.492   7.712  -5.847
   71   HD21  ASN   8          HD21      ASN   8 -15.150   9.274  -7.571
   72   HD22  ASN   8          HD22      ASN   8 -16.656   8.442  -7.700
   73    H    HIS   9           H        HIS   9 -12.992   6.894  -2.204
   74    HA   HIS   9           HA       HIS   9 -11.330   8.901  -1.195
   75    HB2  HIS   9           HB2      HIS   9 -10.476   6.024  -1.255
   76    HB3  HIS   9           HB3      HIS   9 -10.231   7.219   0.011
   77    HD1  HIS   9           HD1      HIS   9 -12.565   7.919   1.310
   78    HD2  HIS   9           HD2      HIS   9 -12.552   4.348  -0.817
   79    HE1  HIS   9           HE1      HIS   9 -14.498   6.584   2.211
   80    HE2  HIS   9           HE2      HIS   9 -14.526   4.465   0.849
   81    H    THR  10           H        THR  10  -9.536   9.817  -1.998
   82    HA   THR  10           HA       THR  10  -8.675   9.198  -4.633
   83    HB   THR  10           HB       THR  10  -7.322  10.966  -2.587
   84    HG1  THR  10           HG1      THR  10  -8.724  12.265  -4.506
   85   HG21  THR  10          HG21      THR  10  -5.894  10.409  -4.496
   86   HG22  THR  10          HG22      THR  10  -6.382  12.104  -4.550
   87   HG23  THR  10          HG23      THR  10  -7.166  10.926  -5.605
   88    H    CYS  11           H        CYS  11  -7.101   7.860  -5.315
   89    HA   CYS  11           HA       CYS  11  -5.800   6.126  -3.489
   90    HB2  CYS  11           HB2      CYS  11  -6.202   5.385  -5.784
   91    HB3  CYS  11           HB3      CYS  11  -5.153   6.653  -6.393
   92    H    VAL  12           H        VAL  12  -4.365   6.752  -2.125
   93    HA   VAL  12           HA       VAL  12  -2.612   8.771  -2.048
   94    HB   VAL  12           HB       VAL  12  -3.197   6.655  -0.564
   95   HG11  VAL  12          HG11      VAL  12  -1.280   5.228  -0.205
   96   HG12  VAL  12          HG12      VAL  12  -0.515   5.918  -1.640
   97   HG13  VAL  12          HG13      VAL  12  -2.024   5.008  -1.786
   98   HG21  VAL  12          HG21      VAL  12  -2.377   8.543   0.364
   99   HG22  VAL  12          HG22      VAL  12  -0.814   8.372  -0.431
  100   HG23  VAL  12          HG23      VAL  12  -1.277   7.258   0.855
  101    H    ILE  13           H        ILE  13  -2.537   6.117  -4.225
  102    HA   ILE  13           HA       ILE  13   0.263   6.527  -4.918
  103    HB   ILE  13           HB       ILE  13  -1.545   4.460  -6.079
  104   HG12  ILE  13          HG12      ILE  13  -1.587   4.405  -3.574
  105   HG13  ILE  13          HG13      ILE  13  -0.993   2.952  -4.353
  106   HG21  ILE  13          HG21      ILE  13   0.602   4.813  -7.177
  107   HG22  ILE  13          HG22      ILE  13   0.514   3.228  -6.405
  108   HG23  ILE  13          HG23      ILE  13   1.426   4.532  -5.641
  109   HD11  ILE  13          HD11      ILE  13   1.259   3.544  -3.870
  110   HD12  ILE  13          HD12      ILE  13   0.301   3.596  -2.389
  111   HD13  ILE  13          HD13      ILE  13   0.743   5.092  -3.210
  112    H    CYS  14           H        CYS  14  -2.868   6.149  -6.569
  113    HA   CYS  14           HA       CYS  14  -1.770   6.990  -9.094
  114    HB2  CYS  14           HB2      CYS  14  -4.578   6.378  -8.291
  115    HB3  CYS  14           HB3      CYS  14  -4.083   6.689  -9.930
  116    H    ASP  15           H        ASP  15  -3.321   8.536  -6.472
  117    HA   ASP  15           HA       ASP  15  -4.166  10.600  -6.082
  118    HB2  ASP  15           HB2      ASP  15  -2.070  11.207  -7.496
  119    HB3  ASP  15           HB3      ASP  15  -3.257  11.592  -8.722
  120    H    GLN  16           H        GLN  16  -5.686   8.583  -7.402
  121    HA   GLN  16           HA       GLN  16  -7.592  10.176  -8.956
  122    HB2  GLN  16           HB2      GLN  16  -7.023   7.211  -9.129
  123    HB3  GLN  16           HB3      GLN  16  -8.244   8.065 -10.051
  124    HG2  GLN  16           HG2      GLN  16  -5.298   8.518 -10.213
  125    HG3  GLN  16           HG3      GLN  16  -6.264   7.628 -11.380
  126   HE21  GLN  16          HE21      GLN  16  -4.606  10.011 -11.710
  127   HE22  GLN  16          HE22      GLN  16  -5.648  11.235 -12.346
  128    H    GLU  17           H        GLU  17  -9.737   9.945  -8.460
  129    HA   GLU  17           HA       GLU  17 -10.333   9.254  -5.747
  130    HB2  GLU  17           HB2      GLU  17 -12.094  10.376  -7.933
  131    HB3  GLU  17           HB3      GLU  17 -12.535  10.235  -6.239
  132    HG2  GLU  17           HG2      GLU  17 -10.920  11.825  -5.587
  133    HG3  GLU  17           HG3      GLU  17 -10.179  11.791  -7.180
  134    H    LYS  18           H        LYS  18 -10.603   7.227  -5.331
  135    HA   LYS  18           HA       LYS  18 -12.295   5.572  -7.102
  136    HB2  LYS  18           HB2      LYS  18 -10.233   4.231  -5.446
  137    HB3  LYS  18           HB3      LYS  18 -10.866   3.811  -7.023
  138    HG2  LYS  18           HG2      LYS  18  -8.887   5.997  -6.461
  139    HG3  LYS  18           HG3      LYS  18  -8.510   4.410  -7.117
  140    HD2  LYS  18           HD2      LYS  18 -10.468   6.178  -8.488
  141    HD3  LYS  18           HD3      LYS  18  -8.759   6.432  -8.700
  142    HE2  LYS  18           HE2      LYS  18  -9.740   5.088 -10.488
  143    HE3  LYS  18           HE3      LYS  18  -8.514   4.243  -9.580
  144    HZ1  LYS  18           HZ1      LYS  18 -10.478   2.880 -10.101
  145    HZ2  LYS  18           HZ2      LYS  18 -11.414   3.902  -9.139
  146    HZ3  LYS  18           HZ3      LYS  18 -10.176   2.988  -8.444
  147    H    ASN  19           H        ASN  19 -13.771   4.235  -6.128
  148    HA   ASN  19           HA       ASN  19 -14.161   4.731  -3.275
  149    HB2  ASN  19           HB2      ASN  19 -16.418   4.160  -3.572
  150    HB3  ASN  19           HB3      ASN  19 -15.997   5.037  -5.037
  151   HD21  ASN  19          HD21      ASN  19 -16.992   2.040  -3.689
  152   HD22  ASN  19          HD22      ASN  19 -17.202   1.185  -5.213
  153    H    ARG  20           H        ARG  20 -12.729   2.435  -5.216
  154    HA   ARG  20           HA       ARG  20 -13.206   0.329  -3.219
  155    HB2  ARG  20           HB2      ARG  20 -12.830   0.149  -6.181
  156    HB3  ARG  20           HB3      ARG  20 -12.481  -1.231  -5.156
  157    HG2  ARG  20           HG2      ARG  20 -14.784  -1.054  -4.269
  158    HG3  ARG  20           HG3      ARG  20 -15.108   0.173  -5.478
  159    HD2  ARG  20           HD2      ARG  20 -14.264  -1.544  -7.113
  160    HD3  ARG  20           HD3      ARG  20 -14.420  -2.716  -5.828
  161    HE   ARG  20           HE       ARG  20 -16.852  -1.434  -5.955
  162   HH11  ARG  20          HH11      ARG  20 -14.887  -3.308  -8.158
  163   HH12  ARG  20          HH12      ARG  20 -16.246  -3.941  -9.032
  164   HH21  ARG  20          HH21      ARG  20 -18.646  -2.273  -7.093
  165   HH22  ARG  20          HH22      ARG  20 -18.384  -3.361  -8.422
  166    H    GLY  21           H        GLY  21 -11.560  -0.267  -2.050
  167    HA2  GLY  21           HA2      GLY  21  -8.973  -0.859  -2.646
  168    HA3  GLY  21           HA3      GLY  21  -8.952   0.890  -2.436
  169    H    ILE  22           H        ILE  22  -7.490   0.256  -0.493
  170    HA   ILE  22           HA       ILE  22  -9.262  -0.330   1.770
  171    HB   ILE  22           HB       ILE  22  -7.641  -1.534   2.841
  172   HG12  ILE  22          HG12      ILE  22  -5.565  -0.134   1.181
  173   HG13  ILE  22          HG13      ILE  22  -6.035   0.327   2.780
  174   HG21  ILE  22          HG21      ILE  22  -8.160  -2.809   0.888
  175   HG22  ILE  22          HG22      ILE  22  -6.429  -2.970   1.191
  176   HG23  ILE  22          HG23      ILE  22  -7.007  -1.893  -0.085
  177   HD11  ILE  22          HD11      ILE  22  -4.644  -2.183   1.954
  178   HD12  ILE  22          HD12      ILE  22  -5.294  -1.901   3.568
  179   HD13  ILE  22          HD13      ILE  22  -4.008  -0.870   2.952
  180    H    HIS  23           H        HIS  23  -7.859   0.401   3.796
  181    HA   HIS  23           HA       HIS  23  -6.761   3.034   3.534
  182    HB2  HIS  23           HB2      HIS  23  -8.482   4.090   5.036
  183    HB3  HIS  23           HB3      HIS  23  -9.070   3.700   3.437
  184    HD1  HIS  23           HD1      HIS  23  -9.613   2.990   7.032
  185    HD2  HIS  23           HD2      HIS  23 -10.888   1.584   3.358
  186    HE1  HIS  23           HE1      HIS  23 -11.650   1.602   7.523
  187    HE2  HIS  23           HE2      HIS  23 -12.314   0.629   5.298
  188    H    LEU  24           H        LEU  24  -5.104   2.995   4.907
  189    HA   LEU  24           HA       LEU  24  -5.079   1.070   7.075
  190    HB2  LEU  24           HB2      LEU  24  -3.073   2.782   5.708
  191    HB3  LEU  24           HB3      LEU  24  -2.768   2.368   7.351
  192    HG   LEU  24           HG       LEU  24  -1.865   0.449   6.728
  193   HD11  LEU  24          HD11      LEU  24  -4.359  -0.180   5.230
  194   HD12  LEU  24          HD12      LEU  24  -3.985  -0.600   6.905
  195   HD13  LEU  24          HD13      LEU  24  -3.035  -1.292   5.590
  196   HD21  LEU  24          HD21      LEU  24  -2.588   1.245   3.952
  197   HD22  LEU  24          HD22      LEU  24  -1.409   0.016   4.419
  198   HD23  LEU  24          HD23      LEU  24  -1.137   1.707   4.844
  199    H    TYR  25           H        TYR  25  -4.071   4.424   6.791
  200    HA   TYR  25           HA       TYR  25  -4.791   4.850   9.575
  201    HB2  TYR  25           HB2      TYR  25  -3.054   6.551   7.824
  202    HB3  TYR  25           HB3      TYR  25  -3.281   6.758   9.547
  203    HD1  TYR  25           HD1      TYR  25  -3.152   3.338   8.821
  204    HD2  TYR  25           HD2      TYR  25  -0.596   6.712   9.234
  205    HE1  TYR  25           HE1      TYR  25  -1.275   1.835   9.174
  206    HE2  TYR  25           HE2      TYR  25   1.323   5.213   9.622
  207    HH   TYR  25           HH       TYR  25   1.655   2.893  10.470
  208    H    THR  26           H        THR  26  -4.429   7.599   7.587
  209    HA   THR  26           HA       THR  26  -7.342   7.865   7.397
  210    HB   THR  26           HB       THR  26  -6.608   9.720   8.584
  211    HG1  THR  26           HG1      THR  26  -7.023  10.236   5.879
  212   HG21  THR  26          HG21      THR  26  -4.625  11.022   8.090
  213   HG22  THR  26          HG22      THR  26  -4.296  10.022   6.677
  214   HG23  THR  26          HG23      THR  26  -4.214   9.317   8.295
  215    H    LYS  27           H        LYS  27  -4.880   6.777   5.546
  216    HA   LYS  27           HA       LYS  27  -5.651   8.252   3.134
  217    HB2  LYS  27           HB2      LYS  27  -3.609   6.533   2.415
  218    HB3  LYS  27           HB3      LYS  27  -3.458   8.244   2.761
  219    HG2  LYS  27           HG2      LYS  27  -3.270   6.164   4.908
  220    HG3  LYS  27           HG3      LYS  27  -1.883   6.658   3.940
  221    HD2  LYS  27           HD2      LYS  27  -3.603   8.478   5.611
  222    HD3  LYS  27           HD3      LYS  27  -2.016   7.879   6.063
  223    HE2  LYS  27           HE2      LYS  27  -1.637   8.989   3.542
  224    HE3  LYS  27           HE3      LYS  27  -2.760  10.092   4.332
  225    HZ1  LYS  27           HZ1      LYS  27  -0.784  10.956   5.026
  226    HZ2  LYS  27           HZ2      LYS  27   0.020   9.475   5.003
  227    HZ3  LYS  27           HZ3      LYS  27  -1.023   9.845   6.279
  228    H    PHE  28           H        PHE  28  -5.180   6.806   1.136
  229    HA   PHE  28           HA       PHE  28  -6.633   4.286   1.339
  230    HB2  PHE  28           HB2      PHE  28  -8.380   5.823   0.882
  231    HB3  PHE  28           HB3      PHE  28  -7.404   6.704  -0.274
  232    HD1  PHE  28           HD1      PHE  28  -7.296   6.050  -2.543
  233    HD2  PHE  28           HD2      PHE  28  -9.326   3.602   0.274
  234    HE1  PHE  28           HE1      PHE  28  -8.244   4.736  -4.387
  235    HE2  PHE  28           HE2      PHE  28 -10.275   2.280  -1.565
  236    HZ   PHE  28           HZ       PHE  28  -9.725   2.825  -3.909
  237    H    ILE  29           H        ILE  29  -5.244   2.888   0.443
  238    HA   ILE  29           HA       ILE  29  -3.856   3.613  -2.022
  239    HB   ILE  29           HB       ILE  29  -3.963   0.914  -0.612
  240   HG12  ILE  29          HG12      ILE  29  -1.475   1.429  -0.215
  241   HG13  ILE  29          HG13      ILE  29  -1.892   3.104  -0.551
  242   HG21  ILE  29          HG21      ILE  29  -2.280   1.837  -2.933
  243   HG22  ILE  29          HG22      ILE  29  -3.627   0.700  -3.007
  244   HG23  ILE  29          HG23      ILE  29  -2.152   0.271  -2.134
  245   HD11  ILE  29          HD11      ILE  29  -3.419   3.136   1.308
  246   HD12  ILE  29          HD12      ILE  29  -1.837   2.571   1.844
  247   HD13  ILE  29          HD13      ILE  29  -3.147   1.419   1.600
  248    H    CYS  30           H        CYS  30  -4.981   3.312  -3.964
  249    HA   CYS  30           HA       CYS  30  -7.524   2.076  -3.991
  250    HB2  CYS  30           HB2      CYS  30  -7.653   2.459  -6.256
  251    HB3  CYS  30           HB3      CYS  30  -6.485   3.660  -5.766
  252    H    LEU  31           H        LEU  31  -8.183   0.174  -4.928
  253    HA   LEU  31           HA       LEU  31  -7.039  -2.004  -3.758
  254    HB2  LEU  31           HB2      LEU  31  -8.784  -3.180  -4.679
  255    HB3  LEU  31           HB3      LEU  31  -9.402  -1.567  -4.595
  256    HG   LEU  31           HG       LEU  31  -8.486  -1.511  -7.102
  257   HD11  LEU  31          HD11      LEU  31  -7.651  -3.805  -7.071
  258   HD12  LEU  31          HD12      LEU  31  -8.962  -3.619  -8.235
  259   HD13  LEU  31          HD13      LEU  31  -9.267  -4.395  -6.682
  260   HD21  LEU  31          HD21      LEU  31 -11.119  -2.665  -6.213
  261   HD22  LEU  31          HD22      LEU  31 -10.774  -2.042  -7.824
  262   HD23  LEU  31          HD23      LEU  31 -10.738  -0.959  -6.434
  263    H    ASP  32           H        ASP  32  -6.206  -0.593  -6.716
  264    HA   ASP  32           HA       ASP  32  -5.228  -2.978  -8.005
  265    HB2  ASP  32           HB2      ASP  32  -6.213  -1.037  -9.214
  266    HB3  ASP  32           HB3      ASP  32  -4.825  -0.119  -8.729
  267    H    CYS  33           H        CYS  33  -4.040  -0.092  -6.570
  268    HA   CYS  33           HA       CYS  33  -1.281  -0.711  -6.675
  269    HB2  CYS  33           HB2      CYS  33  -2.797   1.277  -5.000
  270    HB3  CYS  33           HB3      CYS  33  -1.066   1.077  -4.943
  271    H    GLU  34           H        GLU  34  -3.883  -1.206  -4.463
  272    HA   GLU  34           HA       GLU  34  -2.427  -2.029  -2.267
  273    HB2  GLU  34           HB2      GLU  34  -4.860  -1.490  -2.310
  274    HB3  GLU  34           HB3      GLU  34  -5.149  -3.019  -3.088
  275    HG2  GLU  34           HG2      GLU  34  -3.768  -2.912  -0.485
  276    HG3  GLU  34           HG3      GLU  34  -5.512  -2.827  -0.578
  277    H    ARG  35           H        ARG  35  -3.612  -3.846  -5.041
  278    HA   ARG  35           HA       ARG  35  -2.258  -6.198  -4.144
  279    HB2  ARG  35           HB2      ARG  35  -2.775  -7.157  -6.394
  280    HB3  ARG  35           HB3      ARG  35  -4.175  -6.616  -5.482
  281    HG2  ARG  35           HG2      ARG  35  -4.110  -4.514  -6.802
  282    HG3  ARG  35           HG3      ARG  35  -2.858  -5.239  -7.794
  283    HD2  ARG  35           HD2      ARG  35  -4.381  -6.997  -8.415
  284    HD3  ARG  35           HD3      ARG  35  -5.628  -6.334  -7.371
  285    HE   ARG  35           HE       ARG  35  -4.657  -4.472  -9.325
  286   HH11  ARG  35          HH11      ARG  35  -6.921  -7.090  -8.791
  287   HH12  ARG  35          HH12      ARG  35  -8.007  -6.568 -10.040
  288   HH21  ARG  35          HH21      ARG  35  -6.076  -3.764 -10.934
  289   HH22  ARG  35          HH22      ARG  35  -7.529  -4.666 -11.261
  290    H    LYS  36           H        LYS  36  -1.323  -3.479  -5.998
  291    HA   LYS  36           HA       LYS  36   0.788  -4.559  -7.495
  292    HB2  LYS  36           HB2      LYS  36   0.377  -1.833  -6.368
  293    HB3  LYS  36           HB3      LYS  36   1.702  -2.219  -7.430
  294    HG2  LYS  36           HG2      LYS  36  -0.027  -2.787  -9.139
  295    HG3  LYS  36           HG3      LYS  36  -1.231  -2.211  -8.063
  296    HD2  LYS  36           HD2      LYS  36  -0.615  -0.140  -8.357
  297    HD3  LYS  36           HD3      LYS  36   1.061  -0.487  -8.669
  298    HE2  LYS  36           HE2      LYS  36  -1.143  -1.187 -10.582
  299    HE3  LYS  36           HE3      LYS  36  -0.350   0.382 -10.600
  300    HZ1  LYS  36           HZ1      LYS  36   0.679  -1.126 -12.179
  301    HZ2  LYS  36           HZ2      LYS  36   0.998  -2.240 -10.951
  302    HZ3  LYS  36           HZ3      LYS  36   1.774  -0.740 -10.951
  303    H    VAL  37           H        VAL  37   0.466  -3.267  -4.312
  304    HA   VAL  37           HA       VAL  37   3.132  -3.008  -3.683
  305    HB   VAL  37           HB       VAL  37   2.423  -2.979  -1.347
  306   HG11  VAL  37          HG11      VAL  37   0.363  -1.479  -2.930
  307   HG12  VAL  37          HG12      VAL  37   2.065  -1.033  -3.005
  308   HG13  VAL  37          HG13      VAL  37   1.205  -0.969  -1.465
  309   HG21  VAL  37          HG21      VAL  37   0.809  -4.570  -1.064
  310   HG22  VAL  37          HG22      VAL  37  -0.085  -4.073  -2.503
  311   HG23  VAL  37          HG23      VAL  37  -0.137  -3.081  -1.040
  312    H    ILE  38           H        ILE  38   0.926  -5.620  -3.053
  313    HA   ILE  38           HA       ILE  38   2.558  -7.376  -1.627
  314    HB   ILE  38           HB       ILE  38   0.504  -8.375  -3.573
  315   HG12  ILE  38          HG12      ILE  38  -0.018  -6.742  -1.112
  316   HG13  ILE  38          HG13      ILE  38  -0.662  -6.514  -2.719
  317   HG21  ILE  38          HG21      ILE  38   1.362  -9.164  -0.809
  318   HG22  ILE  38          HG22      ILE  38   1.586 -10.059  -2.308
  319   HG23  ILE  38          HG23      ILE  38  -0.030  -9.864  -1.628
  320   HD11  ILE  38          HD11      ILE  38  -2.215  -8.202  -2.491
  321   HD12  ILE  38          HD12      ILE  38  -2.193  -7.476  -0.879
  322   HD13  ILE  38          HD13      ILE  38  -1.328  -8.980  -1.185
  323    H    SER  39           H        SER  39   2.197  -6.576  -4.914
  324    HA   SER  39           HA       SER  39   3.558  -8.894  -5.836
  325    HB2  SER  39           HB2      SER  39   1.670  -7.811  -7.091
  326    HB3  SER  39           HB3      SER  39   2.755  -6.469  -7.444
  327    HG   SER  39           HG       SER  39   3.887  -7.702  -8.794
  328    H    THR  40           H        THR  40   4.304  -5.633  -5.057
  329    HA   THR  40           HA       THR  40   6.837  -5.552  -6.442
  330    HB   THR  40           HB       THR  40   5.732  -3.654  -4.374
  331    HG1  THR  40           HG1      THR  40   4.368  -3.932  -6.259
  332   HG21  THR  40          HG21      THR  40   8.126  -3.384  -4.767
  333   HG22  THR  40          HG22      THR  40   7.226  -2.018  -5.422
  334   HG23  THR  40          HG23      THR  40   7.838  -3.269  -6.503
  335    H    SER  41           H        SER  41   5.659  -6.127  -3.190
  336    HA   SER  41           HA       SER  41   8.128  -5.869  -1.842
  337    HB2  SER  41           HB2      SER  41   6.865  -7.237  -0.052
  338    HB3  SER  41           HB3      SER  41   6.266  -5.634  -0.474
  339    HG   SER  41           HG       SER  41   4.460  -6.647  -0.789
  340    H    THR  42           H        THR  42   7.128  -8.218  -3.970
  341    HA   THR  42           HA       THR  42   8.181 -10.558  -2.742
  342    HB   THR  42           HB       THR  42   7.892 -11.603  -4.920
  343    HG1  THR  42           HG1      THR  42   8.633  -9.965  -6.287
  344   HG21  THR  42          HG21      THR  42   5.515 -11.111  -5.287
  345   HG22  THR  42          HG22      THR  42   5.670  -9.642  -4.317
  346   HG23  THR  42          HG23      THR  42   5.884 -11.226  -3.565
  347    H    SER  43           H        SER  43  10.052  -8.587  -2.457
  348    HA   SER  43           HA       SER  43  12.346  -9.728  -3.832
  349    HB2  SER  43           HB2      SER  43  13.223  -7.371  -4.219
  350    HB3  SER  43           HB3      SER  43  11.877  -7.847  -5.254
  351    HG   SER  43           HG       SER  43  10.670  -6.364  -4.358
  352    H    ASP  44           H        ASP  44  11.422 -10.132  -1.256
  353    HA   ASP  44           HA       ASP  44  12.331  -8.381   0.709
  354    HB2  ASP  44           HB2      ASP  44  10.774 -10.134   1.263
  355    HB3  ASP  44           HB3      ASP  44  11.953 -11.373   0.842
  356    HA   PRO  45           HA       PRO  45  16.482 -10.922   0.930
  357    HB2  PRO  45           HB2      PRO  45  17.125 -12.120  -1.475
  358    HB3  PRO  45           HB3      PRO  45  16.491 -12.956  -0.096
  359    HG2  PRO  45           HG2      PRO  45  15.153 -12.095  -2.473
  360    HG3  PRO  45           HG3      PRO  45  14.873 -13.530  -1.530
  361    HD2  PRO  45           HD2      PRO  45  13.233 -11.385  -1.473
  362    HD3  PRO  45           HD3      PRO  45  13.506 -12.429  -0.073
  363    H    ASP  46           H        ASP  46  18.528 -10.223   0.083
  364    HA   ASP  46           HA       ASP  46  18.190  -7.723  -1.386
  365    HB2  ASP  46           HB2      ASP  46  20.588  -8.706   0.162
  366    HB3  ASP  46           HB3      ASP  46  20.366  -7.096  -0.496
  367    H    TYR  47           H        TYR  47  20.288  -7.139  -2.633
  368    HA   TYR  47           HA       TYR  47  20.554  -9.241  -4.650
  369    HB2  TYR  47           HB2      TYR  47  21.304  -7.306  -6.111
  370    HB3  TYR  47           HB3      TYR  47  19.631  -7.251  -5.571
  371    HD1  TYR  47           HD1      TYR  47  19.164  -5.829  -3.435
  372    HD2  TYR  47           HD2      TYR  47  22.666  -5.437  -5.822
  373    HE1  TYR  47           HE1      TYR  47  19.512  -3.574  -2.544
  374    HE2  TYR  47           HE2      TYR  47  23.028  -3.177  -4.920
  375    HH   TYR  47           HH       TYR  47  21.716  -1.373  -3.883
  376    H    ALA  48           H        ALA  48  22.107  -9.204  -2.209
  377    HA   ALA  48           HA       ALA  48  24.806  -8.738  -3.281
  378    HB1  ALA  48           HB1      ALA  48  25.569  -8.685  -0.960
  379    HB2  ALA  48           HB2      ALA  48  23.922  -8.981  -0.407
  380    HB3  ALA  48           HB3      ALA  48  24.315  -7.480  -1.241
  381    H1   SER   0           H1       SER   0  16.017  14.847 -14.343
  382    H2   SER   0           H2       SER   0  15.798  16.188 -13.339
  383    H3   SER   0           H3       SER   0  14.651  15.828 -14.525
  384    HA   SER   0           HA       SER   0  14.050  13.814 -13.416
  385    HB2  SER   0           HB2      SER   0  16.333  13.408 -12.463
  386    HB3  SER   0           HB3      SER   0  16.016  14.672 -11.277
  387    HG   SER   0           HG       SER   0  15.475  12.184 -10.976
  388    H    MET   1           H        MET   1  12.141  14.949 -13.421
  389    HA   MET   1           HA       MET   1  11.497  16.315 -10.930
  390    HB2  MET   1           HB2      MET   1  12.162  18.123 -12.455
  391    HB3  MET   1           HB3      MET   1  11.008  17.553 -13.648
  392    HG2  MET   1           HG2      MET   1  10.161  19.494 -12.469
  393    HG3  MET   1           HG3      MET   1   9.169  18.075 -12.143
  394    HE1  MET   1           HE1      MET   1   8.916  20.022  -8.774
  395    HE2  MET   1           HE2      MET   1   8.028  19.248 -10.086
  396    HE3  MET   1           HE3      MET   1   8.969  20.705 -10.398
  397    H    ASP   2           H        ASP   2  10.534  14.112 -10.849
  398    HA   ASP   2           HA       ASP   2   7.736  14.290 -11.452
  399    HB2  ASP   2           HB2      ASP   2   8.497  13.453 -13.612
  400    HB3  ASP   2           HB3      ASP   2   9.383  12.153 -12.823
  401    H    GLU   3           H        GLU   3  10.357  12.075 -10.594
  402    HA   GLU   3           HA       GLU   3   8.591  10.720  -8.704
  403    HB2  GLU   3           HB2      GLU   3   9.828   9.311 -10.265
  404    HB3  GLU   3           HB3      GLU   3  11.346  10.010  -9.722
  405    HG2  GLU   3           HG2      GLU   3  10.984   9.058  -7.499
  406    HG3  GLU   3           HG3      GLU   3   9.470   8.347  -8.058
  407    H    THR   4           H        THR   4   8.632  11.250  -6.646
  408    HA   THR   4           HA       THR   4  10.808  12.806  -5.534
  409    HB   THR   4           HB       THR   4   9.419  12.713  -3.437
  410    HG1  THR   4           HG1      THR   4   8.338  10.684  -4.204
  411   HG21  THR   4          HG21      THR   4   8.025  13.682  -5.934
  412   HG22  THR   4          HG22      THR   4   9.223  14.578  -5.002
  413   HG23  THR   4          HG23      THR   4   7.656  14.195  -4.288
  414    H    VAL   5           H        VAL   5  12.606  11.619  -5.202
  415    HA   VAL   5           HA       VAL   5  12.420   8.867  -4.339
  416    HB   VAL   5           HB       VAL   5  14.884  10.548  -4.817
  417   HG11  VAL   5          HG11      VAL   5  14.543   7.563  -4.555
  418   HG12  VAL   5          HG12      VAL   5  15.338   8.629  -3.397
  419   HG13  VAL   5          HG13      VAL   5  16.039   8.386  -4.997
  420   HG21  VAL   5          HG21      VAL   5  13.453   8.620  -6.642
  421   HG22  VAL   5          HG22      VAL   5  15.002   9.389  -6.981
  422   HG23  VAL   5          HG23      VAL   5  13.545  10.370  -6.836
  423    H    LYS   6           H        LYS   6  14.608  11.402  -3.147
  424    HA   LYS   6           HA       LYS   6  15.238  12.044  -1.070
  425    HB2  LYS   6           HB2      LYS   6  12.740  10.690  -0.112
  426    HB3  LYS   6           HB3      LYS   6  13.718  11.798   0.821
  427    HG2  LYS   6           HG2      LYS   6  13.147  13.594  -0.639
  428    HG3  LYS   6           HG3      LYS   6  12.306  12.508  -1.738
  429    HD2  LYS   6           HD2      LYS   6  10.666  13.647  -0.413
  430    HD3  LYS   6           HD3      LYS   6  10.737  11.975   0.126
  431    HE2  LYS   6           HE2      LYS   6  12.097  12.606   2.022
  432    HE3  LYS   6           HE3      LYS   6  12.124  14.273   1.461
  433    HZ1  LYS   6           HZ1      LYS   6   9.743  12.755   2.378
  434    HZ2  LYS   6           HZ2      LYS   6   9.687  14.311   1.717
  435    HZ3  LYS   6           HZ3      LYS   6  10.490  14.047   3.179
  436    H    LEU   7           H        LEU   7  16.285  11.207   0.872
  437    HA   LEU   7           HA       LEU   7  17.488   8.687   0.428
  438    HB2  LEU   7           HB2      LEU   7  17.488  10.542   2.791
  439    HB3  LEU   7           HB3      LEU   7  18.304   9.005   2.840
  440    HG   LEU   7           HG       LEU   7  19.627   9.764   0.823
  441   HD11  LEU   7          HD11      LEU   7  18.444  12.398   1.640
  442   HD12  LEU   7          HD12      LEU   7  18.152  11.549   0.126
  443   HD13  LEU   7          HD13      LEU   7  19.759  12.180   0.488
  444   HD21  LEU   7          HD21      LEU   7  21.170  11.085   2.178
  445   HD22  LEU   7          HD22      LEU   7  20.564   9.693   3.074
  446   HD23  LEU   7          HD23      LEU   7  19.918  11.300   3.401
  447    H    ASN   8           H        ASN   8  15.674   9.552   3.380
  448    HA   ASN   8           HA       ASN   8  14.545   6.860   3.413
  449    HB2  ASN   8           HB2      ASN   8  14.096   9.124   5.365
  450    HB3  ASN   8           HB3      ASN   8  13.545   7.492   5.573
  451   HD21  ASN   8          HD21      ASN   8  15.233   9.039   7.287
  452   HD22  ASN   8          HD22      ASN   8  16.716   8.168   7.430
  453    H    HIS   9           H        HIS   9  13.030   6.674   1.935
  454    HA   HIS   9           HA       HIS   9  11.405   8.705   0.917
  455    HB2  HIS   9           HB2      HIS   9  10.503   5.839   0.989
  456    HB3  HIS   9           HB3      HIS   9  10.275   7.036  -0.280
  457    HD1  HIS   9           HD1      HIS   9  12.615   7.692  -1.585
  458    HD2  HIS   9           HD2      HIS   9  12.541   4.131   0.556
  459    HE1  HIS   9           HE1      HIS   9  14.526   6.322  -2.480
  460    HE2  HIS   9           HE2      HIS   9  14.518   4.208  -1.111
  461    H    THR  10           H        THR  10   9.627   9.665   1.722
  462    HA   THR  10           HA       THR  10   8.757   9.065   4.356
  463    HB   THR  10           HB       THR  10   7.429  10.846   2.307
  464    HG1  THR  10           HG1      THR  10   8.865  12.120   4.222
  465   HG21  THR  10          HG21      THR  10   5.998  10.320   4.221
  466   HG22  THR  10          HG22      THR  10   6.514  12.006   4.268
  467   HG23  THR  10          HG23      THR  10   7.280  10.820   5.325
  468    H    CYS  11           H        CYS  11   7.157   7.757   5.044
  469    HA   CYS  11           HA       CYS  11   5.828   6.036   3.223
  470    HB2  CYS  11           HB2      CYS  11   6.215   5.298   5.523
  471    HB3  CYS  11           HB3      CYS  11   5.190   6.587   6.125
  472    H    VAL  12           H        VAL  12   4.402   6.689   1.859
  473    HA   VAL  12           HA       VAL  12   2.681   8.735   1.777
  474    HB   VAL  12           HB       VAL  12   3.233   6.606   0.302
  475   HG11  VAL  12          HG11      VAL  12   1.290   5.211  -0.057
  476   HG12  VAL  12          HG12      VAL  12   0.537   5.916   1.375
  477   HG13  VAL  12          HG13      VAL  12   2.030   4.979   1.524
  478   HG21  VAL  12          HG21      VAL  12   2.445   8.502  -0.633
  479   HG22  VAL  12          HG22      VAL  12   0.880   8.362   0.163
  480   HG23  VAL  12          HG23      VAL  12   1.323   7.234  -1.119
  481    H    ILE  13           H        ILE  13   2.560   6.086   3.956
  482    HA   ILE  13           HA       ILE  13  -0.231   6.547   4.657
  483    HB   ILE  13           HB       ILE  13   1.543   4.455   5.825
  484   HG12  ILE  13          HG12      ILE  13   1.583   4.391   3.320
  485   HG13  ILE  13          HG13      ILE  13   0.964   2.954   4.104
  486   HG21  ILE  13          HG21      ILE  13  -0.597   4.850   6.919
  487   HG22  ILE  13          HG22      ILE  13  -0.536   3.260   6.153
  488   HG23  ILE  13          HG23      ILE  13  -1.424   4.578   5.383
  489   HD11  ILE  13          HD11      ILE  13  -1.280   3.583   3.619
  490   HD12  ILE  13          HD12      ILE  13  -0.321   3.612   2.138
  491   HD13  ILE  13          HD13      ILE  13  -0.735   5.119   2.953
  492    H    CYS  14           H        CYS  14   2.896   6.126   6.303
  493    HA   CYS  14           HA       CYS  14   1.818   6.987   8.831
  494    HB2  CYS  14           HB2      CYS  14   4.615   6.335   8.028
  495    HB3  CYS  14           HB3      CYS  14   4.128   6.648   9.665
  496    H    ASP  15           H        ASP  15   3.392   8.501   6.201
  497    HA   ASP  15           HA       ASP  15   4.267  10.550   5.804
  498    HB2  ASP  15           HB2      ASP  15   2.186  11.191   7.224
  499    HB3  ASP  15           HB3      ASP  15   3.383  11.561   8.448
  500    H    GLN  16           H        GLN  16   5.758   8.509   7.126
  501    HA   GLN  16           HA       GLN  16   7.693  10.072   8.677
  502    HB2  GLN  16           HB2      GLN  16   7.072   7.118   8.861
  503    HB3  GLN  16           HB3      GLN  16   8.309   7.953   9.778
  504    HG2  GLN  16           HG2      GLN  16   5.373   8.460   9.943
  505    HG3  GLN  16           HG3      GLN  16   6.323   7.554  11.110
  506   HE21  GLN  16          HE21      GLN  16   4.708   9.969  11.426
  507   HE22  GLN  16          HE22      GLN  16   5.769  11.171  12.070
  508    H    GLU  17           H        GLU  17   9.836   9.797   8.182
  509    HA   GLU  17           HA       GLU  17  10.416   9.090   5.468
  510    HB2  GLU  17           HB2      GLU  17  12.196  10.189   7.649
  511    HB3  GLU  17           HB3      GLU  17  12.634  10.032   5.955
  512    HG2  GLU  17           HG2      GLU  17  11.050  11.651   5.299
  513    HG3  GLU  17           HG3      GLU  17  10.307  11.638   6.890
  514    H    LYS  18           H        LYS  18  10.652   7.057   5.061
  515    HA   LYS  18           HA       LYS  18  12.309   5.378   6.840
  516    HB2  LYS  18           HB2      LYS  18  10.222   4.070   5.185
  517    HB3  LYS  18           HB3      LYS  18  10.846   3.644   6.764
  518    HG2  LYS  18           HG2      LYS  18   8.910   5.863   6.196
  519    HG3  LYS  18           HG3      LYS  18   8.503   4.285   6.856
  520    HD2  LYS  18           HD2      LYS  18  10.493   6.025   8.219
  521    HD3  LYS  18           HD3      LYS  18   8.788   6.309   8.434
  522    HE2  LYS  18           HE2      LYS  18   9.743   4.955  10.223
  523    HE3  LYS  18           HE3      LYS  18   8.506   4.121   9.313
  524    HZ1  LYS  18           HZ1      LYS  18  10.456   2.733   9.850
  525    HZ2  LYS  18           HZ2      LYS  18  11.408   3.738   8.880
  526    HZ3  LYS  18           HZ3      LYS  18  10.154   2.835   8.191
  527    H    ASN  19           H        ASN  19  13.763   4.016   5.868
  528    HA   ASN  19           HA       ASN  19  14.161   4.492   3.013
  529    HB2  ASN  19           HB2      ASN  19  16.407   3.882   3.309
  530    HB3  ASN  19           HB3      ASN  19  16.005   4.770   4.771
  531   HD21  ASN  19          HD21      ASN  19  16.950   1.752   3.430
  532   HD22  ASN  19          HD22      ASN  19  17.143   0.898   4.953
  533    H    ARG  20           H        ARG  20  12.687   2.233   4.963
  534    HA   ARG  20           HA       ARG  20  13.128   0.111   2.973
  535    HB2  ARG  20           HB2      ARG  20  12.751  -0.055   5.935
  536    HB3  ARG  20           HB3      ARG  20  12.374  -1.431   4.914
  537    HG2  ARG  20           HG2      ARG  20  14.680  -1.300   4.023
  538    HG3  ARG  20           HG3      ARG  20  15.029  -0.074   5.229
  539    HD2  ARG  20           HD2      ARG  20  14.154  -1.771   6.872
  540    HD3  ARG  20           HD3      ARG  20  14.288  -2.950   5.592
  541    HE   ARG  20           HE       ARG  20  16.741  -1.722   5.703
  542   HH11  ARG  20          HH11      ARG  20  14.748  -3.549   7.918
  543   HH12  ARG  20          HH12      ARG  20  16.094  -4.185   8.805
  544   HH21  ARG  20          HH21      ARG  20  18.522  -2.577   6.853
  545   HH22  ARG  20          HH22      ARG  20  18.241  -3.645   8.189
  546    H    GLY  21           H        GLY  21  11.471  -0.464   1.809
  547    HA2  GLY  21           HA2      GLY  21   8.875  -1.008   2.404
  548    HA3  GLY  21           HA3      GLY  21   8.885   0.741   2.189
  549    H    ILE  22           H        ILE  22   7.412   0.126   0.249
  550    HA   ILE  22           HA       ILE  22   9.171  -0.497  -2.014
  551    HB   ILE  22           HB       ILE  22   7.527  -1.675  -3.080
  552   HG12  ILE  22          HG12      ILE  22   5.478  -0.234  -1.422
  553   HG13  ILE  22          HG13      ILE  22   5.955   0.213  -3.023
  554   HG21  ILE  22          HG21      ILE  22   8.025  -2.954  -1.123
  555   HG22  ILE  22          HG22      ILE  22   6.291  -3.084  -1.423
  556   HG23  ILE  22          HG23      ILE  22   6.891  -2.014  -0.151
  557   HD11  ILE  22          HD11      ILE  22   4.519  -2.268  -2.190
  558   HD12  ILE  22          HD12      ILE  22   5.175  -2.005  -3.804
  559   HD13  ILE  22          HD13      ILE  22   3.907  -0.947  -3.192
  560    H    HIS  23           H        HIS  23   7.778   0.252  -4.041
  561    HA   HIS  23           HA       HIS  23   6.728   2.906  -3.786
  562    HB2  HIS  23           HB2      HIS  23   8.465   3.924  -5.294
  563    HB3  HIS  23           HB3      HIS  23   9.046   3.530  -3.694
  564    HD1  HIS  23           HD1      HIS  23   9.569   2.790  -7.284
  565    HD2  HIS  23           HD2      HIS  23  10.831   1.387  -3.606
  566    HE1  HIS  23           HE1      HIS  23  11.589   1.376  -7.770
  567    HE2  HIS  23           HE2      HIS  23  12.225   0.386  -5.544
  568    H    LEU  24           H        LEU  24   5.065   2.892  -5.157
  569    HA   LEU  24           HA       LEU  24   5.008   0.962  -7.318
  570    HB2  LEU  24           HB2      LEU  24   3.031   2.713  -5.960
  571    HB3  LEU  24           HB3      LEU  24   2.720   2.296  -7.601
  572    HG   LEU  24           HG       LEU  24   1.787   0.395  -6.971
  573   HD11  LEU  24          HD11      LEU  24   4.269  -0.269  -5.472
  574   HD12  LEU  24          HD12      LEU  24   3.888  -0.692  -7.145
  575   HD13  LEU  24          HD13      LEU  24   2.927  -1.361  -5.825
  576   HD21  LEU  24          HD21      LEU  24   2.518   1.187  -4.197
  577   HD22  LEU  24          HD22      LEU  24   1.316  -0.022  -4.664
  578   HD23  LEU  24          HD23      LEU  24   1.079   1.673  -5.097
  579    H    TYR  25           H        TYR  25   4.059   4.334  -7.049
  580    HA   TYR  25           HA       TYR  25   4.789   4.737  -9.833
  581    HB2  TYR  25           HB2      TYR  25   3.082   6.473  -8.086
  582    HB3  TYR  25           HB3      TYR  25   3.312   6.672  -9.809
  583    HD1  TYR  25           HD1      TYR  25   3.123   3.254  -9.075
  584    HD2  TYR  25           HD2      TYR  25   0.627   6.674  -9.499
  585    HE1  TYR  25           HE1      TYR  25   1.219   1.783  -9.426
  586    HE2  TYR  25           HE2      TYR  25  -1.317   5.206  -9.880
  587    HH   TYR  25           HH       TYR  25  -1.701   2.893 -10.721
  588    H    THR  26           H        THR  26   4.478   7.499  -7.857
  589    HA   THR  26           HA       THR  26   7.395   7.713  -7.666
  590    HB   THR  26           HB       THR  26   6.695   9.578  -8.857
  591    HG1  THR  26           HG1      THR  26   7.117  10.094  -6.151
  592   HG21  THR  26          HG21      THR  26   4.736  10.921  -8.365
  593   HG22  THR  26          HG22      THR  26   4.390   9.929  -6.949
  594   HG23  THR  26          HG23      THR  26   4.294   9.223  -8.566
  595    H    LYS  27           H        LYS  27   4.913   6.676  -5.811
  596    HA   LYS  27           HA       LYS  27   5.709   8.148  -3.402
  597    HB2  LYS  27           HB2      LYS  27   3.641   6.464  -2.679
  598    HB3  LYS  27           HB3      LYS  27   3.517   8.175  -3.029
  599    HG2  LYS  27           HG2      LYS  27   3.291   6.090  -5.169
  600    HG3  LYS  27           HG3      LYS  27   1.915   6.613  -4.201
  601    HD2  LYS  27           HD2      LYS  27   3.663   8.394  -5.881
  602    HD3  LYS  27           HD3      LYS  27   2.066   7.822  -6.328
  603    HE2  LYS  27           HE2      LYS  27   1.709   8.945  -3.813
  604    HE3  LYS  27           HE3      LYS  27   2.855  10.024  -4.603
  605    HZ1  LYS  27           HZ1      LYS  27   0.903  10.930  -5.299
  606    HZ2  LYS  27           HZ2      LYS  27   0.061   9.468  -5.266
  607    HZ3  LYS  27           HZ3      LYS  27   1.109   9.804  -6.545
  608    H    PHE  28           H        PHE  28   5.218   6.714  -1.398
  609    HA   PHE  28           HA       PHE  28   6.624   4.167  -1.596
  610    HB2  PHE  28           HB2      PHE  28   8.399   5.674  -1.145
  611    HB3  PHE  28           HB3      PHE  28   7.441   6.574   0.010
  612    HD1  PHE  28           HD1      PHE  28   7.320   5.930   2.277
  613    HD2  PHE  28           HD2      PHE  28   9.304   3.438  -0.530
  614    HE1  PHE  28           HE1      PHE  28   8.244   4.605   4.128
  615    HE2  PHE  28           HE2      PHE  28  10.232   2.104   1.311
  616    HZ   PHE  28           HZ       PHE  28   9.691   2.669   3.656
  617    H    ILE  29           H        ILE  29   5.211   2.795  -0.696
  618    HA   ILE  29           HA       ILE  29   3.838   3.552   1.768
  619    HB   ILE  29           HB       ILE  29   3.893   0.847   0.367
  620   HG12  ILE  29          HG12      ILE  29   1.415   1.407  -0.031
  621   HG13  ILE  29          HG13      ILE  29   1.863   3.074   0.301
  622   HG21  ILE  29          HG21      ILE  29   2.230   1.811   2.685
  623   HG22  ILE  29          HG22      ILE  29   3.559   0.651   2.762
  624   HG23  ILE  29          HG23      ILE  29   2.075   0.243   1.894
  625   HD11  ILE  29          HD11      ILE  29   3.389   3.072  -1.559
  626   HD12  ILE  29          HD12      ILE  29   1.798   2.536  -2.093
  627   HD13  ILE  29          HD13      ILE  29   3.087   1.360  -1.845
  628    H    CYS  30           H        CYS  30   4.955   3.239   3.707
  629    HA   CYS  30           HA       CYS  30   7.474   1.959   3.740
  630    HB2  CYS  30           HB2      CYS  30   7.615   2.346   6.006
  631    HB3  CYS  30           HB3      CYS  30   6.475   3.570   5.509
  632    H    LEU  31           H        LEU  31   8.104   0.044   4.684
  633    HA   LEU  31           HA       LEU  31   6.922  -2.117   3.520
  634    HB2  LEU  31           HB2      LEU  31   8.668  -3.324   4.437
  635    HB3  LEU  31           HB3      LEU  31   9.295  -1.711   4.359
  636    HG   LEU  31           HG       LEU  31   8.381  -1.635   6.862
  637   HD11  LEU  31          HD11      LEU  31   7.504  -3.912   6.842
  638   HD12  LEU  31          HD12      LEU  31   8.819  -3.746   8.004
  639   HD13  LEU  31          HD13      LEU  31   9.107  -4.534   6.453
  640   HD21  LEU  31          HD21      LEU  31  10.996  -2.841   5.982
  641   HD22  LEU  31          HD22      LEU  31  10.656  -2.204   7.590
  642   HD23  LEU  31          HD23      LEU  31  10.642  -1.126   6.194
  643    H    ASP  32           H        ASP  32   6.121  -0.680   6.473
  644    HA   ASP  32           HA       ASP  32   5.089  -3.037   7.775
  645    HB2  ASP  32           HB2      ASP  32   6.119  -1.111   8.970
  646    HB3  ASP  32           HB3      ASP  32   4.745  -0.169   8.488
  647    H    CYS  33           H        CYS  33   3.971  -0.111   6.309
  648    HA   CYS  33           HA       CYS  33   1.195  -0.705   6.440
  649    HB2  CYS  33           HB2      CYS  33   2.737   1.248   4.752
  650    HB3  CYS  33           HB3      CYS  33   1.003   1.077   4.699
  651    H    GLU  34           H        GLU  34   3.783  -1.259   4.224
  652    HA   GLU  34           HA       GLU  34   2.308  -2.060   2.030
  653    HB2  GLU  34           HB2      GLU  34   4.752  -1.564   2.071
  654    HB3  GLU  34           HB3      GLU  34   5.013  -3.096   2.854
  655    HG2  GLU  34           HG2      GLU  34   3.631  -2.971   0.251
  656    HG3  GLU  34           HG3      GLU  34   5.376  -2.917   0.343
  657    H    ARG  35           H        ARG  35   3.466  -3.889   4.808
  658    HA   ARG  35           HA       ARG  35   2.070  -6.218   3.921
  659    HB2  ARG  35           HB2      ARG  35   2.575  -7.178   6.174
  660    HB3  ARG  35           HB3      ARG  35   3.983  -6.664   5.260
  661    HG2  ARG  35           HG2      ARG  35   3.952  -4.559   6.576
  662    HG3  ARG  35           HG3      ARG  35   2.687  -5.260   7.567
  663    HD2  ARG  35           HD2      ARG  35   4.176  -7.042   8.194
  664    HD3  ARG  35           HD3      ARG  35   5.436  -6.409   7.148
  665    HE   ARG  35           HE       ARG  35   4.503  -4.518   9.095
  666   HH11  ARG  35          HH11      ARG  35   6.717  -7.185   8.571
  667   HH12  ARG  35          HH12      ARG  35   7.813  -6.679   9.818
  668   HH21  ARG  35          HH21      ARG  35   5.940  -3.833  10.699
  669   HH22  ARG  35          HH22      ARG  35   7.374  -4.765  11.031
  670    H    LYS  36           H        LYS  36   1.178  -3.481   5.768
  671    HA   LYS  36           HA       LYS  36  -0.949  -4.516   7.270
  672    HB2  LYS  36           HB2      LYS  36  -0.474  -1.795   6.148
  673    HB3  LYS  36           HB3      LYS  36  -1.824  -2.156   7.188
  674    HG2  LYS  36           HG2      LYS  36  -0.162  -2.819   8.946
  675    HG3  LYS  36           HG3      LYS  36   1.064  -2.222   7.870
  676    HD2  LYS  36           HD2      LYS  36   0.541  -0.085   8.104
  677    HD3  LYS  36           HD3      LYS  36  -1.119  -0.477   8.429
  678    HE2  LYS  36           HE2      LYS  36   1.038  -1.169  10.347
  679    HE3  LYS  36           HE3      LYS  36   0.275   0.411  10.356
  680    HZ1  LYS  36           HZ1      LYS  36  -0.774  -1.069  11.948
  681    HZ2  LYS  36           HZ2      LYS  36  -1.116  -2.187  10.725
  682    HZ3  LYS  36           HZ3      LYS  36  -1.866  -0.672  10.720
  683    H    VAL  37           H        VAL  37  -0.603  -3.245   4.082
  684    HA   VAL  37           HA       VAL  37  -3.267  -2.934   3.456
  685    HB   VAL  37           HB       VAL  37  -2.557  -2.927   1.117
  686   HG11  VAL  37          HG11      VAL  37  -0.470  -1.460   2.696
  687   HG12  VAL  37          HG12      VAL  37  -2.164  -0.984   2.767
  688   HG13  VAL  37          HG13      VAL  37  -1.302  -0.939   1.228
  689   HG21  VAL  37          HG21      VAL  37  -0.973  -4.549   0.839
  690   HG22  VAL  37          HG22      VAL  37  -0.070  -4.064   2.278
  691   HG23  VAL  37          HG23      VAL  37   0.000  -3.078   0.811
  692    H    ILE  38           H        ILE  38  -1.109  -5.587   2.831
  693    HA   ILE  38           HA       ILE  38  -2.772  -7.319   1.414
  694    HB   ILE  38           HB       ILE  38  -0.733  -8.350   3.359
  695   HG12  ILE  38          HG12      ILE  38  -0.185  -6.733   0.893
  696   HG13  ILE  38          HG13      ILE  38   0.464  -6.512   2.500
  697   HG21  ILE  38          HG21      ILE  38  -1.607  -9.131   0.597
  698   HG22  ILE  38          HG22      ILE  38  -1.845 -10.018   2.098
  699   HG23  ILE  38          HG23      ILE  38  -0.226  -9.852   1.418
  700   HD11  ILE  38          HD11      ILE  38   1.985  -8.225   2.276
  701   HD12  ILE  38          HD12      ILE  38   1.975  -7.506   0.663
  702   HD13  ILE  38          HD13      ILE  38   1.084  -8.995   0.977
  703    H    SER  39           H        SER  39  -2.394  -6.513   4.699
  704    HA   SER  39           HA       SER  39  -3.795  -8.809   5.626
  705    HB2  SER  39           HB2      SER  39  -1.893  -7.762   6.890
  706    HB3  SER  39           HB3      SER  39  -2.947  -6.392   7.228
  707    HG   SER  39           HG       SER  39  -4.099  -7.581   8.593
  708    H    THR  40           H        THR  40  -4.483  -5.536   4.837
  709    HA   THR  40           HA       THR  40  -7.012  -5.404   6.225
  710    HB   THR  40           HB       THR  40  -5.874  -3.535   4.147
  711    HG1  THR  40           HG1      THR  40  -4.521  -3.831   6.044
  712   HG21  THR  40          HG21      THR  40  -8.264  -3.224   4.537
  713   HG22  THR  40          HG22      THR  40  -7.341  -1.870   5.186
  714   HG23  THR  40          HG23      THR  40  -7.973  -3.105   6.273
  715    H    SER  41           H        SER  41  -5.847  -6.012   2.974
  716    HA   SER  41           HA       SER  41  -8.312  -5.713   1.627
  717    HB2  SER  41           HB2      SER  41  -7.076  -7.114  -0.156
  718    HB3  SER  41           HB3      SER  41  -6.451  -5.518   0.257
  719    HG   SER  41           HG       SER  41  -4.663  -6.560   0.576
  720    H    THR  42           H        THR  42  -7.353  -8.073   3.759
  721    HA   THR  42           HA       THR  42  -8.448 -10.399   2.546
  722    HB   THR  42           HB       THR  42  -8.176 -11.442   4.727
  723    HG1  THR  42           HG1      THR  42  -8.890  -9.777   6.086
  724   HG21  THR  42          HG21      THR  42  -5.791 -10.990   5.088
  725   HG22  THR  42          HG22      THR  42  -5.921  -9.522   4.114
  726   HG23  THR  42          HG23      THR  42  -6.165 -11.102   3.368
  727    H    SER  43           H        SER  43 -10.287  -8.398   2.249
  728    HA   SER  43           HA       SER  43 -12.598  -9.490   3.637
  729    HB2  SER  43           HB2      SER  43 -13.428  -7.111   4.005
  730    HB3  SER  43           HB3      SER  43 -12.094  -7.611   5.046
  731    HG   SER  43           HG       SER  43 -10.864  -6.149   4.160
  732    H    ASP  44           H        ASP  44 -11.674  -9.916   1.055
  733    HA   ASP  44           HA       ASP  44 -12.558  -8.161  -0.918
  734    HB2  ASP  44           HB2      ASP  44 -11.035  -9.949  -1.465
  735    HB3  ASP  44           HB3      ASP  44 -12.236 -11.162  -1.036
  736    HA   PRO  45           HA       PRO  45 -16.756 -10.610  -1.122
  737    HB2  PRO  45           HB2      PRO  45 -17.432 -11.819   1.266
  738    HB3  PRO  45           HB3      PRO  45 -16.805 -12.663  -0.139
  739    HG2  PRO  45           HG2      PRO  45 -15.439 -11.782   2.329
  740    HG3  PRO  45           HG3      PRO  45 -15.233 -13.230   1.357
  741    HD2  PRO  45           HD2      PRO  45 -13.499 -11.149   1.263
  742    HD3  PRO  45           HD3      PRO  45 -13.816 -12.194  -0.136
  743    H    ASP  46           H        ASP  46 -18.780  -9.920  -0.249
  744    HA   ASP  46           HA       ASP  46 -18.405  -7.393   1.182
  745    HB2  ASP  46           HB2      ASP  46 -20.822  -8.342  -0.361
  746    HB3  ASP  46           HB3      ASP  46 -20.574  -6.734   0.295
  747    H    TYR  47           H        TYR  47 -20.492  -6.764   2.428
  748    HA   TYR  47           HA       TYR  47 -20.794  -8.855   4.451
  749    HB2  TYR  47           HB2      TYR  47 -21.508  -6.902   5.905
  750    HB3  TYR  47           HB3      TYR  47 -19.834  -6.878   5.365
  751    HD1  TYR  47           HD1      TYR  47 -19.347  -5.470   3.220
  752    HD2  TYR  47           HD2      TYR  47 -22.837  -5.012   5.612
  753    HE1  TYR  47           HE1      TYR  47 -19.660  -3.208   2.319
  754    HE2  TYR  47           HE2      TYR  47 -23.160  -2.749   4.705
  755    HH   TYR  47           HH       TYR  47 -21.823  -0.970   3.669
  756    H    ALA  48           H        ALA  48 -22.347  -8.802   2.009
  757    HA   ALA  48           HA       ALA  48 -25.035  -8.279   3.080
  758    HB1  ALA  48           HB1      ALA  48 -25.800  -8.224   0.760
  759    HB2  ALA  48           HB2      ALA  48 -24.159  -8.559   0.206
  760    HB3  ALA  48           HB3      ALA  48 -24.518  -7.044   1.034
  Start of MODEL   20
    1    H1   SER   0           H1       SER   0   1.269  11.529   3.049
    2    H2   SER   0           H2       SER   0   1.573  11.419   1.376
    3    H3   SER   0           H3       SER   0   0.144  12.152   1.935
    4    HA   SER   0           HA       SER   0   2.910  13.143   2.312
    5    HB2  SER   0           HB2      SER   0   1.833  13.392   0.025
    6    HB3  SER   0           HB3      SER   0   0.615  14.405   0.795
    7    HG   SER   0           HG       SER   0   3.265  14.942   0.181
    8    H    MET   1           H        MET   1  -0.551  13.939   2.675
    9    HA   MET   1           HA       MET   1  -0.189  14.750   5.388
   10    HB2  MET   1           HB2      MET   1   0.693  16.762   4.259
   11    HB3  MET   1           HB3      MET   1  -0.816  16.918   3.372
   12    HG2  MET   1           HG2      MET   1  -2.024  17.275   5.450
   13    HG3  MET   1           HG3      MET   1  -0.528  17.078   6.362
   14    HE1  MET   1           HE1      MET   1  -1.341  20.909   6.705
   15    HE2  MET   1           HE2      MET   1  -1.047  19.403   7.573
   16    HE3  MET   1           HE3      MET   1  -2.512  19.595   6.612
   17    H    ASP   2           H        ASP   2  -2.357  15.747   2.736
   18    HA   ASP   2           HA       ASP   2  -4.523  14.368   4.168
   19    HB2  ASP   2           HB2      ASP   2  -6.111  15.976   3.285
   20    HB3  ASP   2           HB3      ASP   2  -4.834  16.824   4.141
   21    H    GLU   3           H        GLU   3  -5.222  12.639   3.196
   22    HA   GLU   3           HA       GLU   3  -4.814  12.365   0.295
   23    HB2  GLU   3           HB2      GLU   3  -5.163  10.135   2.268
   24    HB3  GLU   3           HB3      GLU   3  -4.611  10.028   0.603
   25    HG2  GLU   3           HG2      GLU   3  -3.140  11.248   2.921
   26    HG3  GLU   3           HG3      GLU   3  -2.777   9.759   2.082
   27    H    THR   4           H        THR   4  -7.121  13.531   1.879
   28    HA   THR   4           HA       THR   4  -9.238  11.609   1.164
   29    HB   THR   4           HB       THR   4 -10.506  12.591   3.122
   30    HG1  THR   4           HG1      THR   4  -9.154  14.461   3.374
   31   HG21  THR   4          HG21      THR   4  -9.310  11.241   4.796
   32   HG22  THR   4          HG22      THR   4  -7.928  11.131   3.706
   33   HG23  THR   4          HG23      THR   4  -9.465  10.391   3.258
   34    H    VAL   5           H        VAL   5 -10.802  12.354  -0.137
   35    HA   VAL   5           HA       VAL   5 -11.384  15.228  -0.134
   36    HB   VAL   5           HB       VAL   5 -11.821  15.151  -2.563
   37   HG11  VAL   5          HG11      VAL   5  -9.008  14.415  -1.766
   38   HG12  VAL   5          HG12      VAL   5  -9.705  16.033  -1.743
   39   HG13  VAL   5          HG13      VAL   5  -9.479  15.193  -3.277
   40   HG21  VAL   5          HG21      VAL   5 -10.482  12.463  -2.420
   41   HG22  VAL   5          HG22      VAL   5 -10.986  13.305  -3.886
   42   HG23  VAL   5          HG23      VAL   5 -12.193  12.742  -2.732
   43    H    LYS   6           H        LYS   6 -12.540  12.449   0.759
   44    HA   LYS   6           HA       LYS   6 -14.585  11.690   1.324
   45    HB2  LYS   6           HB2      LYS   6 -15.353  14.389   0.340
   46    HB3  LYS   6           HB3      LYS   6 -16.598  13.228   0.739
   47    HG2  LYS   6           HG2      LYS   6 -16.167  14.732   2.589
   48    HG3  LYS   6           HG3      LYS   6 -15.724  13.082   2.997
   49    HD2  LYS   6           HD2      LYS   6 -13.389  13.575   2.664
   50    HD3  LYS   6           HD3      LYS   6 -13.778  15.193   2.094
   51    HE2  LYS   6           HE2      LYS   6 -12.999  15.254   4.388
   52    HE3  LYS   6           HE3      LYS   6 -14.688  15.733   4.287
   53    HZ1  LYS   6           HZ1      LYS   6 -15.332  13.534   5.027
   54    HZ2  LYS   6           HZ2      LYS   6 -14.284  14.248   6.147
   55    HZ3  LYS   6           HZ3      LYS   6 -13.711  13.053   5.098
   56    H    LEU   7           H        LEU   7 -16.612  10.825   0.444
   57    HA   LEU   7           HA       LEU   7 -17.672   9.476  -1.010
   58    HB2  LEU   7           HB2      LEU   7 -18.205  11.467  -2.237
   59    HB3  LEU   7           HB3      LEU   7 -16.660  11.421  -3.026
   60    HG   LEU   7           HG       LEU   7 -17.318   9.283  -4.119
   61   HD11  LEU   7          HD11      LEU   7 -19.697   8.720  -4.122
   62   HD12  LEU   7          HD12      LEU   7 -19.981   9.982  -2.925
   63   HD13  LEU   7          HD13      LEU   7 -18.979   8.592  -2.518
   64   HD21  LEU   7          HD21      LEU   7 -19.095  11.663  -4.646
   65   HD22  LEU   7          HD22      LEU   7 -18.805  10.325  -5.756
   66   HD23  LEU   7          HD23      LEU   7 -17.483  11.404  -5.310
   67    H    ASN   8           H        ASN   8 -15.178  10.232  -3.361
   68    HA   ASN   8           HA       ASN   8 -14.264   7.436  -3.246
   69    HB2  ASN   8           HB2      ASN   8 -13.584   9.554  -5.304
   70    HB3  ASN   8           HB3      ASN   8 -13.252   7.842  -5.415
   71   HD21  ASN   8          HD21      ASN   8 -14.699   9.552  -7.223
   72   HD22  ASN   8          HD22      ASN   8 -16.270   8.859  -7.376
   73    H    HIS   9           H        HIS   9 -12.737   7.305  -1.674
   74    HA   HIS   9           HA       HIS   9 -10.974   9.269  -0.811
   75    HB2  HIS   9           HB2      HIS   9 -10.962   6.302  -0.758
   76    HB3  HIS   9           HB3      HIS   9  -9.438   7.106  -0.449
   77    HD1  HIS   9           HD1      HIS   9 -12.652   6.231   1.124
   78    HD2  HIS   9           HD2      HIS   9  -9.408   8.703   1.919
   79    HE1  HIS   9           HE1      HIS   9 -12.811   6.788   3.570
   80    HE2  HIS   9           HE2      HIS   9 -10.742   8.134   4.061
   81    H    THR  10           H        THR  10  -8.714   9.575  -1.275
   82    HA   THR  10           HA       THR  10  -8.248   9.264  -4.143
   83    HB   THR  10           HB       THR  10  -6.684  10.893  -2.108
   84    HG1  THR  10           HG1      THR  10  -9.074  11.329  -3.268
   85   HG21  THR  10          HG21      THR  10  -5.751  12.037  -4.043
   86   HG22  THR  10          HG22      THR  10  -6.688  11.008  -5.125
   87   HG23  THR  10          HG23      THR  10  -5.406  10.310  -4.133
   88    H    CYS  11           H        CYS  11  -6.737   7.937  -4.959
   89    HA   CYS  11           HA       CYS  11  -5.461   6.059  -3.234
   90    HB2  CYS  11           HB2      CYS  11  -6.012   5.429  -5.556
   91    HB3  CYS  11           HB3      CYS  11  -4.914   6.659  -6.159
   92    H    VAL  12           H        VAL  12  -3.852   6.575  -1.969
   93    HA   VAL  12           HA       VAL  12  -2.216   8.813  -2.108
   94    HB   VAL  12           HB       VAL  12  -0.671   7.580  -0.639
   95   HG11  VAL  12          HG11      VAL  12  -2.606   8.644   0.352
   96   HG12  VAL  12          HG12      VAL  12  -2.244   7.135   1.191
   97   HG13  VAL  12          HG13      VAL  12  -3.578   7.206   0.039
   98   HG21  VAL  12          HG21      VAL  12  -1.170   5.282   0.027
   99   HG22  VAL  12          HG22      VAL  12  -0.809   5.390  -1.696
  100   HG23  VAL  12          HG23      VAL  12  -2.479   5.230  -1.153
  101    H    ILE  13           H        ILE  13  -2.272   6.129  -4.115
  102    HA   ILE  13           HA       ILE  13   0.510   6.283  -4.847
  103    HB   ILE  13           HB       ILE  13  -1.486   4.420  -6.033
  104   HG12  ILE  13          HG12      ILE  13  -1.492   4.286  -3.533
  105   HG13  ILE  13          HG13      ILE  13  -1.031   2.812  -4.363
  106   HG21  ILE  13          HG21      ILE  13   1.489   4.214  -5.667
  107   HG22  ILE  13          HG22      ILE  13   0.658   4.612  -7.173
  108   HG23  ILE  13          HG23      ILE  13   0.451   3.018  -6.444
  109   HD11  ILE  13          HD11      ILE  13   0.331   3.319  -2.399
  110   HD12  ILE  13          HD12      ILE  13   0.905   4.771  -3.221
  111   HD13  ILE  13          HD13      ILE  13   1.256   3.177  -3.895
  112    H    CYS  14           H        CYS  14  -2.626   6.188  -6.443
  113    HA   CYS  14           HA       CYS  14  -1.543   7.050  -8.960
  114    HB2  CYS  14           HB2      CYS  14  -4.345   6.556  -8.060
  115    HB3  CYS  14           HB3      CYS  14  -3.913   6.918  -9.706
  116    H    ASP  15           H        ASP  15  -2.842   8.541  -6.211
  117    HA   ASP  15           HA       ASP  15  -3.594  10.578  -5.642
  118    HB2  ASP  15           HB2      ASP  15  -2.112  11.363  -8.126
  119    HB3  ASP  15           HB3      ASP  15  -2.801  12.500  -6.983
  120    H    GLN  16           H        GLN  16  -5.341   8.963  -7.051
  121    HA   GLN  16           HA       GLN  16  -7.041  10.913  -8.431
  122    HB2  GLN  16           HB2      GLN  16  -7.021   7.941  -8.974
  123    HB3  GLN  16           HB3      GLN  16  -7.885   9.178  -9.858
  124    HG2  GLN  16           HG2      GLN  16  -4.931   8.836  -9.763
  125    HG3  GLN  16           HG3      GLN  16  -5.972   8.381 -11.090
  126   HE21  GLN  16          HE21      GLN  16  -3.736  10.201 -11.063
  127   HE22  GLN  16          HE22      GLN  16  -4.351  11.716 -11.602
  128    H    GLU  17           H        GLU  17  -9.378  10.185  -8.306
  129    HA   GLU  17           HA       GLU  17  -9.917   9.545  -5.521
  130    HB2  GLU  17           HB2      GLU  17 -11.734  10.735  -7.612
  131    HB3  GLU  17           HB3      GLU  17 -12.106  10.544  -5.904
  132    HG2  GLU  17           HG2      GLU  17 -10.498  12.116  -5.260
  133    HG3  GLU  17           HG3      GLU  17  -9.750  12.104  -6.850
  134    H    LYS  18           H        LYS  18 -10.130   7.546  -5.195
  135    HA   LYS  18           HA       LYS  18 -11.981   5.943  -6.821
  136    HB2  LYS  18           HB2      LYS  18 -10.175   4.176  -5.600
  137    HB3  LYS  18           HB3      LYS  18 -10.390   4.471  -7.297
  138    HG2  LYS  18           HG2      LYS  18  -8.536   6.071  -5.587
  139    HG3  LYS  18           HG3      LYS  18  -8.057   4.623  -6.463
  140    HD2  LYS  18           HD2      LYS  18  -8.984   7.247  -7.568
  141    HD3  LYS  18           HD3      LYS  18  -7.452   6.451  -7.811
  142    HE2  LYS  18           HE2      LYS  18 -10.083   5.750  -8.957
  143    HE3  LYS  18           HE3      LYS  18  -8.639   6.207  -9.814
  144    HZ1  LYS  18           HZ1      LYS  18  -9.088   3.829  -9.978
  145    HZ2  LYS  18           HZ2      LYS  18  -8.988   3.674  -8.298
  146    HZ3  LYS  18           HZ3      LYS  18  -7.623   4.126  -9.192
  147    H    ASN  19           H        ASN  19 -13.477   4.831  -5.713
  148    HA   ASN  19           HA       ASN  19 -13.441   5.120  -2.817
  149    HB2  ASN  19           HB2      ASN  19 -15.459   5.858  -3.749
  150    HB3  ASN  19           HB3      ASN  19 -15.570   4.475  -4.801
  151   HD21  ASN  19          HD21      ASN  19 -16.119   5.728  -1.641
  152   HD22  ASN  19          HD22      ASN  19 -17.061   4.372  -1.037
  153    H    ARG  20           H        ARG  20 -12.509   2.859  -5.086
  154    HA   ARG  20           HA       ARG  20 -13.012   0.630  -3.241
  155    HB2  ARG  20           HB2      ARG  20 -12.640   0.639  -6.215
  156    HB3  ARG  20           HB3      ARG  20 -12.649  -0.822  -5.269
  157    HG2  ARG  20           HG2      ARG  20 -14.884  -0.324  -4.499
  158    HG3  ARG  20           HG3      ARG  20 -14.885   1.130  -5.484
  159    HD2  ARG  20           HD2      ARG  20 -14.474  -0.230  -7.399
  160    HD3  ARG  20           HD3      ARG  20 -14.492  -1.675  -6.443
  161    HE   ARG  20           HE       ARG  20 -16.882  -0.762  -5.856
  162   HH11  ARG  20          HH11      ARG  20 -15.332  -0.838  -8.995
  163   HH12  ARG  20          HH12      ARG  20 -16.823  -1.010  -9.862
  164   HH21  ARG  20          HH21      ARG  20 -18.841  -0.980  -7.003
  165   HH22  ARG  20          HH22      ARG  20 -18.818  -1.085  -8.733
  166    H    GLY  21           H        GLY  21 -11.421  -0.351  -2.312
  167    HA2  GLY  21           HA2      GLY  21  -8.927  -1.068  -2.841
  168    HA3  GLY  21           HA3      GLY  21  -8.708   0.664  -2.671
  169    H    ILE  22           H        ILE  22  -7.379   0.059  -0.576
  170    HA   ILE  22           HA       ILE  22  -9.342  -0.466   1.554
  171    HB   ILE  22           HB       ILE  22  -7.866  -1.736   2.765
  172   HG12  ILE  22          HG12      ILE  22  -5.642  -0.477   1.199
  173   HG13  ILE  22          HG13      ILE  22  -6.137  -0.021   2.796
  174   HG21  ILE  22          HG21      ILE  22  -8.301  -3.120   0.918
  175   HG22  ILE  22          HG22      ILE  22  -6.547  -3.213   1.136
  176   HG23  ILE  22          HG23      ILE  22  -7.226  -2.195  -0.132
  177   HD11  ILE  22          HD11      ILE  22  -5.048  -2.703   2.039
  178   HD12  ILE  22          HD12      ILE  22  -5.443  -2.143   3.666
  179   HD13  ILE  22          HD13      ILE  22  -4.121  -1.396   2.772
  180    H    HIS  23           H        HIS  23  -7.976   0.211   3.712
  181    HA   HIS  23           HA       HIS  23  -6.946   2.876   3.391
  182    HB2  HIS  23           HB2      HIS  23  -8.677   3.959   4.779
  183    HB3  HIS  23           HB3      HIS  23  -9.330   3.345   3.281
  184    HD1  HIS  23           HD1      HIS  23  -9.765   3.223   6.915
  185    HD2  HIS  23           HD2      HIS  23 -10.892   1.001   3.618
  186    HE1  HIS  23           HE1      HIS  23 -11.643   1.752   7.715
  187    HE2  HIS  23           HE2      HIS  23 -12.195   0.289   5.738
  188    H    LEU  24           H        LEU  24  -5.217   2.804   4.651
  189    HA   LEU  24           HA       LEU  24  -5.422   1.701   7.333
  190    HB2  LEU  24           HB2      LEU  24  -2.974   2.731   5.909
  191    HB3  LEU  24           HB3      LEU  24  -3.057   1.734   7.304
  192    HG   LEU  24           HG       LEU  24  -3.973   0.756   4.631
  193   HD11  LEU  24          HD11      LEU  24  -1.662   1.329   4.386
  194   HD12  LEU  24          HD12      LEU  24  -1.779  -0.421   4.562
  195   HD13  LEU  24          HD13      LEU  24  -1.259   0.569   5.925
  196   HD21  LEU  24          HD21      LEU  24  -3.704  -1.436   5.638
  197   HD22  LEU  24          HD22      LEU  24  -4.800  -0.453   6.611
  198   HD23  LEU  24          HD23      LEU  24  -3.131  -0.700   7.134
  199    H    TYR  25           H        TYR  25  -4.964   3.135   9.084
  200    HA   TYR  25           HA       TYR  25  -4.852   5.143  10.161
  201    HB2  TYR  25           HB2      TYR  25  -3.454   6.131   7.698
  202    HB3  TYR  25           HB3      TYR  25  -3.379   6.863   9.282
  203    HD1  TYR  25           HD1      TYR  25  -3.196   3.231   9.035
  204    HD2  TYR  25           HD2      TYR  25  -0.845   6.788   9.138
  205    HE1  TYR  25           HE1      TYR  25  -1.218   1.897   9.492
  206    HE2  TYR  25           HE2      TYR  25   1.164   5.440   9.610
  207    HH   TYR  25           HH       TYR  25   1.674   3.230  10.615
  208    H    THR  26           H        THR  26  -4.823   7.469   7.842
  209    HA   THR  26           HA       THR  26  -7.752   7.489   7.625
  210    HB   THR  26           HB       THR  26  -7.157   9.416   8.799
  211    HG1  THR  26           HG1      THR  26  -7.157  11.092   6.851
  212   HG21  THR  26          HG21      THR  26  -4.948   9.901   6.811
  213   HG22  THR  26          HG22      THR  26  -4.753   9.241   8.436
  214   HG23  THR  26          HG23      THR  26  -5.325  10.898   8.217
  215    H    LYS  27           H        LYS  27  -5.311   6.410   5.886
  216    HA   LYS  27           HA       LYS  27  -5.647   7.987   3.448
  217    HB2  LYS  27           HB2      LYS  27  -3.843   5.787   3.138
  218    HB3  LYS  27           HB3      LYS  27  -3.506   7.510   3.091
  219    HG2  LYS  27           HG2      LYS  27  -3.741   5.894   5.596
  220    HG3  LYS  27           HG3      LYS  27  -2.232   6.263   4.792
  221    HD2  LYS  27           HD2      LYS  27  -4.176   8.202   5.994
  222    HD3  LYS  27           HD3      LYS  27  -2.558   7.833   6.565
  223    HE2  LYS  27           HE2      LYS  27  -1.994   8.571   4.047
  224    HE3  LYS  27           HE3      LYS  27  -3.460   9.501   4.308
  225    HZ1  LYS  27           HZ1      LYS  27  -2.496  10.551   6.208
  226    HZ2  LYS  27           HZ2      LYS  27  -1.437  10.740   4.907
  227    HZ3  LYS  27           HZ3      LYS  27  -1.105   9.601   6.108
  228    H    PHE  28           H        PHE  28  -5.081   6.526   1.477
  229    HA   PHE  28           HA       PHE  28  -6.721   4.137   1.340
  230    HB2  PHE  28           HB2      PHE  28  -8.297   5.936   0.956
  231    HB3  PHE  28           HB3      PHE  28  -7.256   6.630  -0.274
  232    HD1  PHE  28           HD1      PHE  28  -7.238   5.858  -2.483
  233    HD2  PHE  28           HD2      PHE  28  -9.424   3.719   0.477
  234    HE1  PHE  28           HE1      PHE  28  -8.280   4.505  -4.238
  235    HE2  PHE  28           HE2      PHE  28 -10.472   2.359  -1.286
  236    HZ   PHE  28           HZ       PHE  28  -9.888   2.742  -3.654
  237    H    ILE  29           H        ILE  29  -5.346   2.724   0.363
  238    HA   ILE  29           HA       ILE  29  -4.006   3.611  -2.093
  239    HB   ILE  29           HB       ILE  29  -4.011   0.872  -0.791
  240   HG12  ILE  29          HG12      ILE  29  -1.448   1.546  -0.617
  241   HG13  ILE  29          HG13      ILE  29  -2.106   3.173  -0.625
  242   HG21  ILE  29          HG21      ILE  29  -3.760   0.724  -3.203
  243   HG22  ILE  29          HG22      ILE  29  -2.254   0.297  -2.390
  244   HG23  ILE  29          HG23      ILE  29  -2.426   1.878  -3.147
  245   HD11  ILE  29          HD11      ILE  29  -1.720   2.217   1.638
  246   HD12  ILE  29          HD12      ILE  29  -2.976   1.028   1.298
  247   HD13  ILE  29          HD13      ILE  29  -3.378   2.745   1.350
  248    H    CYS  30           H        CYS  30  -4.910   3.118  -4.109
  249    HA   CYS  30           HA       CYS  30  -7.587   2.072  -4.116
  250    HB2  CYS  30           HB2      CYS  30  -7.698   2.589  -6.364
  251    HB3  CYS  30           HB3      CYS  30  -6.519   3.742  -5.800
  252    H    LEU  31           H        LEU  31  -8.280   0.212  -5.110
  253    HA   LEU  31           HA       LEU  31  -7.109  -1.991  -3.996
  254    HB2  LEU  31           HB2      LEU  31  -8.878  -3.155  -4.901
  255    HB3  LEU  31           HB3      LEU  31  -9.494  -1.555  -4.687
  256    HG   LEU  31           HG       LEU  31  -8.782  -1.310  -7.225
  257   HD11  LEU  31          HD11      LEU  31  -7.819  -3.539  -7.437
  258   HD12  LEU  31          HD12      LEU  31  -9.231  -3.361  -8.479
  259   HD13  LEU  31          HD13      LEU  31  -9.360  -4.260  -6.969
  260   HD21  LEU  31          HD21      LEU  31 -11.008  -0.938  -6.397
  261   HD22  LEU  31          HD22      LEU  31 -11.280  -2.674  -6.242
  262   HD23  LEU  31          HD23      LEU  31 -11.084  -1.950  -7.839
  263    H    ASP  32           H        ASP  32  -6.336  -0.506  -6.914
  264    HA   ASP  32           HA       ASP  32  -5.455  -2.864  -8.336
  265    HB2  ASP  32           HB2      ASP  32  -6.341  -0.598  -9.284
  266    HB3  ASP  32           HB3      ASP  32  -4.692  -0.087  -9.039
  267    H    CYS  33           H        CYS  33  -4.185  -0.183  -6.608
  268    HA   CYS  33           HA       CYS  33  -1.438  -0.838  -6.875
  269    HB2  CYS  33           HB2      CYS  33  -2.851   1.121  -5.100
  270    HB3  CYS  33           HB3      CYS  33  -1.126   0.867  -5.075
  271    H    GLU  34           H        GLU  34  -3.989  -1.443  -4.648
  272    HA   GLU  34           HA       GLU  34  -2.549  -2.212  -2.426
  273    HB2  GLU  34           HB2      GLU  34  -5.160  -1.979  -3.013
  274    HB3  GLU  34           HB3      GLU  34  -5.023  -3.722  -3.023
  275    HG2  GLU  34           HG2      GLU  34  -5.635  -3.185  -0.851
  276    HG3  GLU  34           HG3      GLU  34  -3.915  -3.424  -0.757
  277    H    ARG  35           H        ARG  35  -3.571  -4.084  -5.234
  278    HA   ARG  35           HA       ARG  35  -2.238  -6.413  -4.261
  279    HB2  ARG  35           HB2      ARG  35  -2.674  -7.392  -6.507
  280    HB3  ARG  35           HB3      ARG  35  -4.111  -6.826  -5.675
  281    HG2  ARG  35           HG2      ARG  35  -4.009  -4.766  -7.038
  282    HG3  ARG  35           HG3      ARG  35  -2.675  -5.472  -7.936
  283    HD2  ARG  35           HD2      ARG  35  -4.780  -5.771  -9.110
  284    HD3  ARG  35           HD3      ARG  35  -4.117  -7.307  -8.581
  285    HE   ARG  35           HE       ARG  35  -5.797  -6.645  -6.568
  286   HH11  ARG  35          HH11      ARG  35  -6.181  -6.938 -10.029
  287   HH12  ARG  35          HH12      ARG  35  -7.857  -7.366  -9.939
  288   HH21  ARG  35          HH21      ARG  35  -8.012  -7.215  -6.439
  289   HH22  ARG  35          HH22      ARG  35  -8.902  -7.514  -7.897
  290    H    LYS  36           H        LYS  36  -1.267  -3.673  -6.031
  291    HA   LYS  36           HA       LYS  36   0.838  -4.751  -7.561
  292    HB2  LYS  36           HB2      LYS  36   0.577  -2.026  -6.395
  293    HB3  LYS  36           HB3      LYS  36   1.748  -2.484  -7.601
  294    HG2  LYS  36           HG2      LYS  36  -0.179  -2.983  -9.092
  295    HG3  LYS  36           HG3      LYS  36  -1.224  -2.308  -7.901
  296    HD2  LYS  36           HD2      LYS  36  -0.028  -0.261  -8.091
  297    HD3  LYS  36           HD3      LYS  36   1.053  -0.934  -9.279
  298    HE2  LYS  36           HE2      LYS  36  -1.926  -0.581  -9.560
  299    HE3  LYS  36           HE3      LYS  36  -0.690   0.419 -10.313
  300    HZ1  LYS  36           HZ1      LYS  36  -1.557  -1.223 -11.844
  301    HZ2  LYS  36           HZ2      LYS  36  -1.093  -2.473 -10.809
  302    HZ3  LYS  36           HZ3      LYS  36   0.082  -1.504 -11.539
  303    H    VAL  37           H        VAL  37   0.496  -3.413  -4.413
  304    HA   VAL  37           HA       VAL  37   3.145  -3.249  -3.676
  305    HB   VAL  37           HB       VAL  37   2.381  -3.169  -1.398
  306   HG11  VAL  37          HG11      VAL  37   0.328  -1.718  -3.045
  307   HG12  VAL  37          HG12      VAL  37   2.018  -1.208  -2.962
  308   HG13  VAL  37          HG13      VAL  37   1.029  -1.219  -1.503
  309   HG21  VAL  37          HG21      VAL  37  -0.168  -3.296  -1.065
  310   HG22  VAL  37          HG22      VAL  37   0.824  -4.753  -1.036
  311   HG23  VAL  37          HG23      VAL  37  -0.104  -4.346  -2.492
  312    H    ILE  38           H        ILE  38   0.839  -5.802  -3.142
  313    HA   ILE  38           HA       ILE  38   2.366  -7.544  -1.584
  314    HB   ILE  38           HB       ILE  38   0.351  -8.507  -3.591
  315   HG12  ILE  38          HG12      ILE  38  -0.146  -6.901  -1.119
  316   HG13  ILE  38          HG13      ILE  38  -0.805  -6.668  -2.718
  317   HG21  ILE  38          HG21      ILE  38   1.136  -9.402  -0.841
  318   HG22  ILE  38          HG22      ILE  38   1.405 -10.242  -2.364
  319   HG23  ILE  38          HG23      ILE  38  -0.231 -10.061  -1.732
  320   HD11  ILE  38          HD11      ILE  38  -1.491  -9.107  -1.143
  321   HD12  ILE  38          HD12      ILE  38  -2.373  -8.349  -2.467
  322   HD13  ILE  38          HD13      ILE  38  -2.335  -7.584  -0.878
  323    H    SER  39           H        SER  39   2.049  -6.939  -4.940
  324    HA   SER  39           HA       SER  39   3.382  -9.245  -5.803
  325    HB2  SER  39           HB2      SER  39   2.779  -6.674  -7.258
  326    HB3  SER  39           HB3      SER  39   3.226  -8.196  -7.997
  327    HG   SER  39           HG       SER  39   0.892  -7.681  -6.480
  328    H    THR  40           H        THR  40   4.256  -5.942  -5.143
  329    HA   THR  40           HA       THR  40   6.892  -6.122  -6.279
  330    HB   THR  40           HB       THR  40   5.653  -3.984  -4.543
  331    HG1  THR  40           HG1      THR  40   4.461  -4.238  -6.446
  332   HG21  THR  40          HG21      THR  40   7.328  -2.502  -5.509
  333   HG22  THR  40          HG22      THR  40   8.021  -3.852  -6.410
  334   HG23  THR  40          HG23      THR  40   8.094  -3.835  -4.647
  335    H    SER  41           H        SER  41   5.474  -6.209  -3.048
  336    HA   SER  41           HA       SER  41   7.879  -5.873  -1.603
  337    HB2  SER  41           HB2      SER  41   6.517  -6.734   0.338
  338    HB3  SER  41           HB3      SER  41   5.823  -5.354  -0.512
  339    HG   SER  41           HG       SER  41   4.218  -6.556  -1.194
  340    H    THR  42           H        THR  42   6.854  -8.498  -3.398
  341    HA   THR  42           HA       THR  42   7.616 -10.654  -1.722
  342    HB   THR  42           HB       THR  42   7.632 -11.980  -3.844
  343    HG1  THR  42           HG1      THR  42   6.569  -9.862  -5.296
  344   HG21  THR  42          HG21      THR  42   5.244 -11.710  -4.321
  345   HG22  THR  42          HG22      THR  42   5.248 -10.167  -3.463
  346   HG23  THR  42          HG23      THR  42   5.560 -11.666  -2.586
  347    H    SER  43           H        SER  43   9.388  -8.439  -3.673
  348    HA   SER  43           HA       SER  43  11.848  -9.807  -2.927
  349    HB2  SER  43           HB2      SER  43  11.251  -8.907  -5.755
  350    HB3  SER  43           HB3      SER  43  12.788  -9.557  -5.185
  351    HG   SER  43           HG       SER  43  10.870 -11.253  -4.479
  352    H    ASP  44           H        ASP  44  13.015  -8.378  -1.858
  353    HA   ASP  44           HA       ASP  44  13.577  -5.829  -3.057
  354    HB2  ASP  44           HB2      ASP  44  11.545  -5.314  -1.731
  355    HB3  ASP  44           HB3      ASP  44  12.387  -5.821  -0.276
  356    HA   PRO  45           HA       PRO  45  16.811  -6.704   0.304
  357    HB2  PRO  45           HB2      PRO  45  16.114  -9.015   1.885
  358    HB3  PRO  45           HB3      PRO  45  16.265  -7.354   2.421
  359    HG2  PRO  45           HG2      PRO  45  13.950  -8.657   2.403
  360    HG3  PRO  45           HG3      PRO  45  14.056  -6.912   2.190
  361    HD2  PRO  45           HD2      PRO  45  13.778  -9.050   0.093
  362    HD3  PRO  45           HD3      PRO  45  12.880  -7.529   0.253
  363    H    ASP  46           H        ASP  46  18.592  -8.283   0.560
  364    HA   ASP  46           HA       ASP  46  18.315 -10.773  -0.925
  365    HB2  ASP  46           HB2      ASP  46  18.965  -9.204  -2.671
  366    HB3  ASP  46           HB3      ASP  46  20.320  -8.642  -1.696
  367    H    TYR  47           H        TYR  47  20.607  -8.615   0.736
  368    HA   TYR  47           HA       TYR  47  21.679 -10.974   2.085
  369    HB2  TYR  47           HB2      TYR  47  23.893  -9.755   2.099
  370    HB3  TYR  47           HB3      TYR  47  23.375 -10.373   0.539
  371    HD1  TYR  47           HD1      TYR  47  22.981  -8.908  -1.287
  372    HD2  TYR  47           HD2      TYR  47  23.732  -7.322   2.581
  373    HE1  TYR  47           HE1      TYR  47  23.273  -6.670  -2.270
  374    HE2  TYR  47           HE2      TYR  47  24.024  -5.081   1.616
  375    HH   TYR  47           HH       TYR  47  23.200  -4.365  -1.649
  376    H    ALA  48           H        ALA  48  22.497 -10.599   4.182
  377    HA   ALA  48           HA       ALA  48  21.798  -8.065   5.448
  378    HB1  ALA  48           HB1      ALA  48  20.786 -10.728   6.443
  379    HB2  ALA  48           HB2      ALA  48  19.808  -9.467   5.695
  380    HB3  ALA  48           HB3      ALA  48  20.582  -9.176   7.253
  381    H1   SER   0           H1       SER   0  -1.165  11.546  -3.290
  382    H2   SER   0           H2       SER   0  -1.466  11.450  -1.616
  383    H3   SER   0           H3       SER   0  -0.026  12.155  -2.181
  384    HA   SER   0           HA       SER   0  -2.776  13.191  -2.556
  385    HB2  SER   0           HB2      SER   0  -1.689  13.430  -0.272
  386    HB3  SER   0           HB3      SER   0  -0.461  14.427  -1.050
  387    HG   SER   0           HG       SER   0  -3.097  15.000  -0.423
  388    H    MET   1           H        MET   1   0.696  13.926  -2.932
  389    HA   MET   1           HA       MET   1   0.337  14.742  -5.643
  390    HB2  MET   1           HB2      MET   1  -0.502  16.772  -4.516
  391    HB3  MET   1           HB3      MET   1   1.012  16.901  -3.631
  392    HG2  MET   1           HG2      MET   1   2.219  17.226  -5.719
  393    HG3  MET   1           HG3      MET   1   0.714  17.066  -6.622
  394    HE1  MET   1           HE1      MET   1   1.594  20.872  -6.980
  395    HE2  MET   1           HE2      MET   1   1.268  19.366  -7.837
  396    HE3  MET   1           HE3      MET   1   2.747  19.541  -6.892
  397    H    ASP   2           H        ASP   2   2.539  15.713  -3.004
  398    HA   ASP   2           HA       ASP   2   4.665  14.284  -4.443
  399    HB2  ASP   2           HB2      ASP   2   6.288  15.867  -3.576
  400    HB3  ASP   2           HB3      ASP   2   5.021  16.734  -4.429
  401    H    GLU   3           H        GLU   3   5.346  12.549  -3.469
  402    HA   GLU   3           HA       GLU   3   4.943  12.283  -0.567
  403    HB2  GLU   3           HB2      GLU   3   5.240  10.044  -2.536
  404    HB3  GLU   3           HB3      GLU   3   4.693   9.950  -0.868
  405    HG2  GLU   3           HG2      GLU   3   3.236  11.188  -3.185
  406    HG3  GLU   3           HG3      GLU   3   2.850   9.710  -2.338
  407    H    THR   4           H        THR   4   7.262  13.406  -2.160
  408    HA   THR   4           HA       THR   4   9.346  11.446  -1.453
  409    HB   THR   4           HB       THR   4  10.628  12.396  -3.413
  410    HG1  THR   4           HG1      THR   4   9.289  14.301  -3.646
  411   HG21  THR   4          HG21      THR   4   9.395  11.076  -5.087
  412   HG22  THR   4          HG22      THR   4   8.017  10.992  -3.988
  413   HG23  THR   4          HG23      THR   4   9.543  10.223  -3.551
  414    H    VAL   5           H        VAL   5  10.937  12.164  -0.165
  415    HA   VAL   5           HA       VAL   5  11.563  15.033  -0.173
  416    HB   VAL   5           HB       VAL   5  12.011  14.951   2.257
  417   HG11  VAL   5          HG11      VAL   5   9.181  14.261   1.474
  418   HG12  VAL   5          HG12      VAL   5   9.906  15.867   1.442
  419   HG13  VAL   5          HG13      VAL   5   9.673  15.036   2.980
  420   HG21  VAL   5          HG21      VAL   5  10.622  12.287   2.122
  421   HG22  VAL   5          HG22      VAL   5  11.146  13.121   3.585
  422   HG23  VAL   5          HG23      VAL   5  12.340  12.535   2.428
  423    H    LYS   6           H        LYS   6  12.663  12.227  -1.053
  424    HA   LYS   6           HA       LYS   6  14.693  11.436  -1.635
  425    HB2  LYS   6           HB2      LYS   6  15.514  14.123  -0.663
  426    HB3  LYS   6           HB3      LYS   6  16.738  12.939  -1.063
  427    HG2  LYS   6           HG2      LYS   6  16.325  14.444  -2.917
  428    HG3  LYS   6           HG3      LYS   6  15.852  12.801  -3.317
  429    HD2  LYS   6           HD2      LYS   6  13.526  13.338  -2.977
  430    HD3  LYS   6           HD3      LYS   6  13.947  14.951  -2.416
  431    HE2  LYS   6           HE2      LYS   6  13.160  15.017  -4.707
  432    HE3  LYS   6           HE3      LYS   6  14.858  15.461  -4.616
  433    HZ1  LYS   6           HZ1      LYS   6  15.456  13.246  -5.350
  434    HZ2  LYS   6           HZ2      LYS   6  14.421  13.974  -6.469
  435    HZ3  LYS   6           HZ3      LYS   6  13.826  12.796  -5.414
  436    H    LEU   7           H        LEU   7  16.705  10.533  -0.764
  437    HA   LEU   7           HA       LEU   7  17.749   9.166   0.688
  438    HB2  LEU   7           HB2      LEU   7  18.325  11.148   1.909
  439    HB3  LEU   7           HB3      LEU   7  16.783  11.134   2.704
  440    HG   LEU   7           HG       LEU   7  17.406   8.986   3.799
  441   HD11  LEU   7          HD11      LEU   7  19.775   8.379   3.792
  442   HD12  LEU   7          HD12      LEU   7  20.078   9.636   2.591
  443   HD13  LEU   7          HD13      LEU   7  19.050   8.263   2.190
  444   HD21  LEU   7          HD21      LEU   7  19.228  11.336   4.310
  445   HD22  LEU   7          HD22      LEU   7  18.921  10.006   5.427
  446   HD23  LEU   7          HD23      LEU   7  17.615  11.105   4.985
  447    H    ASN   8           H        ASN   8  15.284   9.968   3.052
  448    HA   ASN   8           HA       ASN   8  14.315   7.191   2.947
  449    HB2  ASN   8           HB2      ASN   8  13.684   9.328   5.001
  450    HB3  ASN   8           HB3      ASN   8  13.318   7.623   5.116
  451   HD21  ASN   8          HD21      ASN   8  14.811   9.312   6.916
  452   HD22  ASN   8          HD22      ASN   8  16.367   8.585   7.059
  453    H    HIS   9           H        HIS   9  12.781   7.085   1.379
  454    HA   HIS   9           HA       HIS   9  11.050   9.078   0.520
  455    HB2  HIS   9           HB2      HIS   9  10.982   6.110   0.473
  456    HB3  HIS   9           HB3      HIS   9   9.472   6.943   0.171
  457    HD1  HIS   9           HD1      HIS   9  12.658   6.003  -1.421
  458    HD2  HIS   9           HD2      HIS   9   9.457   8.533  -2.201
  459    HE1  HIS   9           HE1      HIS   9  12.813   6.556  -3.867
  460    HE2  HIS   9           HE2      HIS   9  10.774   7.949  -4.348
  461    H    THR  10           H        THR  10   8.797   9.429   0.994
  462    HA   THR  10           HA       THR  10   8.338   9.129   3.863
  463    HB   THR  10           HB       THR  10   6.796  10.784   1.831
  464    HG1  THR  10           HG1      THR  10   9.199  11.177   2.977
  465   HG21  THR  10          HG21      THR  10   5.889  11.948   3.768
  466   HG22  THR  10          HG22      THR  10   6.812  10.903   4.849
  467   HG23  THR  10          HG23      THR  10   5.514  10.226   3.864
  468    H    CYS  11           H        CYS  11   6.805   7.833   4.689
  469    HA   CYS  11           HA       CYS  11   5.488   5.974   2.974
  470    HB2  CYS  11           HB2      CYS  11   6.039   5.339   5.294
  471    HB3  CYS  11           HB3      CYS  11   4.967   6.591   5.899
  472    H    VAL  12           H        VAL  12   3.884   6.517   1.715
  473    HA   VAL  12           HA       VAL  12   2.288   8.783   1.855
  474    HB   VAL  12           HB       VAL  12   0.714   7.573   0.398
  475   HG11  VAL  12          HG11      VAL  12   2.662   8.596  -0.610
  476   HG12  VAL  12          HG12      VAL  12   2.262   7.088  -1.438
  477   HG13  VAL  12          HG13      VAL  12   3.606   7.139  -0.296
  478   HG21  VAL  12          HG21      VAL  12   1.171   5.265  -0.264
  479   HG22  VAL  12          HG22      VAL  12   0.819   5.386   1.460
  480   HG23  VAL  12          HG23      VAL  12   2.483   5.195   0.910
  481    H    ILE  13           H        ILE  13   2.302   6.104   3.869
  482    HA   ILE  13           HA       ILE  13  -0.478   6.308   4.613
  483    HB   ILE  13           HB       ILE  13   1.496   4.415   5.794
  484   HG12  ILE  13          HG12      ILE  13   1.487   4.275   3.291
  485   HG13  ILE  13          HG13      ILE  13   1.006   2.811   4.129
  486   HG21  ILE  13          HG21      ILE  13  -1.483   4.258   5.439
  487   HG22  ILE  13          HG22      ILE  13  -0.641   4.645   6.940
  488   HG23  ILE  13          HG23      ILE  13  -0.463   3.046   6.213
  489   HD11  ILE  13          HD11      ILE  13  -0.357   3.336   2.169
  490   HD12  ILE  13          HD12      ILE  13  -0.904   4.797   2.992
  491   HD13  ILE  13          HD13      ILE  13  -1.276   3.212   3.670
  492    H    CYS  14           H        CYS  14   2.667   6.163   6.194
  493    HA   CYS  14           HA       CYS  14   1.605   7.050   8.714
  494    HB2  CYS  14           HB2      CYS  14   4.386   6.499   7.806
  495    HB3  CYS  14           HB3      CYS  14   3.978   6.874   9.453
  496    H    ASP  15           H        ASP  15   2.927   8.510   5.957
  497    HA   ASP  15           HA       ASP  15   3.715  10.532   5.378
  498    HB2  ASP  15           HB2      ASP  15   2.264  11.352   7.869
  499    HB3  ASP  15           HB3      ASP  15   2.962  12.471   6.714
  500    H    GLN  16           H        GLN  16   5.439   8.889   6.782
  501    HA   GLN  16           HA       GLN  16   7.180  10.810   8.152
  502    HB2  GLN  16           HB2      GLN  16   7.106   7.839   8.702
  503    HB3  GLN  16           HB3      GLN  16   7.999   9.060   9.580
  504    HG2  GLN  16           HG2      GLN  16   5.039   8.774   9.499
  505    HG3  GLN  16           HG3      GLN  16   6.078   8.303  10.823
  506   HE21  GLN  16          HE21      GLN  16   3.874  10.166  10.802
  507   HE22  GLN  16          HE22      GLN  16   4.524  11.670  11.335
  508    H    GLU  17           H        GLU  17   9.503  10.041   8.019
  509    HA   GLU  17           HA       GLU  17  10.017   9.385   5.233
  510    HB2  GLU  17           HB2      GLU  17  11.865  10.545   7.313
  511    HB3  GLU  17           HB3      GLU  17  12.225  10.343   5.605
  512    HG2  GLU  17           HG2      GLU  17  10.642  11.942   4.963
  513    HG3  GLU  17           HG3      GLU  17   9.902  11.947   6.556
  514    H    LYS  18           H        LYS  18  10.192   7.382   4.907
  515    HA   LYS  18           HA       LYS  18  12.020   5.752   6.529
  516    HB2  LYS  18           HB2      LYS  18  10.178   4.012   5.322
  517    HB3  LYS  18           HB3      LYS  18  10.407   4.309   7.018
  518    HG2  LYS  18           HG2      LYS  18   8.572   5.936   5.315
  519    HG3  LYS  18           HG3      LYS  18   8.072   4.497   6.196
  520    HD2  LYS  18           HD2      LYS  18   9.052   7.106   7.292
  521    HD3  LYS  18           HD3      LYS  18   7.506   6.341   7.541
  522    HE2  LYS  18           HE2      LYS  18  10.126   5.592   8.681
  523    HE3  LYS  18           HE3      LYS  18   8.693   6.078   9.542
  524    HZ1  LYS  18           HZ1      LYS  18   9.104   3.691   9.705
  525    HZ2  LYS  18           HZ2      LYS  18   8.989   3.538   8.027
  526    HZ3  LYS  18           HZ3      LYS  18   7.639   4.014   8.929
  527    H    ASN  19           H        ASN  19  13.489   4.604   5.419
  528    HA   ASN  19           HA       ASN  19  13.452   4.891   2.524
  529    HB2  ASN  19           HB2      ASN  19  15.486   5.593   3.449
  530    HB3  ASN  19           HB3      ASN  19  15.572   4.213   4.505
  531   HD21  ASN  19          HD21      ASN  19  16.126   5.446   1.339
  532   HD22  ASN  19          HD22      ASN  19  17.046   4.071   0.738
  533    H    ARG  20           H        ARG  20  12.487   2.648   4.805
  534    HA   ARG  20           HA       ARG  20  12.922   0.420   2.934
  535    HB2  ARG  20           HB2      ARG  20  12.547   0.333   5.909
  536    HB3  ARG  20           HB3      ARG  20  12.580  -1.075   4.885
  537    HG2  ARG  20           HG2      ARG  20  14.839  -0.563   4.212
  538    HG3  ARG  20           HG3      ARG  20  14.807   0.889   5.203
  539    HD2  ARG  20           HD2      ARG  20  14.465  -0.383   7.173
  540    HD3  ARG  20           HD3      ARG  20  14.341  -1.826   6.211
  541    HE   ARG  20           HE       ARG  20  16.781  -1.092   5.552
  542   HH11  ARG  20          HH11      ARG  20  15.264  -1.090   8.709
  543   HH12  ARG  20          HH12      ARG  20  16.759  -1.269   9.569
  544   HH21  ARG  20          HH21      ARG  20  18.754  -1.312   6.683
  545   HH22  ARG  20          HH22      ARG  20  18.745  -1.391   8.416
  546    H    GLY  21           H        GLY  21  11.327  -0.535   2.038
  547    HA2  GLY  21           HA2      GLY  21   8.828  -1.217   2.587
  548    HA3  GLY  21           HA3      GLY  21   8.639   0.515   2.423
  549    H    ILE  22           H        ILE  22   7.285  -0.063   0.322
  550    HA   ILE  22           HA       ILE  22   9.232  -0.629  -1.814
  551    HB   ILE  22           HB       ILE  22   7.728  -1.875  -3.018
  552   HG12  ILE  22          HG12      ILE  22   5.534  -0.572  -1.447
  553   HG13  ILE  22          HG13      ILE  22   6.031  -0.132  -3.046
  554   HG21  ILE  22          HG21      ILE  22   8.145  -3.262  -1.169
  555   HG22  ILE  22          HG22      ILE  22   6.390  -3.326  -1.381
  556   HG23  ILE  22          HG23      ILE  22   7.092  -2.317  -0.118
  557   HD11  ILE  22          HD11      ILE  22   4.897  -2.791  -2.276
  558   HD12  ILE  22          HD12      ILE  22   5.295  -2.243  -3.907
  559   HD13  ILE  22          HD13      ILE  22   3.991  -1.469  -3.010
  560    H    HIS  23           H        HIS  23   7.873   0.066  -3.969
  561    HA   HIS  23           HA       HIS  23   6.889   2.749  -3.651
  562    HB2  HIS  23           HB2      HIS  23   8.629   3.800  -5.051
  563    HB3  HIS  23           HB3      HIS  23   9.279   3.179  -3.554
  564    HD1  HIS  23           HD1      HIS  23   9.689   3.031  -7.194
  565    HD2  HIS  23           HD2      HIS  23  10.802   0.817  -3.890
  566    HE1  HIS  23           HE1      HIS  23  11.542   1.535  -7.995
  567    HE2  HIS  23           HE2      HIS  23  12.071   0.064  -6.020
  568    H    LEU  24           H        LEU  24   5.153   2.706  -4.903
  569    HA   LEU  24           HA       LEU  24   5.327   1.594  -7.585
  570    HB2  LEU  24           HB2      LEU  24   2.903   2.669  -6.152
  571    HB3  LEU  24           HB3      LEU  24   2.963   1.668  -7.545
  572    HG   LEU  24           HG       LEU  24   3.871   0.683  -4.874
  573   HD11  LEU  24          HD11      LEU  24   1.573   1.297  -4.622
  574   HD12  LEU  24          HD12      LEU  24   1.658  -0.456  -4.791
  575   HD13  LEU  24          HD13      LEU  24   1.151   0.539  -6.155
  576   HD21  LEU  24          HD21      LEU  24   3.565  -1.507  -5.875
  577   HD22  LEU  24          HD22      LEU  24   4.675  -0.545  -6.851
  578   HD23  LEU  24          HD23      LEU  24   3.003  -0.766  -7.374
  579    H    TYR  25           H        TYR  25   4.890   3.035  -9.338
  580    HA   TYR  25           HA       TYR  25   4.809   5.042 -10.416
  581    HB2  TYR  25           HB2      TYR  25   3.437   6.056  -7.949
  582    HB3  TYR  25           HB3      TYR  25   3.369   6.788  -9.533
  583    HD1  TYR  25           HD1      TYR  25   3.124   3.160  -9.274
  584    HD2  TYR  25           HD2      TYR  25   0.845   6.758  -9.389
  585    HE1  TYR  25           HE1      TYR  25   1.120   1.860  -9.722
  586    HE2  TYR  25           HE2      TYR  25  -1.190   5.446  -9.854
  587    HH   TYR  25           HH       TYR  25  -1.763   3.252 -10.830
  588    H    THR  26           H        THR  26   4.827   7.374  -8.108
  589    HA   THR  26           HA       THR  26   7.760   7.339  -7.898
  590    HB   THR  26           HB       THR  26   7.198   9.279  -9.065
  591    HG1  THR  26           HG1      THR  26   7.243  10.964  -7.158
  592   HG21  THR  26          HG21      THR  26   4.996   9.803  -7.078
  593   HG22  THR  26          HG22      THR  26   4.784   9.138  -8.699
  594   HG23  THR  26          HG23      THR  26   5.384  10.787  -8.489
  595    H    LYS  27           H        LYS  27   5.306   6.307  -6.147
  596    HA   LYS  27           HA       LYS  27   5.681   7.884  -3.715
  597    HB2  LYS  27           HB2      LYS  27   3.840   5.717  -3.391
  598    HB3  LYS  27           HB3      LYS  27   3.535   7.447  -3.349
  599    HG2  LYS  27           HG2      LYS  27   3.737   5.823  -5.849
  600    HG3  LYS  27           HG3      LYS  27   2.241   6.215  -5.044
  601    HD2  LYS  27           HD2      LYS  27   4.204   8.123  -6.253
  602    HD3  LYS  27           HD3      LYS  27   2.577   7.779  -6.815
  603    HE2  LYS  27           HE2      LYS  27   2.036   8.530  -4.297
  604    HE3  LYS  27           HE3      LYS  27   3.519   9.433  -4.563
  605    HZ1  LYS  27           HZ1      LYS  27   2.569  10.498  -6.464
  606    HZ2  LYS  27           HZ2      LYS  27   1.518  10.708  -5.160
  607    HZ3  LYS  27           HZ3      LYS  27   1.160   9.575  -6.357
  608    H    PHE  28           H        PHE  28   5.097   6.440  -1.735
  609    HA   PHE  28           HA       PHE  28   6.693   4.021  -1.602
  610    HB2  PHE  28           HB2      PHE  28   8.303   5.788  -1.229
  611    HB3  PHE  28           HB3      PHE  28   7.281   6.506   0.004
  612    HD1  PHE  28           HD1      PHE  28   7.259   5.739   2.215
  613    HD2  PHE  28           HD2      PHE  28   9.394   3.555  -0.750
  614    HE1  PHE  28           HE1      PHE  28   8.283   4.372   3.969
  615    HE2  PHE  28           HE2      PHE  28  10.425   2.180   1.011
  616    HZ   PHE  28           HZ       PHE  28   9.858   2.578   3.382
  617    H    ILE  29           H        ILE  29   5.287   2.636  -0.620
  618    HA   ILE  29           HA       ILE  29   3.984   3.549   1.844
  619    HB   ILE  29           HB       ILE  29   3.944   0.807   0.550
  620   HG12  ILE  29          HG12      ILE  29   1.403   1.521   0.386
  621   HG13  ILE  29          HG13      ILE  29   2.086   3.140   0.386
  622   HG21  ILE  29          HG21      ILE  29   3.694   0.671   2.963
  623   HG22  ILE  29          HG22      ILE  29   2.178   0.267   2.157
  624   HG23  ILE  29          HG23      ILE  29   2.382   1.849   2.908
  625   HD11  ILE  29          HD11      ILE  29   1.651   2.190  -1.861
  626   HD12  ILE  29          HD12      ILE  29   2.892   0.978  -1.537
  627   HD13  ILE  29          HD13      ILE  29   3.324   2.687  -1.597
  628    H    CYS  30           H        CYS  30   4.889   3.045   3.856
  629    HA   CYS  30           HA       CYS  30   7.548   1.952   3.856
  630    HB2  CYS  30           HB2      CYS  30   7.673   2.475   6.102
  631    HB3  CYS  30           HB3      CYS  30   6.511   3.646   5.539
  632    H    LEU  31           H        LEU  31   8.212   0.083   4.852
  633    HA   LEU  31           HA       LEU  31   6.996  -2.100   3.747
  634    HB2  LEU  31           HB2      LEU  31   8.746  -3.296   4.648
  635    HB3  LEU  31           HB3      LEU  31   9.391  -1.709   4.427
  636    HG   LEU  31           HG       LEU  31   8.696  -1.444   6.967
  637   HD11  LEU  31          HD11      LEU  31   7.692  -3.656   7.189
  638   HD12  LEU  31          HD12      LEU  31   9.111  -3.500   8.225
  639   HD13  LEU  31          HD13      LEU  31   9.217  -4.407   6.716
  640   HD21  LEU  31          HD21      LEU  31  10.923  -1.120   6.126
  641   HD22  LEU  31          HD22      LEU  31  11.161  -2.860   5.974
  642   HD23  LEU  31          HD23      LEU  31  10.986  -2.130   7.569
  643    H    ASP  32           H        ASP  32   6.260  -0.596   6.666
  644    HA   ASP  32           HA       ASP  32   5.347  -2.934   8.097
  645    HB2  ASP  32           HB2      ASP  32   6.280  -0.684   9.032
  646    HB3  ASP  32           HB3      ASP  32   4.640  -0.140   8.792
  647    H    CYS  33           H        CYS  33   4.112  -0.237   6.368
  648    HA   CYS  33           HA       CYS  33   1.351  -0.842   6.644
  649    HB2  CYS  33           HB2      CYS  33   2.797   1.088   4.860
  650    HB3  CYS  33           HB3      CYS  33   1.066   0.865   4.845
  651    H    GLU  34           H        GLU  34   3.888  -1.494   4.411
  652    HA   GLU  34           HA       GLU  34   2.426  -2.244   2.197
  653    HB2  GLU  34           HB2      GLU  34   5.041  -2.044   2.765
  654    HB3  GLU  34           HB3      GLU  34   4.890  -3.782   2.789
  655    HG2  GLU  34           HG2      GLU  34   5.487  -3.275   0.610
  656    HG3  GLU  34           HG3      GLU  34   3.763  -3.484   0.528
  657    H    ARG  35           H        ARG  35   3.427  -4.128   5.004
  658    HA   ARG  35           HA       ARG  35   2.047  -6.434   4.042
  659    HB2  ARG  35           HB2      ARG  35   2.476  -7.418   6.288
  660    HB3  ARG  35           HB3      ARG  35   3.921  -6.882   5.447
  661    HG2  ARG  35           HG2      ARG  35   3.862  -4.815   6.806
  662    HG3  ARG  35           HG3      ARG  35   2.520  -5.493   7.711
  663    HD2  ARG  35           HD2      ARG  35   4.622  -5.830   8.878
  664    HD3  ARG  35           HD3      ARG  35   3.931  -7.356   8.354
  665    HE   ARG  35           HE       ARG  35   5.617  -6.720   6.333
  666   HH11  ARG  35          HH11      ARG  35   6.008  -7.028   9.795
  667   HH12  ARG  35          HH12      ARG  35   7.675  -7.484   9.696
  668   HH21  ARG  35          HH21      ARG  35   7.810  -7.319   6.191
  669   HH22  ARG  35          HH22      ARG  35   8.707  -7.651   7.641
  670    H    LYS  36           H        LYS  36   1.133  -3.673   5.810
  671    HA   LYS  36           HA       LYS  36  -0.984  -4.710   7.353
  672    HB2  LYS  36           HB2      LYS  36  -0.681  -1.992   6.180
  673    HB3  LYS  36           HB3      LYS  36  -1.854  -2.425   7.391
  674    HG2  LYS  36           HG2      LYS  36   0.071  -2.956   8.874
  675    HG3  LYS  36           HG3      LYS  36   1.122  -2.302   7.677
  676    HD2  LYS  36           HD2      LYS  36  -0.035  -0.236   7.869
  677    HD3  LYS  36           HD3      LYS  36  -1.124  -0.886   9.062
  678    HE2  LYS  36           HE2      LYS  36   1.862  -0.590   9.331
  679    HE3  LYS  36           HE3      LYS  36   0.649   0.437  10.086
  680    HZ1  LYS  36           HZ1      LYS  36   1.493  -1.218  11.617
  681    HZ2  LYS  36           HZ2      LYS  36   0.997  -2.464  10.589
  682    HZ3  LYS  36           HZ3      LYS  36  -0.154  -1.466  11.325
  683    H    VAL  37           H        VAL  37  -0.632  -3.385   4.200
  684    HA   VAL  37           HA       VAL  37  -3.282  -3.176   3.474
  685    HB   VAL  37           HB       VAL  37  -2.527  -3.115   1.192
  686   HG11  VAL  37          HG11      VAL  37  -0.440  -1.697   2.826
  687   HG12  VAL  37          HG12      VAL  37  -2.122  -1.157   2.750
  688   HG13  VAL  37          HG13      VAL  37  -1.140  -1.188   1.286
  689   HG21  VAL  37          HG21      VAL  37   0.018  -3.290   0.847
  690   HG22  VAL  37          HG22      VAL  37  -0.999  -4.728   0.828
  691   HG23  VAL  37          HG23      VAL  37  -0.058  -4.333   2.278
  692    H    ILE  38           H        ILE  38  -1.024  -5.772   2.935
  693    HA   ILE  38           HA       ILE  38  -2.591  -7.490   1.389
  694    HB   ILE  38           HB       ILE  38  -0.584  -8.484   3.387
  695   HG12  ILE  38          HG12      ILE  38  -0.066  -6.893   0.911
  696   HG13  ILE  38          HG13      ILE  38   0.601  -6.669   2.507
  697   HG21  ILE  38          HG21      ILE  38  -1.393  -9.375   0.642
  698   HG22  ILE  38          HG22      ILE  38  -1.675 -10.204   2.169
  699   HG23  ILE  38          HG23      ILE  38  -0.037 -10.056   1.533
  700   HD11  ILE  38          HD11      ILE  38   1.239  -9.123   0.937
  701   HD12  ILE  38          HD12      ILE  38   2.139  -8.377   2.258
  702   HD13  ILE  38          HD13      ILE  38   2.109  -7.617   0.665
  703    H    SER  39           H        SER  39  -2.245  -6.882   4.742
  704    HA   SER  39           HA       SER  39  -3.616  -9.163   5.615
  705    HB2  SER  39           HB2      SER  39  -2.961  -6.601   7.062
  706    HB3  SER  39           HB3      SER  39  -3.432  -8.112   7.806
  707    HG   SER  39           HG       SER  39  -1.094  -7.645   6.276
  708    H    THR  40           H        THR  40  -4.433  -5.848   4.951
  709    HA   THR  40           HA       THR  40  -7.067  -5.973   6.101
  710    HB   THR  40           HB       THR  40  -5.796  -3.862   4.356
  711    HG1  THR  40           HG1      THR  40  -4.607  -4.138   6.261
  712   HG21  THR  40          HG21      THR  40  -7.444  -2.348   5.322
  713   HG22  THR  40          HG22      THR  40  -8.157  -3.684   6.227
  714   HG23  THR  40          HG23      THR  40  -8.236  -3.670   4.465
  715    H    SER  41           H        SER  41  -5.664  -6.098   2.863
  716    HA   SER  41           HA       SER  41  -8.070  -5.718   1.429
  717    HB2  SER  41           HB2      SER  41  -6.734  -6.606  -0.516
  718    HB3  SER  41           HB3      SER  41  -6.009  -5.239   0.328
  719    HG   SER  41           HG       SER  41  -4.426  -6.471   1.007
  720    H    THR  42           H        THR  42  -7.087  -8.360   3.226
  721    HA   THR  42           HA       THR  42  -7.895 -10.502   1.556
  722    HB   THR  42           HB       THR  42  -7.921 -11.830   3.674
  723    HG1  THR  42           HG1      THR  42  -6.826  -9.710   5.119
  724   HG21  THR  42          HG21      THR  42  -5.526 -11.598   4.143
  725   HG22  THR  42          HG22      THR  42  -5.508 -10.056   3.284
  726   HG23  THR  42          HG23      THR  42  -5.848 -11.552   2.410
  727    H    SER  43           H        SER  43  -9.614  -8.255   3.518
  728    HA   SER  43           HA       SER  43 -12.105  -9.576   2.777
  729    HB2  SER  43           HB2      SER  43 -11.482  -8.677   5.599
  730    HB3  SER  43           HB3      SER  43 -13.032  -9.302   5.036
  731    HG   SER  43           HG       SER  43 -11.140 -11.034   4.336
  732    H    ASP  44           H        ASP  44 -13.253  -8.129   1.710
  733    HA   ASP  44           HA       ASP  44 -13.760  -5.567   2.906
  734    HB2  ASP  44           HB2      ASP  44 -11.724  -5.095   1.569
  735    HB3  ASP  44           HB3      ASP  44 -12.582  -5.589   0.118
  736    HA   PRO  45           HA       PRO  45 -17.023  -6.394  -0.439
  737    HB2  PRO  45           HB2      PRO  45 -16.374  -8.717  -2.018
  738    HB3  PRO  45           HB3      PRO  45 -16.495  -7.055  -2.558
  739    HG2  PRO  45           HG2      PRO  45 -14.207  -8.403  -2.545
  740    HG3  PRO  45           HG3      PRO  45 -14.276  -6.656  -2.333
  741    HD2  PRO  45           HD2      PRO  45 -14.035  -8.798  -0.230
  742    HD3  PRO  45           HD3      PRO  45 -13.106  -7.294  -0.399
  743    H    ASP  46           H        ASP  46 -18.836  -7.936  -0.682
  744    HA   ASP  46           HA       ASP  46 -18.594 -10.431   0.801
  745    HB2  ASP  46           HB2      ASP  46 -19.205  -8.846   2.548
  746    HB3  ASP  46           HB3      ASP  46 -20.555  -8.262   1.579
  747    H    TYR  47           H        TYR  47 -20.858  -8.236  -0.848
  748    HA   TYR  47           HA       TYR  47 -21.978 -10.577  -2.188
  749    HB2  TYR  47           HB2      TYR  47 -24.167  -9.319  -2.195
  750    HB3  TYR  47           HB3      TYR  47 -23.655  -9.943  -0.635
  751    HD1  TYR  47           HD1      TYR  47 -23.226  -8.482   1.186
  752    HD2  TYR  47           HD2      TYR  47 -23.968  -6.889  -2.682
  753    HE1  TYR  47           HE1      TYR  47 -23.469  -6.238   2.165
  754    HE2  TYR  47           HE2      TYR  47 -24.214  -4.640  -1.719
  755    HH   TYR  47           HH       TYR  47 -23.364  -3.944   1.558
  756    H    ALA  48           H        ALA  48 -22.804 -10.191  -4.282
  757    HA   ALA  48           HA       ALA  48 -22.059  -7.676  -5.561
  758    HB1  ALA  48           HB1      ALA  48 -21.096 -10.359  -6.551
  759    HB2  ALA  48           HB2      ALA  48 -20.093  -9.114  -5.810
  760    HB3  ALA  48           HB3      ALA  48 -20.868  -8.812  -7.364