*HEADER    ANTIMICROBIAL PROTEIN                   08-JAN-19   6QES              
*TITLE     [1-40]GGA-AVBD11                                                      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: GALLINACIN-11;                                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: GAL-11,BETA-DEFENSIN 11,VITELLINE MEMBRANE OUTER LAYER      
*COMPND   5 PROTEIN 2,VITELLINE MEMBRANE OUTER LAYER PROTEIN II,VMOII;           
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                                  
*SOURCE   4 ORGANISM_COMMON: CHICKEN;                                            
*SOURCE   5 ORGANISM_TAXID: 9031                                                 
*KEYWDS    NEW FOLD, DOUBLE-BETA-DEFENSIN, DEFENSIN, AVIAN EGG, ANTIMICROBIAL    
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    H.MEUDAL,K.LOTH,A.F.DELMAS,C.LANDON                                   
*REVDAT   1   18-DEC-19 6QES    0                                                
# Restraints file 1: 1_3.tbl
 assi 
   (( segid "   A" and resid 16   and name  HN  ))
   (( segid "   A" and resid 37   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 14   and name  HN  ))
   (( segid "   A" and resid 39   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 39   and name  HN  ))
   (( segid "   A" and resid 14   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 37   and name  HN  ))
   (( segid "   A" and resid 16   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 38   and name  HN  ))
   (( segid "   A" and resid 28   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 28   and name  HN  ))
   (( segid "   A" and resid 38   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 38   and name  N   ))
   (( segid "   A" and resid 28   and name  O   ))
      3.200     0.684     0.727

 assi 
   (( segid "   A" and resid 37   and name  N   ))
   (( segid "   A" and resid 16   and name  O   ))
      3.200     0.684     0.727

 assi 
   (( segid "   A" and resid 28   and name  N   ))
   (( segid "   A" and resid 38   and name  O   ))
      3.200     0.684     0.727

 assi 
   (( segid "   A" and resid 16   and name  N   ))
   (( segid "   A" and resid 37   and name  O   ))
      3.200     0.684     0.727

 assi 
   (( segid "   A" and resid 39   and name  N   ))
   (( segid "   A" and resid 14   and name  O   ))
      3.200     0.684     0.727

 assi 
   (( segid "   A" and resid 14   and name  N   ))
   (( segid "   A" and resid 39   and name  O   ))
      3.200     0.684     0.727

 assi 
   (( segid "   A" and resid 40   and name  HN  ))
   (( segid "   A" and resid 26   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 26   and name  HN  ))
   (( segid "   A" and resid 40   and name  OT1 ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 26   and name  O   ))
   (( segid "   A" and resid 40   and name  N   ))
      3.200     0.684     0.727

 assi 
   (( segid "   A" and resid 26   and name  N   ))
   (( segid "   A" and resid 40   and name  OT1 ))
      3.200     0.684     0.727

# Restraints file 2: disu.tbl
assign (segid "   A" and resid 8 and name SG) (segid "   A" and not resid 8 and name SG) 2.02 0.1 0.1
assign (segid "   A" and resid 15 and name SG) (segid "   A" and not resid 15 and name SG) 2.02 0.1 0.1
assign (segid "   A" and resid 21 and name SG) (segid "   A" and not resid 21 and name SG) 2.02 0.1 0.1
assign (segid "   A" and resid 31 and name SG) (segid "   A" and not resid 31 and name SG) 2.02 0.1 0.1
assign (segid "   A" and resid 38 and name SG) (segid "   A" and not resid 38 and name SG) 2.02 0.1 0.1
assign (segid "   A" and resid 39 and name SG) (segid "   A" and not resid 39 and name SG) 2.02 0.1 0.1

# Restraints file 3: 1_1.tbl
 ASSIGN  (segid "   A" and resid 2    and name C   ) (segid "   A" and resid 3    and name N   )
         (segid "   A" and resid 3    and name CA  ) (segid "   A" and resid 3    and name C   )  1.00 -77.92 82.08 2

 ASSIGN  (segid "   A" and resid 3    and name C   ) (segid "   A" and resid 4    and name N   )
         (segid "   A" and resid 4    and name CA  ) (segid "   A" and resid 4    and name C   )  1.00 -71.33 58.67 2

 ASSIGN  (segid "   A" and resid 4    and name N   ) (segid "   A" and resid 4    and name CA  )
         (segid "   A" and resid 4    and name C   ) (segid "   A" and resid 5    and name N   )  1.00 -14.08 35.92 2

 ASSIGN  (segid "   A" and resid 4    and name C   ) (segid "   A" and resid 5    and name N   )
         (segid "   A" and resid 5    and name CA  ) (segid "   A" and resid 5    and name C   )  1.00 -63.12 36.88 2

 ASSIGN  (segid "   A" and resid 5    and name N   ) (segid "   A" and resid 5    and name CA  )
         (segid "   A" and resid 5    and name C   ) (segid "   A" and resid 6    and name N   )  1.00 -36.37 33.63 2

 ASSIGN  (segid "   A" and resid 6    and name C   ) (segid "   A" and resid 7    and name N   )
         (segid "   A" and resid 7    and name CA  ) (segid "   A" and resid 7    and name C   )  1.00 -67.67 42.33 2

 ASSIGN  (segid "   A" and resid 7    and name N   ) (segid "   A" and resid 7    and name CA  )
         (segid "   A" and resid 7    and name C   ) (segid "   A" and resid 8    and name N   )  1.00 -24.75 25.25 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 -76.68 43.32 2

 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  -5.81 34.19 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 -78.29 51.71 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 -11.37 28.63 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 -92.09 87.91 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 -154.49 25.51 2

 ASSIGN  (segid "   A" and resid 12   and name N   ) (segid "   A" and resid 12   and name CA  )
         (segid "   A" and resid 12   and name C   ) (segid "   A" and resid 13   and name N   )  1.00 155.61 45.61 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 -129.18 50.82 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   )  1.00 151.15 51.15 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 -109.37 70.63 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   )  1.00 142.58 52.58 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 -123.03 36.97 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   )  1.00 146.00 46.00 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 -119.57 60.43 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   )  1.00 126.93 36.93 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 -145.02 34.98 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   )  1.00 151.54 41.54 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 -133.59 46.41 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 -120.81 29.19 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   )  1.00 137.45 37.45 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 -108.47 41.53 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   )  1.00 128.61 38.61 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 -74.88 35.12 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   )  1.00 155.04 35.04 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 -115.34 54.66 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   )  1.00 138.08 48.08 2

 ASSIGN  (segid "   A" and resid 23   and name C   ) (segid "   A" and resid 24   and name N   )
         (segid "   A" and resid 24   and name CA  ) (segid "   A" and resid 24   and name C   )  1.00 -65.03 24.97 2

 ASSIGN  (segid "   A" and resid 24   and name N   ) (segid "   A" and resid 24   and name CA  )
         (segid "   A" and resid 24   and name C   ) (segid "   A" and resid 25   and name N   )  1.00 145.00 25.00 2

 ASSIGN  (segid "   A" and resid 24   and name C   ) (segid "   A" and resid 25   and name N   )
         (segid "   A" and resid 25   and name CA  ) (segid "   A" and resid 25   and name C   )  1.00 -105.25 64.75 2

 ASSIGN  (segid "   A" and resid 25   and name N   ) (segid "   A" and resid 25   and name CA  )
         (segid "   A" and resid 25   and name C   ) (segid "   A" and resid 26   and name N   )  1.00 130.47 40.47 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 -121.41 38.59 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   )  1.00 136.73 36.73 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 -104.20 35.80 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   )  1.00 122.65 32.65 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 -105.97 44.03 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   )  1.00 135.54 45.54 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 -141.02 38.98 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   )  1.00 154.21 44.21 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 -134.68 45.32 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   )  1.00 156.46 36.46 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 -67.32 42.68 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   )  1.00 145.52 35.52 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 -78.66 51.34 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 -12.57 37.43 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 -102.82 77.18 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   )  1.00 144.38 54.38 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 -73.57 26.43 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   )  1.00 136.50 36.50 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 -72.93 47.07 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   )  1.00 140.07 40.07 2

# Restraints file 4: ambig.tbl
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name   HA) 2.090 0.546 0.546 weight 1.000 ! spec=Noesy, no=25, id=24, vol=1.548863e+07
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name   HA)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB1) 2.376 0.706 0.706 weight 1.000 ! spec=Noesy, no=44, id=43, vol=8.591284e+06
    or (segid "   A" and resid   33 and name  HZ2) (segid "   A" and resid    2 and name   HA)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    5 and name   HA) 2.255 0.636 0.636 weight 1.000 ! spec=Noesy, no=48, id=47, vol=1.007931e+07
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name   HA)
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid    5 and name   HA)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HB2) 2.187 0.598 0.598 weight 1.000 ! spec=Noesy, no=50, id=49, vol=1.015822e+07
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HB1)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HB1) 2.686 0.902 0.902 weight 1.000 ! spec=Noesy, no=51, id=50, vol=4.099956e+06
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HB2)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HA2) 2.430 0.738 0.738 weight 1.000 ! spec=Noesy, no=52, id=51, vol=8.071652e+06
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HA1)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HB2) 2.418 0.731 0.731 weight 1.000 ! spec=Noesy, no=55, id=54, vol=9.609148e+06
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name   HA)
assign (segid "   A" and resid   34 and name   HE) (segid "   A" and resid   34 and name  HD2) 2.343 0.686 0.686 weight 1.000 ! spec=Noesy, no=70, id=69, vol=1.368368e+07
    or (segid "   A" and resid   34 and name   HE) (segid "   A" and resid   34 and name  HD1)
    or (segid "   A" and resid    7 and name   HE) (segid "   A" and resid    7 and name  HD2)
    or (segid "   A" and resid    7 and name   HE) (segid "   A" and resid    7 and name  HD1)
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HB2) 2.302 0.662 0.662 weight 1.000 ! spec=Noesy, no=71, id=70, vol=9.700280e+06
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HB1)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB2) 2.033 0.517 0.517 weight 1.000 ! spec=Noesy, no=72, id=71, vol=1.851716e+07
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB1)
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name  HB2) 2.199 0.604 0.604 weight 1.000 ! spec=Noesy, no=90, id=89, vol=1.384217e+07
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name  HB1)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name  HB1) 2.153 0.579 0.579 weight 1.000 ! spec=Noesy, no=106, id=105, vol=1.298538e+07
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name  HB2)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HB1) 2.161 0.584 0.584 weight 1.000 ! spec=Noesy, no=111, id=110, vol=1.577575e+07
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HB2)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   23 and name  HB1) 2.881 1.038 1.038 weight 1.000 ! spec=Noesy, no=121, id=120, vol=2.952370e+06
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   23 and name  HB2)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HB1) 2.042 0.521 0.521 weight 1.000 ! spec=Noesy, no=123, id=122, vol=2.119178e+07
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HB2)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HD2) 2.517 0.792 0.792 weight 1.000 ! spec=Noesy, no=126, id=125, vol=5.852544e+06
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HD1)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HG1) 2.733 0.934 0.934 weight 1.000 ! spec=Noesy, no=132, id=131, vol=3.635230e+06
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HG2)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HB3) 2.432 2.432 3.568 weight 1.000 ! spec=Noesy, no=134, id=133, vol=9.470092e+06
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid    5 and name HG22) 2.416 0.730 0.730 weight 1.000 ! spec=Noesy, no=138, id=137, vol=7.178490e+06
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name HG22)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name HG21)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    1 and name HD11) 2.364 0.699 0.699 weight 1.000 ! spec=Noesy, no=148, id=147, vol=7.040872e+06
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    1 and name HD12)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    1 and name HD13)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    1 and name HD23)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    1 and name HD22)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid    3 and name  HD1) 3.137 1.230 1.230 weight 1.000 ! spec=Noesy, no=187, id=186, vol=1.994690e+06
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   37 and name   HB)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name  HA1) 3.008 1.131 1.131 weight 1.000 ! spec=Noesy, no=190, id=189, vol=2.600848e+06
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name  HA2)
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   24 and name  HD1) 3.281 1.346 1.346 weight 1.000 ! spec=Noesy, no=196, id=195, vol=1.526514e+06
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   24 and name  HD1)
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name  HD2)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   31 and name  HB1) 3.431 1.472 1.472 weight 1.000 ! spec=Noesy, no=197, id=196, vol=1.349580e+06
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HD2)
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HD1)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   31 and name  HB1) 3.414 1.457 1.457 weight 1.000 ! spec=Noesy, no=199, id=198, vol=1.076154e+06
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    2 and name  HD2)
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HB1) 3.343 1.397 1.397 weight 1.000 ! spec=Noesy, no=200, id=199, vol=1.171806e+06
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name  HB1)
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name  HD2)
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid    7 and name  HD2) 3.419 1.461 1.461 weight 1.000 ! spec=Noesy, no=201, id=200, vol=1.281764e+06
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid    7 and name  HD2)
    or (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid    7 and name  HD1)
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid    7 and name  HD1)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   21 and name  HB1) 3.170 1.256 1.256 weight 1.000 ! spec=Noesy, no=216, id=215, vol=1.670918e+06
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   21 and name  HB2)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   21 and name  HB1) 3.392 1.438 1.438 weight 1.000 ! spec=Noesy, no=217, id=216, vol=1.314302e+06
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   21 and name  HB2)
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   21 and name  HB1) 3.296 1.358 1.358 weight 1.000 ! spec=Noesy, no=218, id=217, vol=1.361976e+06
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   21 and name  HB2)
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   21 and name  HB2) 2.942 1.082 1.082 weight 1.000 ! spec=Noesy, no=219, id=218, vol=2.489852e+06
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   21 and name  HB1)
assign (segid "   A" and resid    7 and name   HE) (segid "   A" and resid    7 and name  HB2) 3.125 1.221 1.221 weight 1.000 ! spec=Noesy, no=238, id=237, vol=2.069188e+06
    or (segid "   A" and resid    7 and name   HE) (segid "   A" and resid    7 and name  HB1)
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid    7 and name  HB1) 3.367 1.417 1.417 weight 1.000 ! spec=Noesy, no=239, id=238, vol=1.260026e+06
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid    7 and name  HB1)
    or (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid    7 and name  HB2)
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid    7 and name  HB2)
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name  HG1) 3.308 1.368 1.368 weight 1.000 ! spec=Noesy, no=255, id=254, vol=1.236460e+05
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name  HG2)
assign (segid "   A" and resid    3 and name   HE) (segid "   A" and resid    3 and name  HG1) 3.435 1.475 1.475 weight 1.000 ! spec=Noesy, no=256, id=255, vol=1.084448e+06
    or (segid "   A" and resid    3 and name   HE) (segid "   A" and resid    3 and name  HG2)
assign (segid "   A" and resid   33 and name  HZ2) (segid "   A" and resid    2 and name  HG1) 3.368 1.418 1.418 weight 1.000 ! spec=Noesy, no=258, id=257, vol=1.137078e+06
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HG2)
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HG1)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    2 and name  HG1) 3.433 1.473 1.473 weight 1.000 ! spec=Noesy, no=259, id=258, vol=1.041300e+06
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    1 and name  HB1)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HG2) 3.346 1.399 1.399 weight 1.000 ! spec=Noesy, no=271, id=270, vol=1.396866e+06
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HG1)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   36 and name  HG2) 3.281 3.281 2.719 weight 1.000 ! spec=Noesy, no=272, id=271, vol=1.596614e+06
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   36 and name  HG1)
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid   36 and name  HG2) 3.169 1.255 1.255 weight 1.000 ! spec=Noesy, no=273, id=272, vol=1.388878e+06
    or (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid   36 and name  HG1)
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   24 and name  HG1) 3.430 1.470 1.470 weight 1.000 ! spec=Noesy, no=283, id=282, vol=1.183708e+06
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   24 and name  HG1)
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   24 and name  HG2)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   24 and name  HG2)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HG1) 3.329 1.386 1.386 weight 1.000 ! spec=Noesy, no=284, id=283, vol=1.274780e+06
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HG2)
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   24 and name  HG1) 3.239 1.312 1.312 weight 1.000 ! spec=Noesy, no=285, id=284, vol=1.379232e+06
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   24 and name  HG1)
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   24 and name  HG2)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   24 and name  HG2)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    9 and name HG13) 3.032 1.149 1.149 weight 1.000 ! spec=Noesy, no=286, id=285, vol=1.437074e+06
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    9 and name HG11)
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    9 and name HG12)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    9 and name HG13)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    9 and name HG11)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    9 and name HG12)
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   40 and name HG12) 2.910 1.059 1.059 weight 1.000 ! spec=Noesy, no=290, id=289, vol=3.230760e+06
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   40 and name HG13)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   40 and name HG12)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   40 and name HG13)
    or (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   40 and name HG12)
    or (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   40 and name HG13)
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   40 and name HG12)
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name   HB) 3.456 1.493 1.493 weight 1.000 ! spec=Noesy, no=336, id=335, vol=1.181850e+06
    or (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   37 and name   HB)
assign (segid "   A" and resid   33 and name  HE3) (segid "   A" and resid   32 and name  HB1) 3.628 3.628 2.372 weight 1.000 ! spec=Noesy, no=344, id=343, vol=8.487320e+05
    or (segid "   A" and resid   33 and name  HZ2) (segid "   A" and resid   32 and name  HB1)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HD1) 3.649 1.665 1.665 weight 1.000 ! spec=Noesy, no=353, id=352, vol=6.785760e+05
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HD2)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HD1) 3.778 1.784 1.784 weight 1.000 ! spec=Noesy, no=356, id=355, vol=6.867320e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HD2)
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid    7 and name  HD1) 3.959 1.960 1.960 weight 1.000 ! spec=Noesy, no=357, id=356, vol=4.381460e+05
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid    7 and name  HD1)
    or (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid    7 and name  HD2)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid    7 and name  HD2)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HE2) 4.267 2.276 2.276 weight 1.000 ! spec=Noesy, no=358, id=357, vol=2.813880e+05
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HE1)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    8 and name  HB1) 3.788 1.793 1.793 weight 1.000 ! spec=Noesy, no=359, id=358, vol=5.299320e+05
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    8 and name  HB2)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    8 and name  HB2) 3.634 1.651 1.651 weight 1.000 ! spec=Noesy, no=360, id=359, vol=7.157360e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    8 and name  HB1)
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid    8 and name  HB2) 4.013 2.013 2.013 weight 1.000 ! spec=Noesy, no=361, id=360, vol=4.955020e+05
    or (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid    8 and name  HB1)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HE2) 3.887 1.889 1.889 weight 1.000 ! spec=Noesy, no=364, id=363, vol=4.413000e+05
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HE1)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    4 and name  HB2) 3.732 1.741 1.741 weight 1.000 ! spec=Noesy, no=370, id=369, vol=5.027980e+05
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    4 and name  HB2)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   21 and name  HB2) 3.952 1.953 1.953 weight 1.000 ! spec=Noesy, no=374, id=373, vol=5.409420e+05
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   21 and name  HB1)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    7 and name  HB1) 3.827 1.831 1.831 weight 1.000 ! spec=Noesy, no=397, id=396, vol=5.458440e+05
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    7 and name  HB2)
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    7 and name  HB1) 3.815 1.819 1.819 weight 1.000 ! spec=Noesy, no=399, id=398, vol=5.097160e+05
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    7 and name  HB2)
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name  HG2) 3.720 1.730 1.730 weight 1.000 ! spec=Noesy, no=408, id=407, vol=7.807240e+05
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name  HG1)
assign (segid "   A" and resid   33 and name  HZ3) (segid "   A" and resid    3 and name  HG2) 3.945 1.946 1.946 weight 1.000 ! spec=Noesy, no=409, id=408, vol=5.212820e+05
    or (segid "   A" and resid   33 and name  HZ3) (segid "   A" and resid    3 and name  HG1)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HG2) 3.502 1.533 1.533 weight 1.000 ! spec=Noesy, no=410, id=409, vol=7.511480e+05
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HG1)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HD2) 3.870 1.872 1.872 weight 1.000 ! spec=Noesy, no=411, id=410, vol=4.569380e+05
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HD1)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   23 and name  HG2) 3.783 1.789 1.789 weight 1.000 ! spec=Noesy, no=417, id=416, vol=5.944700e+05
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   23 and name  HG1)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   36 and name  HG1) 3.576 1.599 1.599 weight 1.000 ! spec=Noesy, no=425, id=424, vol=9.660580e+05
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   36 and name  HG2)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   36 and name  HG1) 3.714 1.724 1.724 weight 1.000 ! spec=Noesy, no=426, id=425, vol=7.147200e+05
    or (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   36 and name  HG2)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   36 and name  HG2) 3.796 1.801 1.801 weight 1.000 ! spec=Noesy, no=427, id=426, vol=5.604800e+05
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   36 and name  HG1)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    1 and name HD11) 4.085 2.086 2.086 weight 1.000 ! spec=Noesy, no=441, id=440, vol=3.713920e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    1 and name HD12)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    1 and name HD13)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    1 and name HD23)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    1 and name HD22)
assign (segid "   A" and resid   33 and name  HZ2) (segid "   A" and resid    2 and name  HB2) 3.568 1.591 1.591 weight 1.000 ! spec=Noesy, no=455, id=454, vol=1.007652e+06
    or (segid "   A" and resid   33 and name  HE3) (segid "   A" and resid    2 and name  HB2)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   31 and name   HN) 3.648 1.664 1.664 weight 1.000 ! spec=Noesy, no=480, id=479, vol=7.861360e+05
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   38 and name   HN)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name   HN) 2.058 0.529 0.529 weight 1.000 ! spec=Noesy, no=504, id=503, vol=1.502213e+07
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    7 and name   HN)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid    3 and name   HN) 1.592 1.592 4.408 weight 1.000 ! spec=Noesy, no=512, id=511, vol=7.334900e+07
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    3 and name   HN)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   26 and name  HB1) 3.116 1.214 1.214 weight 1.000 ! spec=Noesy, no=531, id=530, vol=2.437604e+06
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   27 and name  HB3)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   23 and name  HD2) 4.232 2.238 2.238 weight 1.000 ! spec=Noesy, no=542, id=541, vol=3.433840e+05
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   23 and name  HD1)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HD1) 4.174 2.177 2.177 weight 1.000 ! spec=Noesy, no=543, id=542, vol=5.931900e+05
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HD2)
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HD1) 4.649 2.701 2.701 weight 1.000 ! spec=Noesy, no=544, id=543, vol=1.788500e+05
    or (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HD2)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HG1) 2.987 1.115 1.115 weight 1.000 ! spec=Noesy, no=547, id=546, vol=3.449676e+06
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HG2)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    1 and name HD21) 4.123 2.125 2.125 weight 1.000 ! spec=Noesy, no=550, id=549, vol=4.794880e+05
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    1 and name HD23)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    1 and name HD22)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    1 and name HD11)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    1 and name HD12)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    1 and name HD13)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   21 and name  HB1) 4.424 2.447 2.447 weight 1.000 ! spec=Noesy, no=555, id=554, vol=2.554620e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   21 and name  HB2)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    9 and name   HB) 3.428 1.469 1.469 weight 1.000 ! spec=Noesy, no=556, id=555, vol=1.685572e+06
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    9 and name   HB)
assign (segid "   A" and resid   34 and name   HE) (segid "   A" and resid   34 and name  HG2) 3.162 1.250 1.250 weight 1.000 ! spec=Noesy, no=558, id=557, vol=2.418106e+06
    or (segid "   A" and resid    7 and name   HE) (segid "   A" and resid    7 and name  HG1)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HD2) 3.699 1.710 1.710 weight 1.000 ! spec=Noesy, no=559, id=558, vol=1.015796e+06
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HD1)
assign (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   40 and name HG21) 3.042 1.157 1.157 weight 1.000 ! spec=Noesy, no=560, id=559, vol=2.642956e+06
    or (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   40 and name HG23)
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   40 and name HG21)
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   40 and name HG23)
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   40 and name HG21)
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   40 and name HG23)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   40 and name HG21)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid    8 and name  HB1) 4.346 2.361 2.361 weight 1.000 ! spec=Noesy, no=565, id=564, vol=2.509560e+05
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid    8 and name  HB1)
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid    8 and name  HB2)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid    8 and name  HB2)
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   21 and name  HB2) 4.364 2.380 2.380 weight 1.000 ! spec=Noesy, no=574, id=573, vol=2.497920e+05
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   21 and name  HB1)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   11 and name  HD1) 3.928 1.929 1.929 weight 1.000 ! spec=Noesy, no=596, id=595, vol=4.995060e+05
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   11 and name  HD2)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   25 and name  HD2)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   25 and name  HD1)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   21 and name  HB1) 3.698 1.710 1.710 weight 1.000 ! spec=Noesy, no=606, id=605, vol=7.859800e+05
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   21 and name  HB2)
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   36 and name  HD1) 4.257 2.265 2.265 weight 1.000 ! spec=Noesy, no=610, id=609, vol=3.081920e+05
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   36 and name  HD2)
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   36 and name  HG2) 3.904 3.904 2.096 weight 1.000 ! spec=Noesy, no=611, id=610, vol=5.753380e+05
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   36 and name  HG1)
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   34 and name   HA) 3.985 1.985 1.985 weight 1.000 ! spec=Noesy, no=639, id=638, vol=6.309780e+05
    or (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   33 and name  HB2)
assign (segid "   A" and resid    1 and name   HA) (segid "   A" and resid   32 and name  HB1) 3.732 1.741 1.741 weight 1.000 ! spec=Noesy, no=643, id=642, vol=7.911840e+05
    or (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   32 and name  HB1)
assign (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   17 and name   HA) 3.244 1.316 1.316 weight 1.000 ! spec=Noesy, no=650, id=649, vol=1.725964e+06
    or (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   17 and name   HA)
assign (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid   31 and name   HA) 2.384 0.711 0.711 weight 1.000 ! spec=Noesy, no=662, id=661, vol=1.147938e+07
    or (segid "   A" and resid    2 and name  HD2) (segid "   A" and resid    1 and name   HA)
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    5 and name   HA) 2.687 0.903 0.903 weight 1.000 ! spec=Noesy, no=667, id=666, vol=6.487694e+06
    or (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    5 and name   HA)
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name   HA) 2.777 0.964 0.964 weight 1.000 ! spec=Noesy, no=668, id=667, vol=7.267034e+06
    or (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name   HA)
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   26 and name   HA) 2.706 0.916 0.916 weight 1.000 ! spec=Noesy, no=680, id=679, vol=8.261084e+06
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   26 and name   HA)
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   24 and name   HA) 2.384 0.710 0.710 weight 1.000 ! spec=Noesy, no=699, id=698, vol=1.284161e+07
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   24 and name   HA)
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   18 and name   HA) 3.459 1.496 1.496 weight 1.000 ! spec=Noesy, no=700, id=699, vol=1.275916e+06
    or (segid "   A" and resid   16 and name   HB) (segid "   A" and resid   17 and name   HA)
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name   HA) 2.286 0.653 0.653 weight 1.000 ! spec=Noesy, no=703, id=702, vol=1.621922e+07
    or (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   23 and name   HA)
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   17 and name   HA) 2.844 1.011 1.011 weight 1.000 ! spec=Noesy, no=704, id=703, vol=4.329854e+06
    or (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   17 and name   HA)
assign (segid "   A" and resid   23 and name  HD1) (segid "   A" and resid   23 and name   HA) 3.013 1.135 1.135 weight 1.000 ! spec=Noesy, no=705, id=704, vol=3.281384e+06
    or (segid "   A" and resid   23 and name  HD2) (segid "   A" and resid   23 and name   HA)
assign (segid "   A" and resid   23 and name  HD2) (segid "   A" and resid   24 and name   HA) 3.076 1.183 1.183 weight 1.000 ! spec=Noesy, no=706, id=705, vol=2.592608e+06
    or (segid "   A" and resid   23 and name  HD1) (segid "   A" and resid   24 and name   HA)
assign (segid "   A" and resid   23 and name  HG1) (segid "   A" and resid   24 and name   HA) 3.344 1.398 1.398 weight 1.000 ! spec=Noesy, no=710, id=709, vol=1.514316e+06
    or (segid "   A" and resid   23 and name  HG2) (segid "   A" and resid   24 and name   HA)
assign (segid "   A" and resid   23 and name  HG2) (segid "   A" and resid   23 and name   HA) 3.010 1.132 1.132 weight 1.000 ! spec=Noesy, no=711, id=710, vol=3.142394e+06
    or (segid "   A" and resid   23 and name  HG1) (segid "   A" and resid   23 and name   HA)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   17 and name   HA) 3.051 1.164 1.164 weight 1.000 ! spec=Noesy, no=712, id=711, vol=2.838448e+06
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   17 and name   HA)
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   22 and name  HD2) 3.310 1.370 1.370 weight 1.000 ! spec=Noesy, no=726, id=725, vol=1.176556e+06
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   22 and name  HD2)
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    3 and name  HD1) 5.864 4.298 4.298 weight 1.000 ! spec=Noesy, no=727, id=726, vol=2.579140e+05
    or (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    5 and name   HA)
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid    8 and name  HB1) 2.003 2.003 3.997 weight 1.000 ! spec=Noesy, no=738, id=737, vol=1.935360e+07
    or (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid    8 and name  HB2)
assign (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   25 and name  HB2) 2.630 0.864 0.864 weight 1.000 ! spec=Noesy, no=742, id=741, vol=4.564482e+06
    or (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   25 and name  HB2)
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid    8 and name  HB1) 3.639 1.655 1.655 weight 1.000 ! spec=Noesy, no=745, id=744, vol=3.335144e+06
    or (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid    8 and name  HB2)
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   34 and name  HD1) 3.090 1.194 1.194 weight 1.000 ! spec=Noesy, no=746, id=745, vol=3.201116e+06
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   34 and name  HD2)
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name   HA) 2.560 0.820 0.820 weight 1.000 ! spec=Noesy, no=757, id=756, vol=8.681866e+06
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name   HA)
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    4 and name   HA) 2.302 0.662 0.662 weight 1.000 ! spec=Noesy, no=760, id=759, vol=1.655449e+07
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    4 and name   HA)
assign (segid "   A" and resid   19 and name  HD1) (segid "   A" and resid   19 and name   HA) 3.167 1.254 1.254 weight 1.000 ! spec=Noesy, no=765, id=764, vol=2.410762e+06
    or (segid "   A" and resid   19 and name  HD2) (segid "   A" and resid   19 and name   HA)
assign (segid "   A" and resid    3 and name  HG2) (segid "   A" and resid    3 and name  HD1) 3.041 1.156 1.156 weight 1.000 ! spec=Noesy, no=769, id=768, vol=3.071444e+06
    or (segid "   A" and resid    3 and name  HG1) (segid "   A" and resid    3 and name  HD1)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   18 and name   HA) 3.654 1.669 1.669 weight 1.000 ! spec=Noesy, no=790, id=789, vol=7.807340e+05
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   18 and name   HA)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   18 and name   HA)
    or (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   17 and name   HA)
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   17 and name   HA)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   17 and name   HA)
assign (segid "   A" and resid    1 and name HD11) (segid "   A" and resid    5 and name   HB) 3.510 1.540 1.540 weight 1.000 ! spec=Noesy, no=791, id=790, vol=2.143080e+06
    or (segid "   A" and resid    1 and name HD12) (segid "   A" and resid    5 and name   HB)
    or (segid "   A" and resid    1 and name HD13) (segid "   A" and resid    5 and name   HB)
    or (segid "   A" and resid    1 and name HD21) (segid "   A" and resid    5 and name   HB)
    or (segid "   A" and resid    1 and name HD23) (segid "   A" and resid    5 and name   HB)
    or (segid "   A" and resid    1 and name HD22) (segid "   A" and resid    5 and name   HB)
assign (segid "   A" and resid    1 and name   HG) (segid "   A" and resid    6 and name  HB2) 3.997 1.997 1.997 weight 1.000 ! spec=Noesy, no=793, id=792, vol=6.835100e+05
    or (segid "   A" and resid    1 and name   HG) (segid "   A" and resid    6 and name  HB1)
assign (segid "   A" and resid    1 and name  HB2) (segid "   A" and resid    6 and name  HB2) 4.158 2.161 2.161 weight 1.000 ! spec=Noesy, no=794, id=793, vol=4.338160e+05
    or (segid "   A" and resid    1 and name  HB2) (segid "   A" and resid    6 and name  HB1)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   32 and name  HB1) 3.464 1.500 1.500 weight 1.000 ! spec=Noesy, no=800, id=799, vol=1.415504e+06
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   32 and name  HB1)
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   32 and name  HB2) 3.289 1.352 1.352 weight 1.000 ! spec=Noesy, no=801, id=800, vol=1.911742e+06
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   32 and name  HB2)
assign (segid "   A" and resid    1 and name HD11) (segid "   A" and resid    6 and name   HA) 3.397 1.442 1.442 weight 1.000 ! spec=Noesy, no=806, id=805, vol=3.449564e+06
    or (segid "   A" and resid    1 and name HD12) (segid "   A" and resid    6 and name   HA)
    or (segid "   A" and resid    1 and name HD13) (segid "   A" and resid    6 and name   HA)
    or (segid "   A" and resid    1 and name HD21) (segid "   A" and resid    6 and name   HA)
    or (segid "   A" and resid    1 and name HD23) (segid "   A" and resid    6 and name   HA)
    or (segid "   A" and resid    1 and name HD22) (segid "   A" and resid    6 and name   HA)
assign (segid "   A" and resid    1 and name HD11) (segid "   A" and resid    6 and name  HB2) 3.234 1.308 1.308 weight 1.000 ! spec=Noesy, no=813, id=812, vol=1.551112e+06
    or (segid "   A" and resid    1 and name HD12) (segid "   A" and resid    6 and name  HB2)
    or (segid "   A" and resid    1 and name HD13) (segid "   A" and resid    6 and name  HB2)
    or (segid "   A" and resid    1 and name HD11) (segid "   A" and resid    6 and name  HB1)
    or (segid "   A" and resid    1 and name HD12) (segid "   A" and resid    6 and name  HB1)
    or (segid "   A" and resid    1 and name HD13) (segid "   A" and resid    6 and name  HB1)
    or (segid "   A" and resid    1 and name HD21) (segid "   A" and resid    6 and name  HB2)
    or (segid "   A" and resid    1 and name HD23) (segid "   A" and resid    6 and name  HB2)
    or (segid "   A" and resid    1 and name HD22) (segid "   A" and resid    6 and name  HB2)
    or (segid "   A" and resid    1 and name HD21) (segid "   A" and resid    6 and name  HB1)
    or (segid "   A" and resid    1 and name HD23) (segid "   A" and resid    6 and name  HB1)
    or (segid "   A" and resid    1 and name HD22) (segid "   A" and resid    6 and name  HB1)
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name  HD2) 2.781 0.967 0.967 weight 1.000 ! spec=Noesy, no=827, id=826, vol=4.798346e+06
    or (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name  HD1)
assign (segid "   A" and resid    9 and name   HB) (segid "   A" and resid    8 and name  HB2) 4.391 2.410 2.410 weight 1.000 ! spec=Noesy, no=828, id=827, vol=3.387040e+05
    or (segid "   A" and resid    9 and name   HB) (segid "   A" and resid    8 and name  HB1)
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name  HD1) 3.102 1.203 1.203 weight 1.000 ! spec=Noesy, no=829, id=828, vol=2.672166e+06
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name  HD2)
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name  HD2) 2.912 1.060 1.060 weight 1.000 ! spec=Noesy, no=832, id=831, vol=4.447286e+06
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name  HD1)
    or (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name  HD2)
    or (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name  HD1)
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   24 and name  HD1) 2.510 2.510 3.490 weight 1.000 ! spec=Noesy, no=835, id=834, vol=8.950396e+06
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   24 and name  HD1)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name  HD2) 2.499 0.781 0.781 weight 1.000 ! spec=Noesy, no=836, id=835, vol=9.545762e+06
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name  HD1)
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name  HD1) 2.498 0.780 0.780 weight 1.000 ! spec=Noesy, no=837, id=836, vol=1.013336e+07
    or (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name  HD2)
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   24 and name  HD2) 2.558 2.558 3.442 weight 1.000 ! spec=Noesy, no=844, id=843, vol=8.106352e+06
    or (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   24 and name  HD2)
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   23 and name  HE2) 3.288 1.351 1.351 weight 1.000 ! spec=Noesy, no=845, id=844, vol=2.165268e+06
    or (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   23 and name  HE1)
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name  HE2)
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name  HE1)
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name  HD2) 2.561 0.820 0.820 weight 1.000 ! spec=Noesy, no=850, id=849, vol=8.491746e+06
    or (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name  HD1)
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name  HE2) 3.521 1.550 1.550 weight 1.000 ! spec=Noesy, no=851, id=850, vol=1.112790e+06
    or (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name  HE1)
assign (segid "   A" and resid   23 and name  HG1) (segid "   A" and resid   23 and name  HE1) 3.275 1.341 1.341 weight 1.000 ! spec=Noesy, no=852, id=851, vol=1.951000e+06
    or (segid "   A" and resid   23 and name  HG1) (segid "   A" and resid   23 and name  HE2)
    or (segid "   A" and resid   23 and name  HG2) (segid "   A" and resid   23 and name  HE1)
    or (segid "   A" and resid   23 and name  HG2) (segid "   A" and resid   23 and name  HE2)
assign (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   19 and name  HE2) 3.556 1.581 1.581 weight 1.000 ! spec=Noesy, no=853, id=852, vol=1.030128e+06
    or (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   19 and name  HE1)
assign (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   28 and name  HB1) 3.729 1.738 1.738 weight 1.000 ! spec=Noesy, no=855, id=854, vol=8.756380e+05
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   28 and name  HB1)
assign (segid "   A" and resid   36 and name  HD2) (segid "   A" and resid   36 and name  HE1) 2.866 1.027 1.027 weight 1.000 ! spec=Noesy, no=856, id=855, vol=3.896162e+06
    or (segid "   A" and resid   36 and name  HD1) (segid "   A" and resid   36 and name  HE1)
assign (segid "   A" and resid   23 and name  HG2) (segid "   A" and resid   24 and name  HD2) 3.680 3.680 2.320 weight 1.000 ! spec=Noesy, no=857, id=856, vol=1.395328e+06
    or (segid "   A" and resid   23 and name  HG1) (segid "   A" and resid   24 and name  HD2)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HE1) 2.738 0.937 0.937 weight 1.000 ! spec=Noesy, no=858, id=857, vol=5.846134e+06
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   36 and name  HE1)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HE2) 2.825 0.997 0.997 weight 1.000 ! spec=Noesy, no=859, id=858, vol=4.486026e+06
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   36 and name  HE2)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   31 and name  HB1) 3.309 1.369 1.369 weight 1.000 ! spec=Noesy, no=861, id=860, vol=1.841424e+06
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   31 and name  HB1)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   31 and name  HB2) 3.179 1.264 1.264 weight 1.000 ! spec=Noesy, no=863, id=862, vol=2.142102e+06
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   31 and name  HB2)
assign (segid "   A" and resid   30 and name HG23) (segid "   A" and resid   34 and name  HD1) 2.792 2.792 3.208 weight 1.000 ! spec=Noesy, no=866, id=865, vol=2.663490e+06
    or (segid "   A" and resid   30 and name HG22) (segid "   A" and resid   34 and name  HD1)
    or (segid "   A" and resid   30 and name HG21) (segid "   A" and resid   34 and name  HD1)
    or (segid "   A" and resid   30 and name HG23) (segid "   A" and resid   34 and name  HD2)
    or (segid "   A" and resid   30 and name HG22) (segid "   A" and resid   34 and name  HD2)
    or (segid "   A" and resid   30 and name HG21) (segid "   A" and resid   34 and name  HD2)
assign (segid "   A" and resid   24 and name  HG2) (segid "   A" and resid   24 and name  HD1) 3.034 1.150 1.150 weight 1.000 ! spec=Noesy, no=867, id=866, vol=3.193096e+06
    or (segid "   A" and resid   24 and name  HG1) (segid "   A" and resid   24 and name  HD1)
assign (segid "   A" and resid    1 and name HD21) (segid "   A" and resid    2 and name  HD2) 3.507 1.537 1.537 weight 1.000 ! spec=Noesy, no=870, id=869, vol=2.396656e+06
    or (segid "   A" and resid    1 and name HD23) (segid "   A" and resid    2 and name  HD2)
    or (segid "   A" and resid    1 and name HD22) (segid "   A" and resid    2 and name  HD2)
    or (segid "   A" and resid    1 and name HD11) (segid "   A" and resid    2 and name  HD2)
    or (segid "   A" and resid    1 and name HD12) (segid "   A" and resid    2 and name  HD2)
    or (segid "   A" and resid    1 and name HD13) (segid "   A" and resid    2 and name  HD2)
assign (segid "   A" and resid    9 and name HG13) (segid "   A" and resid    8 and name  HB2) 2.979 1.109 1.109 weight 1.000 ! spec=Noesy, no=871, id=870, vol=2.096748e+06
    or (segid "   A" and resid    9 and name HG11) (segid "   A" and resid    8 and name  HB2)
    or (segid "   A" and resid    9 and name HG12) (segid "   A" and resid    8 and name  HB2)
    or (segid "   A" and resid    9 and name HG13) (segid "   A" and resid    8 and name  HB1)
    or (segid "   A" and resid    9 and name HG11) (segid "   A" and resid    8 and name  HB1)
    or (segid "   A" and resid    9 and name HG12) (segid "   A" and resid    8 and name  HB1)
assign (segid "   A" and resid    9 and name HG21) (segid "   A" and resid    8 and name  HB1) 3.590 1.611 1.611 weight 1.000 ! spec=Noesy, no=872, id=871, vol=7.293220e+05
    or (segid "   A" and resid    9 and name HG22) (segid "   A" and resid    8 and name  HB1)
    or (segid "   A" and resid    9 and name HG23) (segid "   A" and resid    8 and name  HB1)
    or (segid "   A" and resid    9 and name HG21) (segid "   A" and resid    8 and name  HB2)
    or (segid "   A" and resid    9 and name HG22) (segid "   A" and resid    8 and name  HB2)
    or (segid "   A" and resid    9 and name HG23) (segid "   A" and resid    8 and name  HB2)
assign (segid "   A" and resid   24 and name  HG1) (segid "   A" and resid   24 and name  HD2) 2.783 0.968 0.968 weight 1.000 ! spec=Noesy, no=876, id=875, vol=5.358310e+06
    or (segid "   A" and resid   24 and name  HG2) (segid "   A" and resid   24 and name  HD2)
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   24 and name  HB1) 2.379 0.708 0.708 weight 1.000 ! spec=Noesy, no=888, id=887, vol=1.041955e+07
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   24 and name  HB1)
assign (segid "   A" and resid   36 and name  HD1) (segid "   A" and resid   15 and name  HB2) 3.364 1.414 1.414 weight 1.000 ! spec=Noesy, no=890, id=889, vol=1.654368e+06
    or (segid "   A" and resid   36 and name  HD2) (segid "   A" and resid   15 and name  HB2)
assign (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   21 and name  HB1) 3.133 1.227 1.227 weight 1.000 ! spec=Noesy, no=891, id=890, vol=1.821174e+06
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   21 and name  HB2)
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   35 and name  HG2) 3.052 1.165 1.165 weight 1.000 ! spec=Noesy, no=892, id=891, vol=2.783134e+06
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   15 and name  HB2)
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   35 and name  HG2)
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   15 and name  HB2)
assign (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   21 and name  HB2) 3.668 1.682 1.682 weight 1.000 ! spec=Noesy, no=894, id=893, vol=5.938420e+05
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   21 and name  HB1)
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   35 and name  HB2) 3.550 1.575 1.575 weight 1.000 ! spec=Noesy, no=895, id=894, vol=1.034488e+06
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   35 and name  HB2)
assign (segid "   A" and resid   24 and name  HG1) (segid "   A" and resid   24 and name  HB1) 2.885 1.041 1.041 weight 1.000 ! spec=Noesy, no=899, id=898, vol=4.342224e+06
    or (segid "   A" and resid   24 and name  HG2) (segid "   A" and resid   24 and name  HB1)
assign (segid "   A" and resid   20 and name HG12) (segid "   A" and resid   21 and name  HB1) 3.719 1.729 1.729 weight 1.000 ! spec=Noesy, no=900, id=899, vol=8.168720e+05
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   20 and name HG12) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   21 and name  HB2)
assign (segid "   A" and resid   40 and name HG21) (segid "   A" and resid   21 and name  HB1) 3.868 1.870 1.870 weight 1.000 ! spec=Noesy, no=901, id=900, vol=3.875980e+05
    or (segid "   A" and resid   40 and name HG22) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   40 and name HG23) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   40 and name HG21) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   40 and name HG22) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   40 and name HG23) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   21 and name  HB2)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   21 and name  HB2) 3.439 1.478 1.478 weight 1.000 ! spec=Noesy, no=902, id=901, vol=1.179916e+06
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   21 and name  HB1)
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   17 and name  HB1) 2.539 0.806 0.806 weight 1.000 ! spec=Noesy, no=908, id=907, vol=6.373706e+06
    or (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   17 and name  HB1)
assign (segid "   A" and resid    3 and name  HG2) (segid "   A" and resid    3 and name  HB1) 2.411 0.726 0.726 weight 1.000 ! spec=Noesy, no=909, id=908, vol=6.446688e+06
    or (segid "   A" and resid    3 and name  HG1) (segid "   A" and resid    3 and name  HB1)
assign (segid "   A" and resid    3 and name  HG1) (segid "   A" and resid    3 and name  HB2) 2.168 0.588 0.588 weight 1.000 ! spec=Noesy, no=910, id=909, vol=2.024397e+07
    or (segid "   A" and resid    3 and name  HG2) (segid "   A" and resid    3 and name  HB2)
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   17 and name  HB2) 1.427 1.427 4.573 weight 1.000 ! spec=Noesy, no=911, id=910, vol=1.305401e+08
    or (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   17 and name  HB2)
assign (segid "   A" and resid   16 and name HG12) (segid "   A" and resid   16 and name   HB) 2.582 0.833 0.833 weight 1.000 ! spec=Noesy, no=912, id=911, vol=7.582716e+06
    or (segid "   A" and resid    7 and name  HG1) (segid "   A" and resid    7 and name  HB2)
    or (segid "   A" and resid    7 and name  HG1) (segid "   A" and resid    7 and name  HB1)
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   35 and name  HB1) 3.533 1.560 1.560 weight 1.000 ! spec=Noesy, no=917, id=916, vol=1.258116e+06
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   35 and name  HB1)
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   36 and name  HB2) 2.440 0.744 0.744 weight 1.000 ! spec=Noesy, no=922, id=921, vol=1.054215e+07
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HB2)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid    2 and name  HG1) 2.460 2.460 3.540 weight 1.000 ! spec=Noesy, no=924, id=923, vol=1.005976e+07
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid    2 and name  HG1)
assign (segid "   A" and resid   23 and name  HG1) (segid "   A" and resid   23 and name  HB2) 2.311 0.668 0.668 weight 1.000 ! spec=Noesy, no=925, id=924, vol=1.306320e+07
    or (segid "   A" and resid   23 and name  HG1) (segid "   A" and resid   23 and name  HB1)
    or (segid "   A" and resid   23 and name  HG2) (segid "   A" and resid   23 and name  HB2)
    or (segid "   A" and resid   23 and name  HG2) (segid "   A" and resid   23 and name  HB1)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HD1) 2.070 0.536 0.536 weight 1.000 ! spec=Noesy, no=929, id=928, vol=2.549828e+07
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   36 and name  HD2)
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   36 and name  HD1)
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HD2)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HD2) 2.601 0.846 0.846 weight 1.000 ! spec=Noesy, no=930, id=929, vol=7.594934e+06
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HD1)
assign (segid "   A" and resid   24 and name  HG2) (segid "   A" and resid   23 and name  HB2) 2.158 2.158 3.842 weight 1.000 ! spec=Noesy, no=937, id=936, vol=2.415052e+07
    or (segid "   A" and resid   24 and name  HG2) (segid "   A" and resid   23 and name  HB1)
    or (segid "   A" and resid   24 and name  HG1) (segid "   A" and resid   23 and name  HB2)
    or (segid "   A" and resid   24 and name  HG1) (segid "   A" and resid   23 and name  HB1)
assign (segid "   A" and resid    1 and name HD11) (segid "   A" and resid    1 and name  HB2) 2.815 0.991 0.991 weight 1.000 ! spec=Noesy, no=947, id=946, vol=4.638914e+06
    or (segid "   A" and resid    1 and name HD12) (segid "   A" and resid    1 and name  HB2)
    or (segid "   A" and resid    1 and name HD13) (segid "   A" and resid    1 and name  HB2)
    or (segid "   A" and resid    1 and name HD21) (segid "   A" and resid    1 and name  HB2)
    or (segid "   A" and resid    1 and name HD23) (segid "   A" and resid    1 and name  HB2)
    or (segid "   A" and resid    1 and name HD22) (segid "   A" and resid    1 and name  HB2)
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid   36 and name  HG1) 3.465 3.465 2.535 weight 1.000 ! spec=Noesy, no=949, id=948, vol=1.457058e+06
    or (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid   36 and name  HG2)
assign (segid "   A" and resid    1 and name HD21) (segid "   A" and resid    5 and name HG22) 2.841 1.009 1.009 weight 1.000 ! spec=Noesy, no=951, id=950, vol=6.249218e+06
    or (segid "   A" and resid    1 and name HD21) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    1 and name HD21) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    1 and name HD23) (segid "   A" and resid    5 and name HG22)
    or (segid "   A" and resid    1 and name HD23) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    1 and name HD23) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    1 and name HD22) (segid "   A" and resid    5 and name HG22)
    or (segid "   A" and resid    1 and name HD22) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    1 and name HD22) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    1 and name HD11) (segid "   A" and resid    5 and name HG22)
    or (segid "   A" and resid    1 and name HD11) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    1 and name HD11) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    1 and name HD12) (segid "   A" and resid    5 and name HG22)
    or (segid "   A" and resid    1 and name HD12) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    1 and name HD12) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    1 and name HD13) (segid "   A" and resid    5 and name HG22)
    or (segid "   A" and resid    1 and name HD13) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    1 and name HD13) (segid "   A" and resid    5 and name HG21)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HG2) 2.066 0.534 0.534 weight 1.000 ! spec=Noesy, no=952, id=951, vol=3.186945e+07
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HG1)
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    7 and name  HD1) 4.194 2.198 2.198 weight 1.000 ! spec=Noesy, no=956, id=955, vol=4.053220e+05
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    7 and name  HD2)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   19 and name  HE2) 4.915 3.020 3.020 weight 1.000 ! spec=Noesy, no=983, id=982, vol=1.426440e+05
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   19 and name  HE1)
assign (segid "   A" and resid   12 and name  HE1) (segid "   A" and resid   10 and name  HA1) 4.740 2.808 2.808 weight 1.000 ! spec=Noesy, no=995, id=994, vol=1.252600e+05
    or (segid "   A" and resid   12 and name  HE1) (segid "   A" and resid   10 and name  HA2)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    8 and name  HB1) 4.542 2.579 2.579 weight 1.000 ! spec=Noesy, no=1008, id=1007, vol=2.408700e+05
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    8 and name  HB2)
# Restraints file 5: unambig.tbl
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name   HA) 2.034 0.517 0.517 weight 1.000 ! spec=Noesy, no=1, id=0, vol=2.695482e+07
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name   HA) 2.883 1.039 1.039 weight 1.000 ! spec=Noesy, no=2, id=1, vol=3.334416e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   39 and name   HA) 2.116 0.560 0.560 weight 1.000 ! spec=Noesy, no=3, id=2, vol=2.507735e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name   HA) 2.134 0.569 0.569 weight 1.000 ! spec=Noesy, no=4, id=3, vol=2.150087e+07
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name   HA) 2.339 0.684 0.684 weight 1.000 ! spec=Noesy, no=5, id=4, vol=1.631408e+07
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name   HA) 2.449 0.750 0.750 weight 1.000 ! spec=Noesy, no=6, id=5, vol=7.293110e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name   HA) 2.797 0.978 0.978 weight 1.000 ! spec=Noesy, no=7, id=6, vol=3.996276e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name  HA1) 2.631 0.865 0.865 weight 1.000 ! spec=Noesy, no=8, id=7, vol=5.740720e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HA1) 2.852 1.017 1.017 weight 1.000 ! spec=Noesy, no=9, id=8, vol=2.897836e+06
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name   HA) 1.996 0.498 0.498 weight 1.000 ! spec=Noesy, no=10, id=9, vol=2.495844e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name   HA) 2.775 0.963 0.963 weight 1.000 ! spec=Noesy, no=11, id=10, vol=4.230000e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name   HA) 2.777 0.964 0.964 weight 1.000 ! spec=Noesy, no=12, id=11, vol=3.452482e+06
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name   HA) 2.142 0.574 0.574 weight 1.000 ! spec=Noesy, no=13, id=12, vol=2.047419e+07
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name   HA) 2.331 0.679 0.679 weight 1.000 ! spec=Noesy, no=14, id=13, vol=1.008711e+07
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   28 and name   HA) 2.657 0.883 0.883 weight 1.000 ! spec=Noesy, no=15, id=14, vol=4.875430e+06
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   28 and name   HA)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name   HA) 2.631 0.865 0.865 weight 1.000 ! spec=Noesy, no=16, id=15, vol=5.702604e+06
assign (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   11 and name   HA) 2.359 0.696 0.696 weight 1.000 ! spec=Noesy, no=17, id=16, vol=1.167075e+07
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   11 and name   HA)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name   HA) 2.823 0.996 0.996 weight 1.000 ! spec=Noesy, no=18, id=17, vol=4.139106e+06
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   40 and name   HA) 2.419 0.731 0.731 weight 1.000 ! spec=Noesy, no=19, id=18, vol=6.584764e+06
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   40 and name   HA)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name   HA) 2.535 0.803 0.803 weight 1.000 ! spec=Noesy, no=20, id=19, vol=6.173508e+06
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HA) 1.863 0.434 0.434 weight 1.000 ! spec=Noesy, no=21, id=20, vol=3.589590e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name   HB) 2.309 0.666 0.666 weight 1.000 ! spec=Noesy, no=22, id=21, vol=1.358577e+07
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name   HA) 2.583 0.834 0.834 weight 1.000 ! spec=Noesy, no=23, id=22, vol=5.492048e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name   HA) 2.087 0.544 0.544 weight 1.000 ! spec=Noesy, no=24, id=23, vol=2.023626e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   23 and name   HA) 2.071 0.536 0.536 weight 1.000 ! spec=Noesy, no=26, id=25, vol=2.080051e+07
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name   HA) 2.388 0.713 0.713 weight 1.000 ! spec=Noesy, no=27, id=26, vol=7.834820e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name   HA) 2.570 0.825 0.825 weight 1.000 ! spec=Noesy, no=28, id=27, vol=6.178788e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name   HA) 2.045 2.045 3.955 weight 1.000 ! spec=Noesy, no=29, id=28, vol=2.371095e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name   HA) 2.219 0.615 0.615 weight 1.000 ! spec=Noesy, no=30, id=29, vol=1.496877e+07
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name   HA) 2.493 0.777 0.777 weight 1.000 ! spec=Noesy, no=31, id=30, vol=7.413234e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name   HA) 1.866 0.435 0.435 weight 1.000 ! spec=Noesy, no=32, id=31, vol=3.603288e+07
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    4 and name   HA) 2.520 0.794 0.794 weight 1.000 ! spec=Noesy, no=33, id=32, vol=6.290592e+06
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    4 and name   HA) 2.838 1.007 1.007 weight 1.000 ! spec=Noesy, no=34, id=33, vol=3.000776e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name   HA) 2.579 0.831 0.831 weight 1.000 ! spec=Noesy, no=35, id=34, vol=7.205110e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name   HA) 2.493 0.777 0.777 weight 1.000 ! spec=Noesy, no=36, id=35, vol=6.719694e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name   HA) 2.859 1.022 1.022 weight 1.000 ! spec=Noesy, no=37, id=36, vol=3.164490e+06
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name   HA) 2.148 0.577 0.577 weight 1.000 ! spec=Noesy, no=38, id=37, vol=2.044610e+07
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name   HA) 2.528 0.799 0.799 weight 1.000 ! spec=Noesy, no=39, id=38, vol=7.437914e+06
assign (segid "   A" and resid   33 and name  HE3) (segid "   A" and resid   33 and name   HA) 2.386 0.712 0.712 weight 1.000 ! spec=Noesy, no=40, id=39, vol=1.044725e+07
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid   33 and name   HA) 2.843 2.843 3.157 weight 1.000 ! spec=Noesy, no=41, id=40, vol=2.833928e+06
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name   HB) 2.131 0.568 0.568 weight 1.000 ! spec=Noesy, no=42, id=41, vol=1.232499e+07
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name   HB) 2.528 0.799 0.799 weight 1.000 ! spec=Noesy, no=43, id=42, vol=6.339792e+06
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name   HA) 2.551 2.551 3.449 weight 1.000 ! spec=Noesy, no=45, id=44, vol=7.634446e+06
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name   HA) 2.590 0.839 0.839 weight 1.000 ! spec=Noesy, no=46, id=45, vol=5.506730e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name   HB) 2.401 0.721 0.721 weight 1.000 ! spec=Noesy, no=47, id=46, vol=9.819812e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name   HA) 2.656 0.882 0.882 weight 1.000 ! spec=Noesy, no=49, id=48, vol=4.767920e+06
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name   HA) 2.756 0.950 0.950 weight 1.000 ! spec=Noesy, no=53, id=52, vol=3.188150e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid    9 and name   HA) 2.872 1.031 1.031 weight 1.000 ! spec=Noesy, no=54, id=53, vol=3.099060e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name   HA) 2.807 0.985 0.985 weight 1.000 ! spec=Noesy, no=56, id=55, vol=3.643100e+06
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid   33 and name  HB2) 2.595 0.842 0.842 weight 1.000 ! spec=Noesy, no=57, id=56, vol=4.599536e+06
assign (segid "   A" and resid   33 and name  HE3) (segid "   A" and resid   33 and name  HB2) 2.805 2.805 3.195 weight 1.000 ! spec=Noesy, no=58, id=57, vol=4.182068e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name  HA2) 2.548 0.811 0.811 weight 1.000 ! spec=Noesy, no=59, id=58, vol=7.189420e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HA2) 2.481 0.769 0.769 weight 1.000 ! spec=Noesy, no=60, id=59, vol=8.152600e+06
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name  HB1) 2.312 2.312 3.688 weight 1.000 ! spec=Noesy, no=61, id=60, vol=1.203926e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB1) 2.634 2.634 3.366 weight 1.000 ! spec=Noesy, no=62, id=61, vol=5.680324e+06
assign (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   11 and name  HB1) 2.601 0.846 0.846 weight 1.000 ! spec=Noesy, no=63, id=62, vol=6.313996e+06
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   11 and name  HB1)
assign (segid "   A" and resid    3 and name   HE) (segid "   A" and resid    3 and name  HD2) 2.718 0.923 0.923 weight 1.000 ! spec=Noesy, no=64, id=63, vol=4.055326e+06
assign (segid "   A" and resid   33 and name  HE3) (segid "   A" and resid   33 and name  HB1) 2.659 0.884 0.884 weight 1.000 ! spec=Noesy, no=65, id=64, vol=5.453434e+06
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid   33 and name  HB1) 2.504 2.504 3.496 weight 1.000 ! spec=Noesy, no=66, id=65, vol=6.654630e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HB1) 2.297 0.660 0.660 weight 1.000 ! spec=Noesy, no=67, id=66, vol=1.138400e+07
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HB1) 2.813 0.989 0.989 weight 1.000 ! spec=Noesy, no=68, id=67, vol=3.853348e+06
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name  HB1) 2.376 0.705 0.705 weight 1.000 ! spec=Noesy, no=69, id=68, vol=9.803566e+06
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name  HB2) 3.187 1.269 1.269 weight 1.000 ! spec=Noesy, no=73, id=72, vol=2.396308e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HB2) 2.674 2.674 3.326 weight 1.000 ! spec=Noesy, no=74, id=73, vol=4.485318e+06
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   25 and name  HB2) 2.563 0.821 0.821 weight 1.000 ! spec=Noesy, no=75, id=74, vol=6.109378e+06
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   25 and name  HB2)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HB2) 2.380 0.708 0.708 weight 1.000 ! spec=Noesy, no=76, id=75, vol=1.073302e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HB1) 2.632 0.866 0.866 weight 1.000 ! spec=Noesy, no=77, id=76, vol=6.095600e+06
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   28 and name  HB1) 2.355 0.693 0.693 weight 1.000 ! spec=Noesy, no=78, id=77, vol=1.016130e+07
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   28 and name  HB1)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HB1) 2.441 0.745 0.745 weight 1.000 ! spec=Noesy, no=79, id=78, vol=9.818614e+06
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB2) 2.276 0.647 0.647 weight 1.000 ! spec=Noesy, no=80, id=79, vol=1.365261e+07
assign (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   11 and name  HB2) 2.583 0.834 0.834 weight 1.000 ! spec=Noesy, no=81, id=80, vol=6.921332e+06
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   11 and name  HB2)
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   14 and name  HB1) 2.277 0.648 0.648 weight 1.000 ! spec=Noesy, no=82, id=81, vol=1.266969e+07
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   14 and name  HB1)
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   24 and name  HD2) 2.841 1.009 1.009 weight 1.000 ! spec=Noesy, no=83, id=82, vol=3.553790e+06
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   24 and name  HD2)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HB2) 2.824 0.997 0.997 weight 1.000 ! spec=Noesy, no=84, id=83, vol=3.709980e+06
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name  HB2) 2.634 0.867 0.867 weight 1.000 ! spec=Noesy, no=85, id=84, vol=5.877434e+06
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   14 and name  HB2) 2.277 0.648 0.648 weight 1.000 ! spec=Noesy, no=86, id=85, vol=1.283680e+07
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   14 and name  HB2)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name  HG1) 2.495 0.778 0.778 weight 1.000 ! spec=Noesy, no=87, id=86, vol=7.218778e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HB2) 2.691 0.905 0.905 weight 1.000 ! spec=Noesy, no=88, id=87, vol=5.232282e+06
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   28 and name  HB2) 2.452 0.752 0.752 weight 1.000 ! spec=Noesy, no=89, id=88, vol=7.890938e+06
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   28 and name  HB2)
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    4 and name  HB1) 2.625 0.861 0.861 weight 1.000 ! spec=Noesy, no=91, id=90, vol=5.271548e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HB2) 2.823 0.996 0.996 weight 1.000 ! spec=Noesy, no=92, id=91, vol=3.935248e+06
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HB2) 2.770 0.959 0.959 weight 1.000 ! spec=Noesy, no=93, id=92, vol=4.552544e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name  HG2) 2.649 0.877 0.877 weight 1.000 ! spec=Noesy, no=94, id=93, vol=5.044936e+06
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   38 and name  HB2) 2.671 0.892 0.892 weight 1.000 ! spec=Noesy, no=95, id=94, vol=5.626470e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name  HB2) 2.631 2.631 3.369 weight 1.000 ! spec=Noesy, no=96, id=95, vol=5.283834e+06
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name  HB2) 2.818 0.993 0.993 weight 1.000 ! spec=Noesy, no=97, id=96, vol=3.046448e+06
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   22 and name  HG2) 2.729 0.931 0.931 weight 1.000 ! spec=Noesy, no=98, id=97, vol=4.170884e+06
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   22 and name  HG2)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name  HB1) 2.327 0.677 0.677 weight 1.000 ! spec=Noesy, no=99, id=98, vol=1.113952e+07
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name   HB) 2.164 0.585 0.585 weight 1.000 ! spec=Noesy, no=100, id=99, vol=1.362679e+07
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name   HB) 2.518 2.518 3.482 weight 1.000 ! spec=Noesy, no=101, id=100, vol=6.126848e+06
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name  HB1) 2.689 0.904 0.904 weight 1.000 ! spec=Noesy, no=102, id=101, vol=3.965480e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HB1) 2.675 0.895 0.895 weight 1.000 ! spec=Noesy, no=103, id=102, vol=4.407304e+06
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name  HB1) 2.892 1.045 1.045 weight 1.000 ! spec=Noesy, no=104, id=103, vol=3.874006e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name   HB) 2.632 2.632 3.368 weight 1.000 ! spec=Noesy, no=105, id=104, vol=6.614134e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name   HB) 2.816 0.991 0.991 weight 1.000 ! spec=Noesy, no=107, id=106, vol=3.985622e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name   HB) 2.419 0.731 0.731 weight 1.000 ! spec=Noesy, no=108, id=107, vol=8.618404e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name   HB) 2.664 2.664 3.336 weight 1.000 ! spec=Noesy, no=109, id=108, vol=6.187700e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HB2) 2.599 2.599 3.401 weight 1.000 ! spec=Noesy, no=110, id=109, vol=5.512476e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name   HB) 2.300 0.661 0.661 weight 1.000 ! spec=Noesy, no=112, id=111, vol=1.307241e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name   HB) 2.592 2.592 3.408 weight 1.000 ! spec=Noesy, no=113, id=112, vol=4.451706e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name  HB1) 2.843 1.010 1.010 weight 1.000 ! spec=Noesy, no=114, id=113, vol=2.995008e+06
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HB2) 2.563 0.821 0.821 weight 1.000 ! spec=Noesy, no=115, id=114, vol=5.760502e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HB2) 2.422 0.733 0.733 weight 1.000 ! spec=Noesy, no=116, id=115, vol=9.391188e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name  HB2) 2.582 2.582 3.418 weight 1.000 ! spec=Noesy, no=117, id=116, vol=4.699660e+06
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name  HB2) 2.846 2.846 3.154 weight 1.000 ! spec=Noesy, no=118, id=117, vol=3.924462e+06
assign (segid "   A" and resid    3 and name   HE) (segid "   A" and resid    3 and name  HB2) 2.851 1.016 1.016 weight 1.000 ! spec=Noesy, no=119, id=118, vol=3.383376e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HB1) 2.293 0.657 0.657 weight 1.000 ! spec=Noesy, no=120, id=119, vol=1.181753e+07
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HB2) 2.325 2.325 3.675 weight 1.000 ! spec=Noesy, no=122, id=121, vol=1.020295e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HB2) 2.792 2.792 3.208 weight 1.000 ! spec=Noesy, no=124, id=123, vol=2.731250e+06
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    1 and name  HB1) 2.839 1.007 1.007 weight 1.000 ! spec=Noesy, no=125, id=124, vol=2.946296e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HG12) 2.687 0.903 0.903 weight 1.000 ! spec=Noesy, no=127, id=126, vol=5.240710e+06
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name HG12) 2.692 0.906 0.906 weight 1.000 ! spec=Noesy, no=128, id=127, vol=3.531150e+06
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid    2 and name  HG2) 2.825 0.997 0.997 weight 1.000 ! spec=Noesy, no=129, id=128, vol=3.106036e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    2 and name  HG2) 2.576 2.576 3.424 weight 1.000 ! spec=Noesy, no=130, id=129, vol=5.832544e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HG2) 2.804 0.982 0.982 weight 1.000 ! spec=Noesy, no=131, id=130, vol=3.462362e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HG1) 2.798 0.978 0.978 weight 1.000 ! spec=Noesy, no=133, id=132, vol=3.563880e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   27 and name  HB3) 2.842 1.009 1.009 weight 1.000 ! spec=Noesy, no=135, id=134, vol=2.903488e+06
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB3) 1.859 0.432 0.432 weight 1.000 ! spec=Noesy, no=136, id=135, vol=3.830230e+07
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name  HB1) 2.237 0.626 0.626 weight 1.000 ! spec=Noesy, no=137, id=136, vol=1.537244e+07
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HB1) 2.811 0.988 0.988 weight 1.000 ! spec=Noesy, no=139, id=138, vol=3.931454e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HB1) 2.644 0.874 0.874 weight 1.000 ! spec=Noesy, no=140, id=139, vol=6.266722e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   37 and name HG21) 2.875 1.033 1.033 weight 1.000 ! spec=Noesy, no=141, id=140, vol=3.427608e+06
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HG21) 2.332 0.680 0.680 weight 1.000 ! spec=Noesy, no=142, id=141, vol=1.286795e+07
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HG11) 2.455 0.753 0.753 weight 1.000 ! spec=Noesy, no=143, id=142, vol=8.987724e+06
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name HG13) 2.062 0.532 0.532 weight 1.000 ! spec=Noesy, no=144, id=143, vol=1.789604e+07
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name HG11)
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name HG12)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name HG13) 2.716 0.922 0.922 weight 1.000 ! spec=Noesy, no=145, id=144, vol=3.844386e+06
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name HG11)
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name HG12)
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name HG21) 2.590 2.590 3.410 weight 1.000 ! spec=Noesy, no=146, id=145, vol=4.614102e+06
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name HG22)
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name HG23)
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name HG12) 2.461 0.757 0.757 weight 1.000 ! spec=Noesy, no=147, id=146, vol=7.284648e+06
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name HG11)
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name HG13)
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   40 and name HG12) 2.744 0.941 0.941 weight 1.000 ! spec=Noesy, no=149, id=148, vol=3.311474e+06
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   40 and name HG13)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   40 and name HG12)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   40 and name HG12) 2.789 2.789 3.211 weight 1.000 ! spec=Noesy, no=150, id=149, vol=3.727288e+06
    or (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   40 and name HG13)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   40 and name HG12)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HG21) 2.516 0.791 0.791 weight 1.000 ! spec=Noesy, no=151, id=150, vol=7.501020e+06
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HG23)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HG22)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HG21) 2.817 2.817 3.183 weight 1.000 ! spec=Noesy, no=152, id=151, vol=3.815872e+06
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HG23)
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HG22)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name HG21) 2.831 2.831 3.169 weight 1.000 ! spec=Noesy, no=153, id=152, vol=2.581710e+06
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name HG23)
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name HG22)
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   16 and name HG21) 2.410 0.726 0.726 weight 1.000 ! spec=Noesy, no=154, id=153, vol=9.081022e+06
    or (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   16 and name HG23)
    or (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   16 and name HG22)
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   16 and name HG21)
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   16 and name HG23)
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   16 and name HG22)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   16 and name HG21) 2.328 0.677 0.677 weight 1.000 ! spec=Noesy, no=155, id=154, vol=1.171574e+07
    or (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   16 and name HG23)
    or (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   16 and name HG22)
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   16 and name HG21)
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   16 and name HG23)
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   16 and name HG22)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name HG21) 2.397 0.718 0.718 weight 1.000 ! spec=Noesy, no=156, id=155, vol=1.199913e+07
    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 "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name HG21) 2.407 0.724 0.724 weight 1.000 ! spec=Noesy, no=157, id=156, vol=1.011990e+07
    or (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name HG22)
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   40 and name HG21) 2.730 0.932 0.932 weight 1.000 ! spec=Noesy, no=158, id=157, vol=4.365238e+06
    or (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   40 and name HG23)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   40 and name HG21)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name HD13) 2.775 0.963 0.963 weight 1.000 ! spec=Noesy, no=159, id=158, vol=2.849544e+06
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name HD11)
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name HD12)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   15 and name   HA) 3.419 1.461 1.461 weight 1.000 ! spec=Noesy, no=160, id=159, vol=2.243876e+06
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name   HA) 2.986 1.114 1.114 weight 1.000 ! spec=Noesy, no=161, id=160, vol=3.710572e+06
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   39 and name   HA) 3.237 1.310 1.310 weight 1.000 ! spec=Noesy, no=162, id=161, vol=1.697110e+06
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   38 and name   HA) 3.201 1.281 1.281 weight 1.000 ! spec=Noesy, no=163, id=162, vol=1.758864e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name   HA) 3.100 1.201 1.201 weight 1.000 ! spec=Noesy, no=164, id=163, vol=2.232234e+06
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name   HA) 2.894 1.047 1.047 weight 1.000 ! spec=Noesy, no=165, id=164, vol=3.387762e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name   HA) 2.953 1.090 1.090 weight 1.000 ! spec=Noesy, no=166, id=165, vol=2.312884e+06
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name   HA) 3.588 1.609 1.609 weight 1.000 ! spec=Noesy, no=167, id=166, vol=1.099382e+06
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name   HA)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name   HA) 2.931 1.074 1.074 weight 1.000 ! spec=Noesy, no=168, id=167, vol=2.676066e+06
assign (segid "   A" and resid   12 and name  HD2) (segid "   A" and resid   11 and name   HA) 3.043 1.157 1.157 weight 1.000 ! spec=Noesy, no=169, id=168, vol=8.594360e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   40 and name   HA) 3.310 1.369 1.369 weight 1.000 ! spec=Noesy, no=170, id=169, vol=1.348446e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   30 and name   HB) 3.091 3.091 2.909 weight 1.000 ! spec=Noesy, no=171, id=170, vol=2.204252e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   30 and name   HB) 3.305 1.366 1.366 weight 1.000 ! spec=Noesy, no=172, id=171, vol=1.380216e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   17 and name   HA) 3.222 1.298 1.298 weight 1.000 ! spec=Noesy, no=173, id=172, vol=1.964524e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   18 and name   HA) 3.103 1.204 1.204 weight 1.000 ! spec=Noesy, no=174, id=173, vol=2.283822e+06
assign (segid "   A" and resid   12 and name  HD2) (segid "   A" and resid   12 and name   HA) 3.114 3.114 2.886 weight 1.000 ! spec=Noesy, no=175, id=174, vol=8.081020e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name   HA) 2.956 1.092 1.092 weight 1.000 ! spec=Noesy, no=176, id=175, vol=2.144708e+06
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    8 and name   HA) 3.132 1.226 1.226 weight 1.000 ! spec=Noesy, no=177, id=176, vol=2.116082e+06
assign (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid    8 and name   HA) 2.982 1.111 1.111 weight 1.000 ! spec=Noesy, no=178, id=177, vol=2.779992e+06
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid    8 and name   HA)
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name   HA) 3.153 1.242 1.242 weight 1.000 ! spec=Noesy, no=179, id=178, vol=1.939206e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   31 and name   HA) 3.036 1.152 1.152 weight 1.000 ! spec=Noesy, no=180, id=179, vol=2.232884e+06
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name   HA) 3.043 1.158 1.158 weight 1.000 ! spec=Noesy, no=181, id=180, vol=3.104038e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   32 and name   HA) 3.203 3.203 2.797 weight 1.000 ! spec=Noesy, no=182, id=181, vol=1.632232e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name  HB1) 3.048 1.161 1.161 weight 1.000 ! spec=Noesy, no=183, id=182, vol=2.050416e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   18 and name  HB1) 3.366 1.416 1.416 weight 1.000 ! spec=Noesy, no=184, id=183, vol=1.329956e+06
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid    2 and name   HA) 3.030 1.148 1.148 weight 1.000 ! spec=Noesy, no=185, id=184, vol=1.877268e+06
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    7 and name   HA) 2.979 1.109 1.109 weight 1.000 ! spec=Noesy, no=186, id=185, vol=2.213378e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name   HA) 2.886 1.041 1.041 weight 1.000 ! spec=Noesy, no=188, id=187, vol=2.861496e+06
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    6 and name   HA) 2.942 1.082 1.082 weight 1.000 ! spec=Noesy, no=189, id=188, vol=2.161876e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid    9 and name   HA) 3.210 1.288 1.288 weight 1.000 ! spec=Noesy, no=191, id=190, vol=1.633012e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   34 and name   HA) 3.121 1.217 1.217 weight 1.000 ! spec=Noesy, no=192, id=191, vol=2.566846e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name  HB1) 3.411 1.454 1.454 weight 1.000 ! spec=Noesy, no=193, id=192, vol=1.036218e+06
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   34 and name   HA) 3.097 3.097 2.903 weight 1.000 ! spec=Noesy, no=194, id=193, vol=2.295254e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name  HB2) 3.107 1.206 1.206 weight 1.000 ! spec=Noesy, no=195, id=194, vol=1.929474e+06
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name  HB1) 3.325 1.382 1.382 weight 1.000 ! spec=Noesy, no=198, id=197, vol=1.547532e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   38 and name  HB1) 3.251 1.321 1.321 weight 1.000 ! spec=Noesy, no=202, id=201, vol=1.796666e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   25 and name  HB2) 3.022 1.142 1.142 weight 1.000 ! spec=Noesy, no=203, id=202, vol=3.382798e+06
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HB2) 3.356 1.408 1.408 weight 1.000 ! spec=Noesy, no=204, id=203, vol=1.313580e+06
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name  HB2)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HB1) 3.187 1.269 1.269 weight 1.000 ! spec=Noesy, no=205, id=204, vol=1.896490e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   11 and name  HB2) 3.170 3.170 2.830 weight 1.000 ! spec=Noesy, no=206, id=205, vol=1.811190e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name  HB2) 3.252 1.322 1.322 weight 1.000 ! spec=Noesy, no=207, id=206, vol=1.498900e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HB1) 2.910 1.058 1.058 weight 1.000 ! spec=Noesy, no=208, id=207, vol=3.132138e+06
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name  HB1) 3.045 1.159 1.159 weight 1.000 ! spec=Noesy, no=209, id=208, vol=2.439472e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HD2) 2.929 2.929 3.071 weight 1.000 ! spec=Noesy, no=210, id=209, vol=2.645486e+06
assign (segid "   A" and resid   17 and name   HE) (segid "   A" and resid   36 and name  HE2) 3.342 1.396 1.396 weight 1.000 ! spec=Noesy, no=211, id=210, vol=1.148698e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    4 and name  HB2) 2.943 1.083 1.083 weight 1.000 ! spec=Noesy, no=212, id=211, vol=2.700264e+06
assign (segid "   A" and resid   35 and name HE22) (segid "   A" and resid   35 and name  HG1) 3.029 1.147 1.147 weight 1.000 ! spec=Noesy, no=213, id=212, vol=1.847318e+06
assign (segid "   A" and resid   35 and name HE21) (segid "   A" and resid   35 and name  HG1) 3.258 1.327 1.327 weight 1.000 ! spec=Noesy, no=214, id=213, vol=8.867800e+05
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HB2) 3.413 1.456 1.456 weight 1.000 ! spec=Noesy, no=215, id=214, vol=1.136730e+06
assign (segid "   A" and resid   35 and name HE22) (segid "   A" and resid   35 and name  HG2) 3.149 1.239 1.239 weight 1.000 ! spec=Noesy, no=220, id=219, vol=1.382928e+06
assign (segid "   A" and resid   35 and name HE21) (segid "   A" and resid   35 and name  HG2) 3.362 1.413 1.413 weight 1.000 ! spec=Noesy, no=221, id=220, vol=7.325420e+05
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HB1) 3.007 1.130 1.130 weight 1.000 ! spec=Noesy, no=222, id=221, vol=3.778686e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   39 and name  HB1) 3.022 1.142 1.142 weight 1.000 ! spec=Noesy, no=223, id=222, vol=2.846714e+06
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   39 and name  HB1) 3.327 1.384 1.384 weight 1.000 ! spec=Noesy, no=224, id=223, vol=1.493966e+06
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   39 and name  HB1) 3.122 1.218 1.218 weight 1.000 ! spec=Noesy, no=225, id=224, vol=1.827510e+06
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   39 and name  HB1)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   39 and name  HB1) 3.219 1.295 1.295 weight 1.000 ! spec=Noesy, no=226, id=225, vol=1.646722e+06
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   39 and name  HB1)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   38 and name  HB2) 3.408 1.451 1.451 weight 1.000 ! spec=Noesy, no=227, id=226, vol=8.234600e+05
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HB1) 3.406 1.450 1.450 weight 1.000 ! spec=Noesy, no=228, id=227, vol=1.217116e+06
assign (segid "   A" and resid   34 and name   HE) (segid "   A" and resid   34 and name  HB1) 3.402 1.447 1.447 weight 1.000 ! spec=Noesy, no=229, id=228, vol=1.151542e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name  HB2) 3.247 1.318 1.318 weight 1.000 ! spec=Noesy, no=230, id=229, vol=1.804038e+06
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   22 and name  HG1) 3.348 3.348 2.652 weight 1.000 ! spec=Noesy, no=231, id=230, vol=1.188630e+06
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   22 and name  HG1)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name  HB1) 2.970 1.103 1.103 weight 1.000 ! spec=Noesy, no=232, id=231, vol=3.056058e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HB2) 3.288 1.351 1.351 weight 1.000 ! spec=Noesy, no=233, id=232, vol=1.525426e+06
assign (segid "   A" and resid   34 and name   HE) (segid "   A" and resid   34 and name  HB2) 3.411 1.454 1.454 weight 1.000 ! spec=Noesy, no=234, id=233, vol=8.102060e+05
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   22 and name  HB1) 3.088 1.192 1.192 weight 1.000 ! spec=Noesy, no=235, id=234, vol=1.868250e+06
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   22 and name  HB1)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HB1) 2.992 2.992 3.008 weight 1.000 ! spec=Noesy, no=236, id=235, vol=1.825222e+06
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   40 and name   HB) 3.319 1.377 1.377 weight 1.000 ! spec=Noesy, no=237, id=236, vol=1.283502e+06
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   40 and name   HB)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   16 and name   HB) 3.253 1.323 1.323 weight 1.000 ! spec=Noesy, no=240, id=239, vol=1.651648e+06
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   16 and name   HB)
assign (segid "   A" and resid    3 and name   HE) (segid "   A" and resid    3 and name  HB1) 3.016 1.137 1.137 weight 1.000 ! spec=Noesy, no=241, id=240, vol=2.476954e+06
assign (segid "   A" and resid   33 and name  HZ3) (segid "   A" and resid    3 and name  HB1) 3.222 1.298 1.298 weight 1.000 ! spec=Noesy, no=242, id=241, vol=1.618684e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   39 and name  HB2) 3.130 1.225 1.225 weight 1.000 ! spec=Noesy, no=243, id=242, vol=2.106180e+06
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   39 and name  HB2) 3.395 1.441 1.441 weight 1.000 ! spec=Noesy, no=244, id=243, vol=1.000966e+06
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   39 and name  HB2)
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   39 and name  HB2) 3.257 1.326 1.326 weight 1.000 ! spec=Noesy, no=245, id=244, vol=1.525362e+06
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   39 and name  HB2)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   39 and name  HB2) 3.217 1.294 1.294 weight 1.000 ! spec=Noesy, no=246, id=245, vol=1.785570e+06
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   39 and name  HB2)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   36 and name  HB2) 2.911 1.059 1.059 weight 1.000 ! spec=Noesy, no=247, id=246, vol=3.240868e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HB2) 3.092 1.195 1.195 weight 1.000 ! spec=Noesy, no=248, id=247, vol=2.387200e+06
assign (segid "   A" and resid   33 and name  HZ3) (segid "   A" and resid    3 and name  HB2) 3.001 1.126 1.126 weight 1.000 ! spec=Noesy, no=249, id=248, vol=2.500334e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HB1) 2.955 1.091 1.091 weight 1.000 ! spec=Noesy, no=250, id=249, vol=2.977806e+06
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HG2) 3.159 1.247 1.247 weight 1.000 ! spec=Noesy, no=251, id=250, vol=1.661148e+06
assign (segid "   A" and resid   17 and name   HE) (segid "   A" and resid   17 and name  HB2) 3.394 1.440 1.440 weight 1.000 ! spec=Noesy, no=252, id=251, vol=9.773260e+05
assign (segid "   A" and resid    7 and name   HE) (segid "   A" and resid    7 and name  HG2) 3.290 1.353 1.353 weight 1.000 ! spec=Noesy, no=253, id=252, vol=2.546228e+06
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid    7 and name  HG2) 3.139 1.232 1.232 weight 1.000 ! spec=Noesy, no=254, id=253, vol=2.086876e+06
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid    7 and name  HG2)
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid    2 and name  HG1) 3.428 1.469 1.469 weight 1.000 ! spec=Noesy, no=257, id=256, vol=9.358580e+05
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid    2 and name  HG1) 3.362 1.413 1.413 weight 1.000 ! spec=Noesy, no=260, id=259, vol=1.179602e+06
assign (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid    7 and name  HG1) 3.205 1.284 1.284 weight 1.000 ! spec=Noesy, no=261, id=260, vol=2.392694e+06
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid    7 and name  HG1)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HG1) 3.424 1.465 1.465 weight 1.000 ! spec=Noesy, no=262, id=261, vol=1.056354e+06
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid    7 and name  HG1) 3.241 1.313 1.313 weight 1.000 ! spec=Noesy, no=263, id=262, vol=1.734650e+06
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid    7 and name  HG1)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   16 and name HG12) 3.275 1.341 1.341 weight 1.000 ! spec=Noesy, no=264, id=263, vol=1.544932e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HG12) 3.152 1.242 1.242 weight 1.000 ! spec=Noesy, no=265, id=264, vol=1.623850e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    2 and name  HB1) 2.938 1.079 1.079 weight 1.000 ! spec=Noesy, no=266, id=265, vol=1.649494e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HG1) 3.018 1.139 1.139 weight 1.000 ! spec=Noesy, no=267, id=266, vol=2.510054e+06
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    1 and name  HB2) 3.221 1.297 1.297 weight 1.000 ! spec=Noesy, no=268, id=267, vol=1.167458e+06
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   27 and name  HB3) 3.201 1.281 1.281 weight 1.000 ! spec=Noesy, no=269, id=268, vol=1.528806e+06
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   26 and name  HB1) 3.270 1.337 1.337 weight 1.000 ! spec=Noesy, no=270, id=269, vol=1.414472e+06
    or (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG22) 3.058 1.169 1.169 weight 1.000 ! spec=Noesy, no=274, id=273, vol=2.028638e+06
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name HG21)
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    5 and name HG22) 3.037 1.153 1.153 weight 1.000 ! spec=Noesy, no=275, id=274, vol=1.823074e+06
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    5 and name HG21)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   36 and name  HB1) 3.400 1.445 1.445 weight 1.000 ! spec=Noesy, no=276, id=275, vol=1.278174e+06
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   36 and name  HB1) 3.401 1.446 1.446 weight 1.000 ! spec=Noesy, no=277, id=276, vol=1.119982e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HG21) 3.117 1.215 1.215 weight 1.000 ! spec=Noesy, no=278, id=277, vol=1.961272e+06
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   37 and name HG21) 3.270 1.337 1.337 weight 1.000 ! spec=Noesy, no=279, id=278, vol=1.222514e+06
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   37 and name HG21) 3.359 1.410 1.410 weight 1.000 ! spec=Noesy, no=280, id=279, vol=1.006240e+06
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HG11) 3.284 1.348 1.348 weight 1.000 ! spec=Noesy, no=281, id=280, vol=1.232680e+06
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name HG11) 3.113 1.211 1.211 weight 1.000 ! spec=Noesy, no=282, id=281, vol=1.468394e+06
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name HG21) 2.896 1.049 1.049 weight 1.000 ! spec=Noesy, no=287, id=286, vol=2.591770e+06
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name HG22)
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name HG23)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   40 and name HG12) 3.139 1.231 1.231 weight 1.000 ! spec=Noesy, no=288, id=287, vol=1.966724e+06
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   40 and name HG12) 3.257 1.326 1.326 weight 1.000 ! spec=Noesy, no=289, id=288, vol=1.816908e+06
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   40 and name HG21) 3.073 1.180 1.180 weight 1.000 ! spec=Noesy, no=291, id=290, vol=2.348292e+06
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   20 and name HG21) 3.109 1.208 1.208 weight 1.000 ! spec=Noesy, no=292, id=291, vol=1.958630e+06
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   20 and name HG22)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   40 and name HG21) 3.393 3.393 2.607 weight 1.000 ! spec=Noesy, no=293, id=292, vol=1.216482e+06
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid    2 and name  HB2) 3.323 1.380 1.380 weight 1.000 ! spec=Noesy, no=294, id=293, vol=1.102952e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    2 and name  HB2) 3.381 1.429 1.429 weight 1.000 ! spec=Noesy, no=295, id=294, vol=1.137986e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    2 and name  HB2) 3.284 1.348 1.348 weight 1.000 ! spec=Noesy, no=296, id=295, vol=1.393136e+06
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid    2 and name  HB2) 3.385 1.433 1.433 weight 1.000 ! spec=Noesy, no=297, id=296, vol=1.047106e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   15 and name   HA) 3.687 1.699 1.699 weight 1.000 ! spec=Noesy, no=298, id=297, vol=7.152440e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name   HA) 3.706 1.716 1.716 weight 1.000 ! spec=Noesy, no=299, id=298, vol=7.050500e+05
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   15 and name   HA) 3.982 1.982 1.982 weight 1.000 ! spec=Noesy, no=300, id=299, vol=4.815120e+05
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   15 and name   HA) 3.789 1.794 1.794 weight 1.000 ! spec=Noesy, no=301, id=300, vol=5.985840e+05
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   15 and name   HA)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   39 and name   HA) 3.887 1.888 1.888 weight 1.000 ! spec=Noesy, no=302, id=301, vol=5.173120e+05
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   39 and name   HA) 3.783 1.789 1.789 weight 1.000 ! spec=Noesy, no=303, id=302, vol=5.109600e+05
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   39 and name   HA) 3.893 1.894 1.894 weight 1.000 ! spec=Noesy, no=304, id=303, vol=5.162980e+05
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   39 and name   HA)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   30 and name   HA) 4.067 2.067 2.067 weight 1.000 ! spec=Noesy, no=305, id=304, vol=4.013680e+05
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   30 and name   HA) 3.785 1.791 1.791 weight 1.000 ! spec=Noesy, no=306, id=305, vol=7.411840e+05
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   38 and name   HA) 3.970 1.971 1.971 weight 1.000 ! spec=Noesy, no=307, id=306, vol=3.769080e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   38 and name   HA) 3.574 1.596 1.596 weight 1.000 ! spec=Noesy, no=308, id=307, vol=8.668660e+05
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name   HA) 3.765 1.771 1.771 weight 1.000 ! spec=Noesy, no=309, id=308, vol=4.660760e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name   HA) 3.462 1.498 1.498 weight 1.000 ! spec=Noesy, no=310, id=309, vol=9.927860e+05
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name   HA) 4.042 2.042 2.042 weight 1.000 ! spec=Noesy, no=311, id=310, vol=2.562280e+05
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   14 and name   HA) 3.450 1.488 1.488 weight 1.000 ! spec=Noesy, no=312, id=311, vol=1.061798e+06
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   13 and name  HA1) 3.576 1.598 1.598 weight 1.000 ! spec=Noesy, no=313, id=312, vol=8.902200e+05
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   13 and name  HA1)
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   28 and name   HA) 3.899 1.900 1.900 weight 1.000 ! spec=Noesy, no=314, id=313, vol=4.949980e+05
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   28 and name   HA)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name   HA) 4.089 2.090 2.090 weight 1.000 ! spec=Noesy, no=315, id=314, vol=3.356180e+05
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid   11 and name   HA) 3.462 1.498 1.498 weight 1.000 ! spec=Noesy, no=316, id=315, vol=9.206900e+05
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid   11 and name   HA)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   40 and name   HA) 3.683 1.696 1.696 weight 1.000 ! spec=Noesy, no=317, id=316, vol=6.841460e+05
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   40 and name   HA) 3.656 1.671 1.671 weight 1.000 ! spec=Noesy, no=318, id=317, vol=7.829660e+05
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   40 and name   HA)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   30 and name   HB) 3.590 1.611 1.611 weight 1.000 ! spec=Noesy, no=319, id=318, vol=1.034496e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   17 and name   HA) 4.049 2.049 2.049 weight 1.000 ! spec=Noesy, no=320, id=319, vol=3.973580e+05
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   23 and name   HA) 3.575 1.597 1.597 weight 1.000 ! spec=Noesy, no=321, id=320, vol=7.305560e+05
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   23 and name   HA)
assign (segid "   A" and resid   12 and name  HE1) (segid "   A" and resid   12 and name   HA) 3.914 1.915 1.915 weight 1.000 ! spec=Noesy, no=322, id=321, vol=2.386980e+05
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name   HA) 3.462 1.498 1.498 weight 1.000 ! spec=Noesy, no=323, id=322, vol=1.053262e+06
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    8 and name   HA) 3.685 1.697 1.697 weight 1.000 ! spec=Noesy, no=324, id=323, vol=6.186040e+05
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid    8 and name   HA) 3.774 1.781 1.781 weight 1.000 ! spec=Noesy, no=325, id=324, vol=5.487120e+05
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid    8 and name   HA)
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid    8 and name   HA) 3.710 1.721 1.721 weight 1.000 ! spec=Noesy, no=326, id=325, vol=7.540740e+05
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid    8 and name   HA) 4.009 2.009 2.009 weight 1.000 ! spec=Noesy, no=327, id=326, vol=4.272060e+05
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid    8 and name   HA)
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid    8 and name   HA) 3.760 1.767 1.767 weight 1.000 ! spec=Noesy, no=328, id=327, vol=6.267580e+05
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid    8 and name   HA)
assign (segid "   A" and resid   35 and name HE22) (segid "   A" and resid   35 and name   HA) 3.788 1.793 1.793 weight 1.000 ! spec=Noesy, no=329, id=328, vol=3.351100e+05
assign (segid "   A" and resid    7 and name   HE) (segid "   A" and resid    4 and name   HA) 4.075 2.076 2.076 weight 1.000 ! spec=Noesy, no=330, id=329, vol=3.513920e+05
assign (segid "   A" and resid   33 and name  HZ3) (segid "   A" and resid   33 and name   HA) 3.721 1.730 1.730 weight 1.000 ! spec=Noesy, no=331, id=330, vol=6.005500e+05
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    5 and name   HB) 3.780 1.786 1.786 weight 1.000 ! spec=Noesy, no=332, id=331, vol=5.347480e+05
assign (segid "   A" and resid   33 and name  HH2) (segid "   A" and resid    2 and name   HA) 3.537 1.564 1.564 weight 1.000 ! spec=Noesy, no=333, id=332, vol=9.513840e+05
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid    2 and name   HA) 3.604 1.623 1.623 weight 1.000 ! spec=Noesy, no=334, id=333, vol=6.400900e+05
assign (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid    7 and name   HA) 3.852 1.855 1.855 weight 1.000 ! spec=Noesy, no=335, id=334, vol=7.255180e+05
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid    7 and name   HA)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name   HA) 3.462 1.498 1.498 weight 1.000 ! spec=Noesy, no=337, id=336, vol=8.575380e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    6 and name   HA) 3.890 1.892 1.892 weight 1.000 ! spec=Noesy, no=338, id=337, vol=1.652460e+05
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   22 and name  HD2) 3.847 1.850 1.850 weight 1.000 ! spec=Noesy, no=339, id=338, vol=5.623340e+05
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   22 and name  HD2)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB2) 3.862 1.865 1.865 weight 1.000 ! spec=Noesy, no=340, id=339, vol=3.394100e+05
assign (segid "   A" and resid   35 and name HE21) (segid "   A" and resid   33 and name  HB2) 4.024 2.025 2.025 weight 1.000 ! spec=Noesy, no=341, id=340, vol=2.458720e+05
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   13 and name  HA2) 3.655 1.670 1.670 weight 1.000 ! spec=Noesy, no=342, id=341, vol=7.524220e+05
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   13 and name  HA2)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name  HB1) 3.786 1.792 1.792 weight 1.000 ! spec=Noesy, no=343, id=342, vol=8.228880e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   32 and name  HB1) 3.764 1.771 1.771 weight 1.000 ! spec=Noesy, no=345, id=344, vol=5.139960e+05
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid   32 and name  HB1) 3.724 1.733 1.733 weight 1.000 ! spec=Noesy, no=346, id=345, vol=5.122980e+05
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name  HB1) 3.521 1.550 1.550 weight 1.000 ! spec=Noesy, no=347, id=346, vol=9.858560e+05
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   11 and name  HB1) 3.520 3.520 2.480 weight 1.000 ! spec=Noesy, no=348, id=347, vol=8.889120e+05
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   11 and name  HB1) 3.725 1.734 1.734 weight 1.000 ! spec=Noesy, no=349, id=348, vol=6.338120e+05
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   11 and name  HB1)
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid   11 and name  HB1) 3.504 1.535 1.535 weight 1.000 ! spec=Noesy, no=350, id=349, vol=9.238500e+05
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid   11 and name  HB1)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HD1) 3.539 3.539 2.461 weight 1.000 ! spec=Noesy, no=351, id=350, vol=7.708660e+05
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name  HD2) 4.158 2.161 2.161 weight 1.000 ! spec=Noesy, no=352, id=351, vol=4.619260e+05
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   25 and name  HB1) 3.531 1.559 1.559 weight 1.000 ! spec=Noesy, no=354, id=353, vol=1.088960e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   25 and name  HB1) 3.901 3.901 2.099 weight 1.000 ! spec=Noesy, no=355, id=354, vol=4.249380e+05
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   31 and name  HB2) 3.898 1.899 1.899 weight 1.000 ! spec=Noesy, no=362, id=361, vol=5.934360e+05
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   31 and name  HB2) 3.862 1.865 1.865 weight 1.000 ! spec=Noesy, no=363, id=362, vol=6.308320e+05
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HB1) 3.672 1.686 1.686 weight 1.000 ! spec=Noesy, no=365, id=364, vol=5.654780e+05
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   28 and name  HB1) 3.576 1.599 1.599 weight 1.000 ! spec=Noesy, no=366, id=365, vol=7.982100e+05
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   28 and name  HB1)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name  HB2) 3.719 1.729 1.729 weight 1.000 ! spec=Noesy, no=367, id=366, vol=5.547140e+05
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid   11 and name  HB2) 3.486 1.519 1.519 weight 1.000 ! spec=Noesy, no=368, id=367, vol=8.563720e+05
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid   11 and name  HB2)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   36 and name  HE1) 4.278 2.288 2.288 weight 1.000 ! spec=Noesy, no=369, id=368, vol=2.632600e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name  HB2) 3.611 1.630 1.630 weight 1.000 ! spec=Noesy, no=371, id=370, vol=5.321900e+05
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   28 and name  HB2) 4.470 2.497 2.497 weight 1.000 ! spec=Noesy, no=372, id=371, vol=2.309720e+05
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   28 and name  HB2) 3.678 1.691 1.691 weight 1.000 ! spec=Noesy, no=373, id=372, vol=6.452540e+05
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   28 and name  HB2)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name  HB1) 3.582 1.604 1.604 weight 1.000 ! spec=Noesy, no=375, id=374, vol=7.578140e+05
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   15 and name  HB2) 3.892 1.894 1.894 weight 1.000 ! spec=Noesy, no=376, id=375, vol=6.038060e+05
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name  HG2) 3.500 1.531 1.531 weight 1.000 ! spec=Noesy, no=377, id=376, vol=1.139044e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   39 and name  HB1) 3.802 1.807 1.807 weight 1.000 ! spec=Noesy, no=378, id=377, vol=5.372580e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   39 and name  HB1) 3.530 1.558 1.558 weight 1.000 ! spec=Noesy, no=379, id=378, vol=8.952360e+05
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   39 and name  HB1) 4.027 2.027 2.027 weight 1.000 ! spec=Noesy, no=380, id=379, vol=4.390760e+05
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   39 and name  HB1)
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   39 and name  HB1) 3.471 1.506 1.506 weight 1.000 ! spec=Noesy, no=381, id=380, vol=1.005724e+06
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   39 and name  HB1)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   38 and name  HB2) 3.610 1.629 1.629 weight 1.000 ! spec=Noesy, no=382, id=381, vol=8.605900e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HB1) 3.523 1.551 1.551 weight 1.000 ! spec=Noesy, no=383, id=382, vol=8.739540e+05
assign (segid "   A" and resid   35 and name HE22) (segid "   A" and resid   34 and name  HB1) 3.672 1.686 1.686 weight 1.000 ! spec=Noesy, no=384, id=383, vol=6.235000e+05
assign (segid "   A" and resid   35 and name HE21) (segid "   A" and resid   35 and name  HB2) 3.904 1.905 1.905 weight 1.000 ! spec=Noesy, no=385, id=384, vol=2.913000e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   22 and name  HG2) 4.021 2.021 2.021 weight 1.000 ! spec=Noesy, no=386, id=385, vol=4.015040e+05
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   22 and name  HG2) 3.467 1.502 1.502 weight 1.000 ! spec=Noesy, no=387, id=386, vol=9.265000e+05
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   22 and name  HG2)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name  HG1) 4.068 2.069 2.069 weight 1.000 ! spec=Noesy, no=388, id=387, vol=3.681740e+05
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   22 and name  HG1) 4.073 2.073 2.073 weight 1.000 ! spec=Noesy, no=389, id=388, vol=3.719760e+05
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   22 and name  HG1)
assign (segid "   A" and resid   35 and name HE22) (segid "   A" and resid   35 and name  HB1) 3.830 1.833 1.833 weight 1.000 ! spec=Noesy, no=390, id=389, vol=4.214220e+05
assign (segid "   A" and resid   35 and name HE21) (segid "   A" and resid   35 and name  HB1) 4.001 2.001 2.001 weight 1.000 ! spec=Noesy, no=391, id=390, vol=2.414540e+05
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid    9 and name   HB) 3.992 1.992 1.992 weight 1.000 ! spec=Noesy, no=392, id=391, vol=4.037340e+05
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    9 and name   HB) 3.898 1.899 1.899 weight 1.000 ! spec=Noesy, no=393, id=392, vol=5.781380e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   22 and name  HB1) 3.890 1.891 1.891 weight 1.000 ! spec=Noesy, no=394, id=393, vol=4.501020e+05
assign (segid "   A" and resid   17 and name   HE) (segid "   A" and resid   17 and name  HB1) 3.973 1.973 1.973 weight 1.000 ! spec=Noesy, no=395, id=394, vol=4.851880e+05
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   40 and name   HB) 3.598 1.619 1.619 weight 1.000 ! spec=Noesy, no=396, id=395, vol=9.108920e+05
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   16 and name   HB) 3.467 1.503 1.503 weight 1.000 ! spec=Noesy, no=398, id=397, vol=1.033352e+06
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   16 and name   HB)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    3 and name  HB1) 4.026 2.026 2.026 weight 1.000 ! spec=Noesy, no=400, id=399, vol=5.340640e+05
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   39 and name  HB2) 3.531 1.559 1.559 weight 1.000 ! spec=Noesy, no=401, id=400, vol=1.135442e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HB2) 3.466 1.502 1.502 weight 1.000 ! spec=Noesy, no=402, id=401, vol=9.555240e+05
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   39 and name  HB2) 3.948 1.948 1.948 weight 1.000 ! spec=Noesy, no=403, id=402, vol=5.517320e+05
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   36 and name  HB2) 3.550 1.575 1.575 weight 1.000 ! spec=Noesy, no=404, id=403, vol=9.598380e+05
assign (segid "   A" and resid   33 and name  HE3) (segid "   A" and resid    3 and name  HB2) 4.236 2.243 2.243 weight 1.000 ! spec=Noesy, no=405, id=404, vol=5.999420e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    3 and name  HB2) 3.906 1.907 1.907 weight 1.000 ! spec=Noesy, no=406, id=405, vol=5.612820e+05
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name  HG2) 3.770 1.777 1.777 weight 1.000 ! spec=Noesy, no=407, id=406, vol=3.716240e+05
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name  HG2) 4.057 2.058 2.058 weight 1.000 ! spec=Noesy, no=412, id=411, vol=4.092160e+05
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid    2 and name  HB1) 3.709 1.720 1.720 weight 1.000 ! spec=Noesy, no=413, id=412, vol=5.873200e+05
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name  HG2) 3.948 1.948 1.948 weight 1.000 ! spec=Noesy, no=414, id=413, vol=5.706420e+05
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid    2 and name  HB1) 3.803 1.808 1.808 weight 1.000 ! spec=Noesy, no=415, id=414, vol=4.228400e+05
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HG2) 3.929 1.930 1.930 weight 1.000 ! spec=Noesy, no=416, id=415, vol=5.389600e+05
assign (segid "   A" and resid   34 and name   HE) (segid "   A" and resid   34 and name  HG1) 3.547 1.573 1.573 weight 1.000 ! spec=Noesy, no=418, id=417, vol=8.220520e+05
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name  HG1) 3.872 1.874 1.874 weight 1.000 ! spec=Noesy, no=419, id=418, vol=5.559960e+05
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HG1) 3.938 1.939 1.939 weight 1.000 ! spec=Noesy, no=420, id=419, vol=5.659940e+05
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   27 and name  HB3) 3.680 1.693 1.693 weight 1.000 ! spec=Noesy, no=421, id=420, vol=7.888940e+05
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   26 and name  HB1) 3.533 1.561 1.561 weight 1.000 ! spec=Noesy, no=422, id=421, vol=9.698300e+05
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   26 and name  HB1) 3.955 3.955 2.045 weight 1.000 ! spec=Noesy, no=423, id=422, vol=5.843740e+05
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid    7 and name  HG1) 4.409 2.430 2.430 weight 1.000 ! spec=Noesy, no=424, id=423, vol=2.541300e+05
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid    7 and name  HG1)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    5 and name HG22) 4.000 2.000 2.000 weight 1.000 ! spec=Noesy, no=428, id=427, vol=3.581440e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    5 and name HG21)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   36 and name  HB1) 3.644 1.660 1.660 weight 1.000 ! spec=Noesy, no=429, id=428, vol=7.525960e+05
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   36 and name  HB1) 4.002 2.002 2.002 weight 1.000 ! spec=Noesy, no=430, id=429, vol=3.192600e+05
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   37 and name HG21) 4.056 2.057 2.057 weight 1.000 ! spec=Noesy, no=431, id=430, vol=3.470820e+05
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   37 and name HG21) 3.964 1.964 1.964 weight 1.000 ! spec=Noesy, no=432, id=431, vol=4.499760e+05
    or (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   30 and name HG23) 3.527 1.555 1.555 weight 1.000 ! spec=Noesy, no=433, id=432, vol=9.753040e+05
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   30 and name HG22)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   30 and name HG21)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   30 and name HG23) 3.676 1.689 1.689 weight 1.000 ! spec=Noesy, no=434, id=433, vol=9.990320e+05
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   30 and name HG22)
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   30 and name HG21)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name HG23) 3.549 1.574 1.574 weight 1.000 ! spec=Noesy, no=435, id=434, vol=1.220728e+06
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name HG22)
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name HG21)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   30 and name HG23) 3.702 1.713 1.713 weight 1.000 ! spec=Noesy, no=436, id=435, vol=7.739720e+05
    or (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   30 and name HG22)
    or (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   30 and name HG21)
assign (segid "   A" and resid   34 and name   HE) (segid "   A" and resid   30 and name HG23) 3.696 1.707 1.707 weight 1.000 ! spec=Noesy, no=437, id=436, vol=5.887760e+05
    or (segid "   A" and resid   34 and name   HE) (segid "   A" and resid   30 and name HG22)
    or (segid "   A" and resid   34 and name   HE) (segid "   A" and resid   30 and name HG21)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   16 and name HG11) 3.651 1.666 1.666 weight 1.000 ! spec=Noesy, no=438, id=437, vol=8.574200e+05
assign (segid "   A" and resid   17 and name   HE) (segid "   A" and resid   16 and name HG11) 3.855 1.858 1.858 weight 1.000 ! spec=Noesy, no=439, id=438, vol=4.828060e+05
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    9 and name HG13) 3.979 1.979 1.979 weight 1.000 ! spec=Noesy, no=440, id=439, vol=4.571460e+05
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    9 and name HG11)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    9 and name HG12)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   40 and name HG12) 3.539 1.565 1.565 weight 1.000 ! spec=Noesy, no=442, id=441, vol=1.038898e+06
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   12 and name  HD2) (segid "   A" and resid   40 and name HG12) 3.565 1.589 1.589 weight 1.000 ! spec=Noesy, no=443, id=442, vol=5.437280e+05
    or (segid "   A" and resid   12 and name  HD2) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   12 and name  HD2) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   20 and name HG12) 3.920 1.921 1.921 weight 1.000 ! spec=Noesy, no=444, id=443, vol=4.321260e+05
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   20 and name HG11)
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   20 and name HG13)
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid   40 and name HG12) 3.613 1.631 1.631 weight 1.000 ! spec=Noesy, no=445, id=444, vol=6.027360e+05
    or (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid   40 and name HG13)
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid   40 and name HG12)
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   40 and name HG12) 3.718 1.728 1.728 weight 1.000 ! spec=Noesy, no=446, id=445, vol=7.875580e+05
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   40 and name HG13)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   40 and name HG12)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   16 and name HG21) 3.542 1.568 1.568 weight 1.000 ! spec=Noesy, no=447, id=446, vol=1.024924e+06
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   16 and name HG23)
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   16 and name HG22)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   40 and name HG21) 4.072 2.073 2.073 weight 1.000 ! spec=Noesy, no=448, id=447, vol=4.160780e+05
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   40 and name HG21) 3.718 1.727 1.727 weight 1.000 ! spec=Noesy, no=449, id=448, vol=7.789900e+05
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   40 and name HG23)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   40 and name HG21)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   40 and name HG21) 4.113 2.114 2.114 weight 1.000 ! spec=Noesy, no=450, id=449, vol=3.448800e+05
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid   40 and name HG21) 3.689 1.701 1.701 weight 1.000 ! spec=Noesy, no=451, id=450, vol=6.202120e+05
    or (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid   40 and name HG23)
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid   40 and name HG21)
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HD13) 3.481 1.515 1.515 weight 1.000 ! spec=Noesy, no=452, id=451, vol=1.098614e+06
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HD11)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HD12)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HD13) 3.529 1.557 1.557 weight 1.000 ! spec=Noesy, no=453, id=452, vol=9.366560e+05
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HD11)
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HD12)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid    2 and name  HB2) 3.479 1.513 1.513 weight 1.000 ! spec=Noesy, no=454, id=453, vol=9.649660e+05
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name  HB2) 3.774 1.781 1.781 weight 1.000 ! spec=Noesy, no=456, id=455, vol=6.809180e+05
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   25 and name  HB1) 3.844 1.848 1.848 weight 1.000 ! spec=Noesy, no=457, id=456, vol=5.184540e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   25 and name  HB1)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   25 and name  HB2) 3.699 1.711 1.711 weight 1.000 ! spec=Noesy, no=458, id=457, vol=7.070580e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   25 and name  HB2)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   14 and name  HB1) 3.542 1.568 1.568 weight 1.000 ! spec=Noesy, no=459, id=458, vol=1.007068e+06
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   14 and name  HB1)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   14 and name  HB2) 3.563 1.587 1.587 weight 1.000 ! spec=Noesy, no=460, id=459, vol=9.941920e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   14 and name  HB2)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   22 and name  HG2) 4.065 2.065 2.065 weight 1.000 ! spec=Noesy, no=461, id=460, vol=4.182280e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   22 and name  HG2)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   22 and name  HG1) 4.073 2.074 2.074 weight 1.000 ! spec=Noesy, no=462, id=461, vol=4.204560e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   22 and name  HG1)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   16 and name HG12) 4.032 2.032 2.032 weight 1.000 ! spec=Noesy, no=463, id=462, vol=4.355500e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   16 and name HG12)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   16 and name HG11) 4.050 2.051 2.051 weight 1.000 ! spec=Noesy, no=464, id=463, vol=4.114780e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   16 and name HG11)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   16 and name HD13) 3.457 1.494 1.494 weight 1.000 ! spec=Noesy, no=465, id=464, vol=9.175180e+05
    or (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   16 and name HD11)
    or (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   16 and name HD12)
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   16 and name HD13)
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   16 and name HD11)
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   16 and name HD12)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   34 and name   HN) 3.671 1.684 1.684 weight 1.000 ! spec=Noesy, no=466, id=465, vol=9.893760e+05
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name   HN) 4.040 2.040 2.040 weight 1.000 ! spec=Noesy, no=467, id=466, vol=5.826780e+05
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid   33 and name  HZ2) 2.359 0.695 0.695 weight 1.000 ! spec=Noesy, no=468, id=467, vol=8.345192e+06
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid   33 and name  HD1) 2.068 0.534 0.534 weight 1.000 ! spec=Noesy, no=469, id=468, vol=1.848673e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HE2) 3.453 3.453 2.547 weight 1.000 ! spec=Noesy, no=470, id=469, vol=9.542320e+05
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HE1)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   25 and name  HE2) 3.756 1.763 1.763 weight 1.000 ! spec=Noesy, no=471, id=470, vol=7.876600e+05
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   25 and name  HE1)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HE2) 3.459 3.459 2.541 weight 1.000 ! spec=Noesy, no=472, id=471, vol=1.074812e+06
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HE1)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   25 and name  HD2) 3.660 1.674 1.674 weight 1.000 ! spec=Noesy, no=473, id=472, vol=7.335440e+05
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   25 and name  HD1)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HD2) 2.469 2.469 3.531 weight 1.000 ! spec=Noesy, no=474, id=473, vol=7.096768e+06
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HD1)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HD2) 3.233 1.306 1.306 weight 1.000 ! spec=Noesy, no=475, id=474, vol=1.622992e+06
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HD1)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HD2) 3.597 1.617 1.617 weight 1.000 ! spec=Noesy, no=476, id=475, vol=9.433300e+05
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HD1)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name  HD2) 4.222 2.228 2.228 weight 1.000 ! spec=Noesy, no=477, id=476, vol=6.535880e+05
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name  HD1)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name   HN) 3.793 1.798 1.798 weight 1.000 ! spec=Noesy, no=478, id=477, vol=1.104756e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   38 and name   HN) 3.477 1.511 1.511 weight 1.000 ! spec=Noesy, no=479, id=478, vol=1.094892e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name   HN) 3.271 1.338 1.338 weight 1.000 ! spec=Noesy, no=481, id=480, vol=1.221794e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HE3) 3.536 1.563 1.563 weight 1.000 ! spec=Noesy, no=482, id=481, vol=9.689020e+05
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   18 and name   HN) 3.533 1.560 1.560 weight 1.000 ! spec=Noesy, no=483, id=482, vol=9.781700e+05
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   18 and name   HN) 2.581 2.581 3.419 weight 1.000 ! spec=Noesy, no=484, id=483, vol=5.278790e+06
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   14 and name   HN) 2.797 0.978 0.978 weight 1.000 ! spec=Noesy, no=485, id=484, vol=5.572624e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name   HN) 3.579 1.601 1.601 weight 1.000 ! spec=Noesy, no=486, id=485, vol=9.388840e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   23 and name   HN) 3.366 1.416 1.416 weight 1.000 ! spec=Noesy, no=487, id=486, vol=1.137856e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   27 and name   HN) 4.432 2.456 2.456 weight 1.000 ! spec=Noesy, no=488, id=487, vol=9.672500e+05
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   27 and name   HN) 3.388 1.435 1.435 weight 1.000 ! spec=Noesy, no=489, id=488, vol=1.179120e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   27 and name   HN) 3.509 1.539 1.539 weight 1.000 ! spec=Noesy, no=490, id=489, vol=8.031700e+05
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name   HN) 3.699 1.710 1.710 weight 1.000 ! spec=Noesy, no=491, id=490, vol=8.184900e+05
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   36 and name   HN) 3.446 1.485 1.485 weight 1.000 ! spec=Noesy, no=492, id=491, vol=1.217472e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   29 and name   HN) 3.010 1.133 1.133 weight 1.000 ! spec=Noesy, no=493, id=492, vol=2.689782e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   37 and name   HN) 2.883 1.039 1.039 weight 1.000 ! spec=Noesy, no=494, id=493, vol=3.236232e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   26 and name   HN) 2.502 0.783 0.783 weight 1.000 ! spec=Noesy, no=495, id=494, vol=8.520672e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   17 and name   HN) 3.598 1.618 1.618 weight 1.000 ! spec=Noesy, no=496, id=495, vol=8.457620e+05
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   14 and name  HE2) 2.954 1.091 1.091 weight 1.000 ! spec=Noesy, no=497, id=496, vol=2.663086e+06
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   14 and name  HE1)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   14 and name  HE2)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   14 and name  HE1)
assign (segid "   A" and resid   17 and name   HE) (segid "   A" and resid   14 and name  HE2) 3.129 3.129 2.871 weight 1.000 ! spec=Noesy, no=498, id=497, vol=1.759016e+06
    or (segid "   A" and resid   17 and name   HE) (segid "   A" and resid   14 and name  HE1)
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   14 and name  HE2) 2.954 1.091 1.091 weight 1.000 ! spec=Noesy, no=499, id=498, vol=2.188992e+06
    or (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   14 and name  HE1)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   14 and name  HE2)
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   14 and name  HE1)
assign (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   14 and name  HE2) 1.821 0.414 0.414 weight 1.000 ! spec=Noesy, no=500, id=499, vol=4.832372e+07
    or (segid "   A" and resid   14 and name  HD2) (segid "   A" and resid   14 and name  HE1)
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   14 and name  HE2)
    or (segid "   A" and resid   14 and name  HD1) (segid "   A" and resid   14 and name  HE1)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HD2) 2.493 0.777 0.777 weight 1.000 ! spec=Noesy, no=501, id=500, vol=7.821702e+06
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HD1)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name  HD2) 3.036 1.152 1.152 weight 1.000 ! spec=Noesy, no=502, id=501, vol=2.315692e+06
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name  HD1)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name   HN) 2.271 0.645 0.645 weight 1.000 ! spec=Noesy, no=503, id=502, vol=1.457588e+07
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   20 and name   HN) 2.280 0.650 0.650 weight 1.000 ! spec=Noesy, no=505, id=504, vol=1.196426e+07
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name   HN) 2.558 0.818 0.818 weight 1.000 ! spec=Noesy, no=506, id=505, vol=3.643486e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    5 and name   HN) 2.388 0.713 0.713 weight 1.000 ! spec=Noesy, no=507, id=506, vol=8.907112e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   11 and name   HN) 3.042 3.042 2.958 weight 1.000 ! spec=Noesy, no=508, id=507, vol=2.292764e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name   HN) 2.369 2.369 3.631 weight 1.000 ! spec=Noesy, no=509, id=508, vol=9.917438e+06
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name   HN) 2.427 0.737 0.737 weight 1.000 ! spec=Noesy, no=510, id=509, vol=7.547960e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name   HN) 2.819 0.993 0.993 weight 1.000 ! spec=Noesy, no=511, id=510, vol=3.282780e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   11 and name  HD1) 2.820 2.820 3.180 weight 1.000 ! spec=Noesy, no=513, id=512, vol=2.429140e+06
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   11 and name  HD2)
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name   HN) 2.439 0.744 0.744 weight 1.000 ! spec=Noesy, no=514, id=513, vol=6.198776e+06
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid   10 and name   HN) 2.459 0.756 0.756 weight 1.000 ! spec=Noesy, no=515, id=514, vol=6.085212e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name   HN) 2.556 2.556 3.444 weight 1.000 ! spec=Noesy, no=516, id=515, vol=5.646806e+06
assign (segid "   A" and resid   33 and name  HZ2) (segid "   A" and resid   33 and name  HH2) 1.923 0.462 0.462 weight 1.000 ! spec=Noesy, no=517, id=516, vol=2.967109e+07
assign (segid "   A" and resid   33 and name  HE3) (segid "   A" and resid   33 and name  HZ3) 2.083 0.542 0.542 weight 1.000 ! spec=Noesy, no=518, id=517, vol=2.417474e+07
assign (segid "   A" and resid   35 and name HE22) (segid "   A" and resid   35 and name HE21) 1.539 0.296 0.296 weight 1.000 ! spec=Noesy, no=519, id=518, vol=9.666785e+07
assign (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   11 and name  HE2) 1.833 0.420 0.420 weight 1.000 ! spec=Noesy, no=520, id=519, vol=3.997077e+07
    or (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   11 and name  HE1)
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   11 and name  HE2)
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   11 and name  HE1)
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HD2) 1.688 1.688 4.312 weight 1.000 ! spec=Noesy, no=521, id=520, vol=4.658070e+07
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HD1)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name  HD2)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name  HD1)
assign (segid "   A" and resid   33 and name  HH2) (segid "   A" and resid   33 and name  HZ3) 1.865 1.865 4.135 weight 1.000 ! spec=Noesy, no=522, id=521, vol=3.353423e+07
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   28 and name  HE2) 1.691 1.691 4.309 weight 1.000 ! spec=Noesy, no=523, id=522, vol=4.788412e+07
    or (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   28 and name  HE1)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   28 and name  HE2)
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   28 and name  HE1)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   25 and name  HB1) 3.586 1.607 1.607 weight 1.000 ! spec=Noesy, no=524, id=523, vol=1.094432e+06
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   25 and name  HB2) 3.351 1.404 1.404 weight 1.000 ! spec=Noesy, no=525, id=524, vol=1.620134e+06
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name  HB1) 2.745 0.942 0.942 weight 1.000 ! spec=Noesy, no=526, id=525, vol=5.057006e+06
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name  HB2) 2.487 0.773 0.773 weight 1.000 ! spec=Noesy, no=527, id=526, vol=9.019716e+06
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name  HB1) 2.641 0.872 0.872 weight 1.000 ! spec=Noesy, no=528, id=527, vol=6.624606e+06
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name  HB2) 3.178 1.262 1.262 weight 1.000 ! spec=Noesy, no=529, id=528, vol=2.966894e+06
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   36 and name  HB2) 3.569 1.592 1.592 weight 1.000 ! spec=Noesy, no=530, id=529, vol=9.941300e+05
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   37 and name HG21) 3.264 1.332 1.332 weight 1.000 ! spec=Noesy, no=532, id=531, vol=1.745388e+06
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   16 and name HG11) 3.491 1.524 1.524 weight 1.000 ! spec=Noesy, no=533, id=532, vol=1.166068e+06
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   16 and name HG21) 3.192 1.273 1.273 weight 1.000 ! spec=Noesy, no=534, id=533, vol=2.086544e+06
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   16 and name HG23)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   16 and name HG22)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   40 and name HG21) 3.132 1.226 1.226 weight 1.000 ! spec=Noesy, no=535, id=534, vol=2.448488e+06
    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)
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   38 and name   HA) 2.769 0.958 0.958 weight 1.000 ! spec=Noesy, no=536, id=535, vol=4.659972e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   35 and name   HA) 4.144 2.146 2.146 weight 1.000 ! spec=Noesy, no=537, id=536, vol=3.897800e+05
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   37 and name   HA) 4.327 2.341 2.341 weight 1.000 ! spec=Noesy, no=538, id=537, vol=2.911600e+05
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HE1) 4.248 2.255 2.255 weight 1.000 ! spec=Noesy, no=539, id=538, vol=5.642400e+04
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   24 and name  HD2) 2.904 1.054 1.054 weight 1.000 ! spec=Noesy, no=540, id=539, vol=2.524664e+06
    or (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   24 and name  HD2)
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   40 and name HG21) 3.155 3.155 2.845 weight 1.000 ! spec=Noesy, no=541, id=540, vol=1.613810e+06
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   40 and name HG23)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   40 and name HG21)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   26 and name  HB1) 3.113 1.211 1.211 weight 1.000 ! spec=Noesy, no=545, id=544, vol=1.944404e+06
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   27 and name  HB3) 4.517 2.551 2.551 weight 1.000 ! spec=Noesy, no=546, id=545, vol=2.618320e+05
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   16 and name HG21) 3.741 1.749 1.749 weight 1.000 ! spec=Noesy, no=548, id=547, vol=1.220182e+06
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   16 and name HG23)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   16 and name HG22)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    9 and name HG13) 4.127 2.129 2.129 weight 1.000 ! spec=Noesy, no=549, id=548, vol=3.167060e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    9 and name HG11)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    9 and name HG12)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name   HA) 3.337 1.392 1.392 weight 1.000 ! spec=Noesy, no=551, id=550, vol=1.225304e+06
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid   33 and name   HA) 4.098 2.099 2.099 weight 1.000 ! spec=Noesy, no=552, id=551, vol=3.607080e+05
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name   HA) 3.199 1.280 1.280 weight 1.000 ! spec=Noesy, no=553, id=552, vol=6.436680e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    5 and name   HA) 3.245 1.317 1.317 weight 1.000 ! spec=Noesy, no=554, id=553, vol=1.395846e+06
assign (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid    7 and name  HG2) 3.005 1.129 1.129 weight 1.000 ! spec=Noesy, no=557, id=556, vol=2.870602e+06
    or (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid    7 and name  HG2)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   40 and name HG21) 3.424 1.466 1.466 weight 1.000 ! spec=Noesy, no=561, id=560, vol=1.344450e+06
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid    2 and name  HB2) 4.197 2.202 2.202 weight 1.000 ! spec=Noesy, no=562, id=561, vol=4.179440e+05
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid    4 and name   HA) 4.386 2.405 2.405 weight 1.000 ! spec=Noesy, no=563, id=562, vol=2.610380e+05
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid    4 and name   HA)
assign (segid "   A" and resid    3 and name   HE) (segid "   A" and resid    3 and name  HD1) 4.144 2.147 2.147 weight 1.000 ! spec=Noesy, no=564, id=563, vol=4.114720e+05
assign (segid "   A" and resid   28 and name  HE2) (segid "   A" and resid   11 and name  HB1) 4.297 2.308 2.308 weight 1.000 ! spec=Noesy, no=566, id=565, vol=3.373560e+05
    or (segid "   A" and resid   28 and name  HE1) (segid "   A" and resid   11 and name  HB1)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name  HB2) 4.434 2.458 2.458 weight 1.000 ! spec=Noesy, no=567, id=566, vol=2.994140e+05
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid   33 and name  HB2) 4.194 2.199 2.199 weight 1.000 ! spec=Noesy, no=568, id=567, vol=3.019640e+05
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid   32 and name  HB1) 4.683 2.742 2.742 weight 1.000 ! spec=Noesy, no=569, id=568, vol=1.687480e+05
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name  HB1) 4.526 2.561 2.561 weight 1.000 ! spec=Noesy, no=570, id=569, vol=3.213880e+05
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid   33 and name  HB1) 4.112 2.113 2.113 weight 1.000 ! spec=Noesy, no=571, id=570, vol=3.501500e+05
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   38 and name  HB1) 2.574 0.829 0.829 weight 1.000 ! spec=Noesy, no=572, id=571, vol=7.195594e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name  HG1) 3.763 1.770 1.770 weight 1.000 ! spec=Noesy, no=573, id=572, vol=7.241660e+05
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   24 and name  HB1) 4.570 2.610 2.610 weight 1.000 ! spec=Noesy, no=575, id=574, vol=2.076780e+05
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   24 and name  HB1)
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid    7 and name  HG1) 4.301 2.312 2.312 weight 1.000 ! spec=Noesy, no=576, id=575, vol=2.898320e+05
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid    7 and name  HG1)
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid    7 and name  HG2) 4.488 2.518 2.518 weight 1.000 ! spec=Noesy, no=577, id=576, vol=2.145640e+05
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid    7 and name  HG2)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   37 and name HG21) 3.654 1.669 1.669 weight 1.000 ! spec=Noesy, no=578, id=577, vol=1.188884e+06
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   40 and name HG21) 4.544 2.581 2.581 weight 1.000 ! spec=Noesy, no=579, id=578, vol=2.447160e+05
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   12 and name  HD2) (segid "   A" and resid   40 and name HG21) 4.024 2.024 2.024 weight 1.000 ! spec=Noesy, no=580, id=579, vol=5.237320e+05
    or (segid "   A" and resid   12 and name  HD2) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   12 and name  HD2) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   16 and name HD13) 4.103 2.104 2.104 weight 1.000 ! spec=Noesy, no=581, id=580, vol=4.081440e+05
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   16 and name HD11)
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   16 and name HD12)
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   40 and name HG12) 4.151 2.154 2.154 weight 1.000 ! spec=Noesy, no=582, id=581, vol=4.145200e+05
    or (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   40 and name HG21) 4.301 2.313 2.313 weight 1.000 ! spec=Noesy, no=583, id=582, vol=3.157560e+05
    or (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   40 and name HG22)
    or (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   40 and name HG23)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name  HE3) 4.335 2.349 2.349 weight 1.000 ! spec=Noesy, no=584, id=583, vol=3.317560e+05
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   14 and name  HD2) 3.810 1.815 1.815 weight 1.000 ! spec=Noesy, no=585, id=584, vol=8.693920e+05
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   14 and name  HD1)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   35 and name   HN) 2.784 0.969 0.969 weight 1.000 ! spec=Noesy, no=586, id=585, vol=4.114836e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name   HN) 3.321 1.379 1.379 weight 1.000 ! spec=Noesy, no=587, id=586, vol=1.485826e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name   HN) 4.111 2.113 2.113 weight 1.000 ! spec=Noesy, no=588, id=587, vol=4.383720e+05
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   33 and name  HE3) 3.914 1.915 1.915 weight 1.000 ! spec=Noesy, no=589, id=588, vol=4.503640e+05
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    7 and name   HN) 4.154 2.157 2.157 weight 1.000 ! spec=Noesy, no=590, id=589, vol=3.605480e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    7 and name   HN) 3.476 1.510 1.510 weight 1.000 ! spec=Noesy, no=591, id=590, vol=7.856820e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid   11 and name   HN) 3.427 1.468 1.468 weight 1.000 ! spec=Noesy, no=592, id=591, vol=8.591580e+05
assign (segid "   A" and resid   12 and name  HE1) (segid "   A" and resid   12 and name  HD2) 3.251 1.321 1.321 weight 1.000 ! spec=Noesy, no=593, id=592, vol=3.074740e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name  HD1) 4.103 2.105 2.105 weight 1.000 ! spec=Noesy, no=594, id=593, vol=3.758160e+05
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name  HD2)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name  HD2) 3.513 1.543 1.543 weight 1.000 ! spec=Noesy, no=595, id=594, vol=8.713000e+05
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HD2) 3.462 1.499 1.499 weight 1.000 ! spec=Noesy, no=597, id=596, vol=9.707600e+05
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HD1)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   38 and name   HA) 4.361 2.377 2.377 weight 1.000 ! spec=Noesy, no=598, id=597, vol=3.262900e+05
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   27 and name   HA) 3.659 1.673 1.673 weight 1.000 ! spec=Noesy, no=599, id=598, vol=9.046660e+05
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   26 and name   HA) 4.032 2.032 2.032 weight 1.000 ! spec=Noesy, no=600, id=599, vol=5.183960e+05
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   40 and name   HA) 3.771 1.778 1.778 weight 1.000 ! spec=Noesy, no=601, id=600, vol=7.037920e+05
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   37 and name   HB) 3.949 1.949 1.949 weight 1.000 ! spec=Noesy, no=602, id=601, vol=5.956540e+05
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   31 and name  HB1) 3.866 1.868 1.868 weight 1.000 ! spec=Noesy, no=603, id=602, vol=7.039700e+05
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   31 and name  HB2) 3.694 1.706 1.706 weight 1.000 ! spec=Noesy, no=604, id=603, vol=8.976080e+05
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   28 and name  HB2) 4.090 2.091 2.091 weight 1.000 ! spec=Noesy, no=605, id=604, vol=4.261540e+05
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   40 and name   HB) 3.770 3.770 2.230 weight 1.000 ! spec=Noesy, no=607, id=606, vol=7.049400e+05
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   16 and name   HB) 3.883 1.885 1.885 weight 1.000 ! spec=Noesy, no=608, id=607, vol=6.496080e+05
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   16 and name HG12) 3.889 1.890 1.890 weight 1.000 ! spec=Noesy, no=609, id=608, vol=6.430520e+05
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   36 and name  HB1) 4.012 2.013 2.013 weight 1.000 ! spec=Noesy, no=612, id=611, vol=5.423300e+05
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   37 and name HG21) 4.321 2.334 2.334 weight 1.000 ! spec=Noesy, no=613, id=612, vol=2.476520e+05
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   40 and name HG12) 3.367 1.417 1.417 weight 1.000 ! spec=Noesy, no=614, id=613, vol=1.784394e+06
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   40 and name HG11)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   40 and name HG13)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   14 and name   HA) 4.282 2.292 2.292 weight 1.000 ! spec=Noesy, no=615, id=614, vol=3.214500e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   40 and name   HA) 4.204 2.209 2.209 weight 1.000 ! spec=Noesy, no=616, id=615, vol=3.182400e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   40 and name   HA)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HD1) 4.406 2.427 2.427 weight 1.000 ! spec=Noesy, no=617, id=616, vol=3.012560e+05
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   14 and name  HE2) 4.313 2.325 2.325 weight 1.000 ! spec=Noesy, no=618, id=617, vol=3.941620e+05
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   14 and name  HE1)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   14 and name  HE2) 4.590 2.634 2.634 weight 1.000 ! spec=Noesy, no=619, id=618, vol=1.861520e+05
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   14 and name  HE1)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HE2) 3.557 1.582 1.582 weight 1.000 ! spec=Noesy, no=620, id=619, vol=8.964740e+05
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HE1)
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   14 and name  HD2) 3.109 1.209 1.209 weight 1.000 ! spec=Noesy, no=621, id=620, vol=1.999694e+06
    or (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   14 and name  HD1)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   14 and name  HD2)
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   14 and name  HD1)
assign (segid "   A" and resid   30 and name   HB) (segid "   A" and resid   30 and name   HA) 2.927 1.071 1.071 weight 1.000 ! spec=Noesy, no=622, id=621, vol=3.055778e+06
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   30 and name   HA) 4.145 2.148 2.148 weight 1.000 ! spec=Noesy, no=623, id=622, vol=4.296700e+05
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   30 and name   HA) 2.169 0.588 0.588 weight 1.000 ! spec=Noesy, no=624, id=623, vol=1.740875e+07
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   30 and name   HA) 3.310 3.310 2.690 weight 1.000 ! spec=Noesy, no=625, id=624, vol=1.110952e+06
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   24 and name   HA) 2.158 0.582 0.582 weight 1.000 ! spec=Noesy, no=626, id=625, vol=1.854283e+07
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   30 and name   HB) 3.568 1.592 1.592 weight 1.000 ! spec=Noesy, no=627, id=626, vol=4.303040e+05
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name  HB1) 3.588 1.609 1.609 weight 1.000 ! spec=Noesy, no=628, id=627, vol=2.528084e+06
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid    5 and name   HA) 2.999 1.124 1.124 weight 1.000 ! spec=Noesy, no=629, id=628, vol=3.033154e+06
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid    3 and name  HD1) 2.483 0.771 0.771 weight 1.000 ! spec=Noesy, no=630, id=629, vol=6.370678e+06
assign (segid "   A" and resid    5 and name   HB) (segid "   A" and resid    5 and name   HA) 2.075 2.075 3.925 weight 1.000 ! spec=Noesy, no=631, id=630, vol=1.775898e+07
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   18 and name  HB2) 3.042 3.042 2.958 weight 1.000 ! spec=Noesy, no=632, id=631, vol=2.157022e+06
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid    9 and name   HA) 3.848 1.851 1.851 weight 1.000 ! spec=Noesy, no=633, id=632, vol=6.973700e+05
assign (segid "   A" and resid    1 and name   HA) (segid "   A" and resid    2 and name  HD1) 3.521 1.550 1.550 weight 1.000 ! spec=Noesy, no=634, id=633, vol=9.916420e+05
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name  HB2) 4.399 2.418 2.418 weight 1.000 ! spec=Noesy, no=635, id=634, vol=2.527840e+05
assign (segid "   A" and resid   30 and name   HB) (segid "   A" and resid   34 and name   HA) 2.829 1.000 1.000 weight 1.000 ! spec=Noesy, no=636, id=635, vol=3.705116e+06
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HB1) 3.332 1.387 1.387 weight 1.000 ! spec=Noesy, no=637, id=636, vol=2.113320e+05
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HB2) 3.526 1.554 1.554 weight 1.000 ! spec=Noesy, no=638, id=637, vol=3.778402e+06
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   33 and name  HB2) 2.820 0.994 0.994 weight 1.000 ! spec=Noesy, no=640, id=639, vol=5.324986e+06
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name  HB2) 2.252 0.634 0.634 weight 1.000 ! spec=Noesy, no=641, id=640, vol=1.683379e+07
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name  HB1) 2.830 1.001 1.001 weight 1.000 ! spec=Noesy, no=642, id=641, vol=4.248866e+06
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   13 and name  HA2) 4.524 2.559 2.559 weight 1.000 ! spec=Noesy, no=644, id=643, vol=2.930840e+05
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   11 and name  HB1) 3.578 1.600 1.600 weight 1.000 ! spec=Noesy, no=645, id=644, vol=7.091860e+05
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   11 and name  HB1) 3.713 1.724 1.724 weight 1.000 ! spec=Noesy, no=646, id=645, vol=1.026596e+06
assign (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   38 and name   HA) 2.972 1.104 1.104 weight 1.000 ! spec=Noesy, no=647, id=646, vol=2.291870e+06
assign (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   30 and name   HA) 3.365 1.415 1.415 weight 1.000 ! spec=Noesy, no=648, id=647, vol=1.116392e+06
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name   HA) 3.231 1.305 1.305 weight 1.000 ! spec=Noesy, no=649, id=648, vol=3.651178e+06
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   14 and name   HA) 3.121 1.217 1.217 weight 1.000 ! spec=Noesy, no=651, id=650, vol=2.707376e+06
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   14 and name   HA) 3.135 1.228 1.228 weight 1.000 ! spec=Noesy, no=652, id=651, vol=2.252910e+06
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name   HA) 2.794 0.976 0.976 weight 1.000 ! spec=Noesy, no=653, id=652, vol=7.192436e+06
assign (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   28 and name   HA) 3.019 1.139 1.139 weight 1.000 ! spec=Noesy, no=654, id=653, vol=3.617182e+06
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   11 and name   HA) 2.831 1.002 1.002 weight 1.000 ! spec=Noesy, no=655, id=654, vol=3.470044e+06
assign (segid "   A" and resid   24 and name  HD2) (segid "   A" and resid   24 and name   HA) 3.587 1.608 1.608 weight 1.000 ! spec=Noesy, no=656, id=655, vol=9.472600e+05
assign (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   28 and name   HA) 2.612 0.853 0.853 weight 1.000 ! spec=Noesy, no=657, id=656, vol=6.336704e+06
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   12 and name  HB1) 2.210 0.611 0.611 weight 1.000 ! spec=Noesy, no=658, id=657, vol=2.687927e+07
assign (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid   32 and name  HB2) 2.608 0.850 0.850 weight 1.000 ! spec=Noesy, no=659, id=658, vol=4.747670e+06
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   33 and name  HB2) 3.762 3.762 2.238 weight 1.000 ! spec=Noesy, no=660, id=659, vol=2.737126e+07
assign (segid "   A" and resid    2 and name  HD2) (segid "   A" and resid    2 and name  HD1) 3.744 3.744 2.256 weight 1.000 ! spec=Noesy, no=661, id=660, vol=6.345680e+05
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   33 and name   HA) 3.440 1.480 1.480 weight 1.000 ! spec=Noesy, no=663, id=662, vol=8.551116e+06
assign (segid "   A" and resid    2 and name  HD2) (segid "   A" and resid    5 and name   HB) 2.817 0.992 0.992 weight 1.000 ! spec=Noesy, no=664, id=663, vol=4.618518e+06
assign (segid "   A" and resid    3 and name  HD2) (segid "   A" and resid    3 and name  HD1) 3.786 3.786 2.214 weight 1.000 ! spec=Noesy, no=665, id=664, vol=9.316020e+05
assign (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid    5 and name   HA) 3.012 1.134 1.134 weight 1.000 ! spec=Noesy, no=666, id=665, vol=2.608484e+06
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name   HA) 3.006 1.130 1.130 weight 1.000 ! spec=Noesy, no=669, id=668, vol=3.770618e+06
assign (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   37 and name   HA) 3.404 1.448 1.448 weight 1.000 ! spec=Noesy, no=670, id=669, vol=1.054168e+06
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid    8 and name   HA) 3.572 1.595 1.595 weight 1.000 ! spec=Noesy, no=671, id=670, vol=1.873340e+06
assign (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid    4 and name   HA) 4.117 2.119 2.119 weight 1.000 ! spec=Noesy, no=672, id=671, vol=1.006331e+07
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   35 and name   HA) 3.066 1.175 1.175 weight 1.000 ! spec=Noesy, no=673, id=672, vol=3.058060e+06
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    4 and name   HA) 3.499 1.530 1.530 weight 1.000 ! spec=Noesy, no=674, id=673, vol=1.045622e+07
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name   HA) 2.830 1.001 1.001 weight 1.000 ! spec=Noesy, no=675, id=674, vol=4.030982e+06
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid    8 and name   HA) 4.748 2.818 2.818 weight 1.000 ! spec=Noesy, no=676, id=675, vol=8.749040e+05
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   37 and name   HA) 4.158 2.161 2.161 weight 1.000 ! spec=Noesy, no=677, id=676, vol=1.119988e+06
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   30 and name   HA) 3.971 1.971 1.971 weight 1.000 ! spec=Noesy, no=678, id=677, vol=1.617802e+06
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   38 and name   HA) 3.309 1.369 1.369 weight 1.000 ! spec=Noesy, no=679, id=678, vol=5.456804e+06
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   25 and name   HA) 4.535 2.571 2.571 weight 1.000 ! spec=Noesy, no=681, id=680, vol=7.966440e+05
assign (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   30 and name   HA) 3.070 1.178 1.178 weight 1.000 ! spec=Noesy, no=682, id=681, vol=1.213110e+06
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   30 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   30 and name   HA)
assign (segid "   A" and resid   30 and name HG23) (segid "   A" and resid   30 and name   HA) 2.156 0.581 0.581 weight 1.000 ! spec=Noesy, no=683, id=682, vol=1.244442e+07
    or (segid "   A" and resid   30 and name HG22) (segid "   A" and resid   30 and name   HA)
    or (segid "   A" and resid   30 and name HG21) (segid "   A" and resid   30 and name   HA)
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name   HA) 2.549 0.812 0.812 weight 1.000 ! spec=Noesy, no=684, id=683, vol=9.640062e+06
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   22 and name   HA) 2.466 0.760 0.760 weight 1.000 ! spec=Noesy, no=685, id=684, vol=1.056964e+07
assign (segid "   A" and resid   22 and name  HG2) (segid "   A" and resid   22 and name   HA) 2.766 2.766 3.234 weight 1.000 ! spec=Noesy, no=686, id=685, vol=5.918658e+06
assign (segid "   A" and resid   22 and name  HG2) (segid "   A" and resid   21 and name   HA) 4.250 2.258 2.258 weight 1.000 ! spec=Noesy, no=687, id=686, vol=3.700380e+05
assign (segid "   A" and resid   22 and name  HG1) (segid "   A" and resid   21 and name   HA) 4.063 2.064 2.064 weight 1.000 ! spec=Noesy, no=688, id=687, vol=4.458500e+05
assign (segid "   A" and resid   22 and name  HG1) (segid "   A" and resid   22 and name   HA) 2.879 1.036 1.036 weight 1.000 ! spec=Noesy, no=689, id=688, vol=3.586056e+06
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   30 and name   HB) 3.790 1.796 1.796 weight 1.000 ! spec=Noesy, no=690, id=689, vol=8.045140e+05
assign (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   35 and name   HA) 3.184 1.267 1.267 weight 1.000 ! spec=Noesy, no=691, id=690, vol=2.698706e+06
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   35 and name   HA) 3.714 1.724 1.724 weight 1.000 ! spec=Noesy, no=692, id=691, vol=6.911040e+05
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name   HA) 2.754 0.948 0.948 weight 1.000 ! spec=Noesy, no=693, id=692, vol=4.690536e+06
assign (segid "   A" and resid   22 and name  HB1) (segid "   A" and resid   22 and name   HA) 2.521 0.794 0.794 weight 1.000 ! spec=Noesy, no=694, id=693, vol=8.271122e+06
assign (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   40 and name   HA) 2.685 0.901 0.901 weight 1.000 ! spec=Noesy, no=695, id=694, vol=6.120892e+06
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name   HA) 2.562 0.820 0.820 weight 1.000 ! spec=Noesy, no=696, id=695, vol=8.604246e+06
assign (segid "   A" and resid   16 and name   HB) (segid "   A" and resid   16 and name   HA) 2.833 1.004 1.004 weight 1.000 ! spec=Noesy, no=697, id=696, vol=4.526210e+06
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   38 and name   HA) 4.047 2.047 2.047 weight 1.000 ! spec=Noesy, no=698, id=697, vol=4.012320e+05
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   23 and name   HA) 3.552 1.577 1.577 weight 1.000 ! spec=Noesy, no=701, id=700, vol=1.253618e+06
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   17 and name   HA) 3.281 1.345 1.345 weight 1.000 ! spec=Noesy, no=702, id=701, vol=1.760256e+06
assign (segid "   A" and resid   16 and name HG12) (segid "   A" and resid   16 and name   HA) 3.645 1.660 1.660 weight 1.000 ! spec=Noesy, no=707, id=706, vol=9.307540e+05
assign (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   27 and name   HA) 3.032 1.150 1.150 weight 1.000 ! spec=Noesy, no=708, id=707, vol=2.089164e+06
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name   HA)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name   HA)
assign (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   26 and name   HA) 2.014 0.507 0.507 weight 1.000 ! spec=Noesy, no=709, id=708, vol=2.190287e+07
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   26 and name   HA)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   26 and name   HA)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   17 and name   HA) 2.773 2.773 3.227 weight 1.000 ! spec=Noesy, no=713, id=712, vol=5.397682e+06
assign (segid "   A" and resid   30 and name HG23) (segid "   A" and resid   30 and name   HB) 2.121 0.562 0.562 weight 1.000 ! spec=Noesy, no=714, id=713, vol=1.376551e+07
    or (segid "   A" and resid   30 and name HG22) (segid "   A" and resid   30 and name   HB)
    or (segid "   A" and resid   30 and name HG21) (segid "   A" and resid   30 and name   HB)
assign (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   16 and name   HA) 2.566 0.823 0.823 weight 1.000 ! spec=Noesy, no=715, id=714, vol=5.283294e+06
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   16 and name   HA)
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   16 and name   HA)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   16 and name   HA) 3.584 1.605 1.605 weight 1.000 ! spec=Noesy, no=716, id=715, vol=8.232060e+05
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   16 and name   HA)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   16 and name   HA)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   21 and name   HA) 2.756 0.949 0.949 weight 1.000 ! spec=Noesy, no=717, id=716, vol=4.349274e+06
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   21 and name   HA)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   21 and name   HA)
assign (segid "   A" and resid   40 and name HG12) (segid "   A" and resid   13 and name  HA1) 3.128 1.223 1.223 weight 1.000 ! spec=Noesy, no=718, id=717, vol=1.783390e+06
    or (segid "   A" and resid   40 and name HG11) (segid "   A" and resid   13 and name  HA1)
    or (segid "   A" and resid   40 and name HG13) (segid "   A" and resid   13 and name  HA1)
assign (segid "   A" and resid   40 and name HG12) (segid "   A" and resid   40 and name   HA) 2.382 0.709 0.709 weight 1.000 ! spec=Noesy, no=719, id=718, vol=8.099564e+06
    or (segid "   A" and resid   40 and name HG11) (segid "   A" and resid   40 and name   HA)
    or (segid "   A" and resid   40 and name HG13) (segid "   A" and resid   40 and name   HA)
assign (segid "   A" and resid   40 and name HG21) (segid "   A" and resid   40 and name   HA) 2.586 0.836 0.836 weight 1.000 ! spec=Noesy, no=720, id=719, vol=4.948150e+06
    or (segid "   A" and resid   40 and name HG22) (segid "   A" and resid   40 and name   HA)
    or (segid "   A" and resid   40 and name HG23) (segid "   A" and resid   40 and name   HA)
assign (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   38 and name   HA) 3.593 1.614 1.614 weight 1.000 ! spec=Noesy, no=721, id=720, vol=5.969660e+05
    or (segid "   A" and resid   37 and name HG22) (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 "   A" and resid   37 and name HG21) (segid "   A" and resid   36 and name   HA) 3.602 3.602 2.398 weight 1.000 ! spec=Noesy, no=722, id=721, vol=6.199140e+05
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   36 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   36 and name   HA)
assign (segid "   A" and resid   16 and name HG11) (segid "   A" and resid   16 and name   HA) 4.193 2.197 2.197 weight 1.000 ! spec=Noesy, no=723, id=722, vol=4.756960e+05
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   23 and name   HA) 3.495 1.527 1.527 weight 1.000 ! spec=Noesy, no=724, id=723, vol=1.055450e+06
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   35 and name   HA) 2.654 0.880 0.880 weight 1.000 ! spec=Noesy, no=725, id=724, vol=7.506646e+06
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid    5 and name   HA) 4.912 3.016 3.016 weight 1.000 ! spec=Noesy, no=728, id=727, vol=4.140640e+05
assign (segid "   A" and resid   22 and name  HG2) (segid "   A" and resid   22 and name  HD2) 3.289 1.352 1.352 weight 1.000 ! spec=Noesy, no=729, id=728, vol=1.845188e+06
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   34 and name   HA) 4.179 2.183 2.183 weight 1.000 ! spec=Noesy, no=730, id=729, vol=4.005720e+05
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   34 and name   HA) 3.488 1.521 1.521 weight 1.000 ! spec=Noesy, no=731, id=730, vol=1.724720e+06
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   22 and name  HD2) 3.550 1.575 1.575 weight 1.000 ! spec=Noesy, no=732, id=731, vol=1.164246e+06
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name  HB1) 2.301 0.662 0.662 weight 1.000 ! spec=Noesy, no=733, id=732, vol=1.983711e+07
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name  HB1) 2.014 0.507 0.507 weight 1.000 ! spec=Noesy, no=734, id=733, vol=2.784671e+07
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   11 and name  HB1) 1.947 0.474 0.474 weight 1.000 ! spec=Noesy, no=735, id=734, vol=3.251226e+07
assign (segid "   A" and resid   24 and name  HD2) (segid "   A" and resid   24 and name  HD1) 1.855 0.430 0.430 weight 1.000 ! spec=Noesy, no=736, id=735, vol=4.677514e+07
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   33 and name  HB2) 4.044 2.044 2.044 weight 1.000 ! spec=Noesy, no=737, id=736, vol=4.166600e+05
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   14 and name  HB1) 1.832 0.419 0.419 weight 1.000 ! spec=Noesy, no=739, id=738, vol=4.627456e+07
assign (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   28 and name  HB1) 1.735 0.376 0.376 weight 1.000 ! spec=Noesy, no=740, id=739, vol=6.057077e+07
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   31 and name  HB2) 3.329 1.385 1.385 weight 1.000 ! spec=Noesy, no=741, id=740, vol=2.286794e+06
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   25 and name  HB2) 3.116 1.213 1.213 weight 1.000 ! spec=Noesy, no=743, id=742, vol=6.277602e+06
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   38 and name  HB1) 2.347 0.689 0.689 weight 1.000 ! spec=Noesy, no=744, id=743, vol=3.792375e+07
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name  HD1) 3.255 1.325 1.325 weight 1.000 ! spec=Noesy, no=747, id=746, vol=1.615528e+06
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   15 and name  HB1) 2.243 0.629 0.629 weight 1.000 ! spec=Noesy, no=748, id=747, vol=2.681926e+07
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    4 and name  HB2) 1.933 0.467 0.467 weight 1.000 ! spec=Noesy, no=749, id=748, vol=2.924950e+07
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name  HG1) 1.870 0.437 0.437 weight 1.000 ! spec=Noesy, no=750, id=749, vol=4.462792e+07
assign (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   32 and name  HB2) 3.588 1.609 1.609 weight 1.000 ! spec=Noesy, no=751, id=750, vol=1.468044e+06
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name   HA) 2.835 1.005 1.005 weight 1.000 ! spec=Noesy, no=752, id=751, vol=4.420692e+06
assign (segid "   A" and resid   22 and name  HG1) (segid "   A" and resid   22 and name  HD2) 3.058 1.169 1.169 weight 1.000 ! spec=Noesy, no=753, id=752, vol=2.658986e+06
assign (segid "   A" and resid    9 and name   HB) (segid "   A" and resid    9 and name   HA) 3.111 1.210 1.210 weight 1.000 ! spec=Noesy, no=754, id=753, vol=2.548798e+06
assign (segid "   A" and resid   22 and name  HB1) (segid "   A" and resid   22 and name  HD2) 3.760 1.767 1.767 weight 1.000 ! spec=Noesy, no=755, id=754, vol=8.136640e+05
assign (segid "   A" and resid    9 and name   HB) (segid "   A" and resid    6 and name   HA) 2.961 1.096 1.096 weight 1.000 ! spec=Noesy, no=756, id=755, vol=3.424318e+06
assign (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    3 and name   HA) 2.721 0.925 0.925 weight 1.000 ! spec=Noesy, no=758, id=757, vol=6.058790e+06
assign (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name   HA) 2.451 0.751 0.751 weight 1.000 ! spec=Noesy, no=759, id=758, vol=8.903624e+06
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   19 and name   HA) 2.649 0.877 0.877 weight 1.000 ! spec=Noesy, no=761, id=760, vol=6.619584e+06
assign (segid "   A" and resid    1 and name  HB1) (segid "   A" and resid    1 and name   HA) 3.173 1.258 1.258 weight 1.000 ! spec=Noesy, no=763, id=762, vol=2.253012e+06
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   35 and name   HA) 3.159 1.248 1.248 weight 1.000 ! spec=Noesy, no=764, id=763, vol=2.264438e+06
assign (segid "   A" and resid    1 and name  HB1) (segid "   A" and resid    5 and name   HB) 3.248 1.319 1.319 weight 1.000 ! spec=Noesy, no=766, id=765, vol=2.017168e+06
assign (segid "   A" and resid    1 and name   HG) (segid "   A" and resid    5 and name   HB) 3.386 1.433 1.433 weight 1.000 ! spec=Noesy, no=767, id=766, vol=1.570082e+06
assign (segid "   A" and resid    7 and name  HG2) (segid "   A" and resid    7 and name   HA) 3.198 1.279 1.279 weight 1.000 ! spec=Noesy, no=768, id=767, vol=2.198782e+06
assign (segid "   A" and resid    2 and name  HG1) (segid "   A" and resid    2 and name   HA) 3.401 1.446 1.446 weight 1.000 ! spec=Noesy, no=770, id=769, vol=1.519770e+06
assign (segid "   A" and resid   16 and name HG12) (segid "   A" and resid   37 and name   HB) 2.825 0.997 0.997 weight 1.000 ! spec=Noesy, no=771, id=770, vol=4.744582e+06
assign (segid "   A" and resid    2 and name  HB1) (segid "   A" and resid    2 and name   HA) 3.016 1.137 1.137 weight 1.000 ! spec=Noesy, no=772, id=771, vol=3.335984e+06
assign (segid "   A" and resid    2 and name  HG2) (segid "   A" and resid    5 and name   HB) 3.266 1.333 1.333 weight 1.000 ! spec=Noesy, no=773, id=772, vol=1.973926e+06
assign (segid "   A" and resid    1 and name  HB2) (segid "   A" and resid    5 and name   HB) 3.185 1.268 1.268 weight 1.000 ! spec=Noesy, no=774, id=773, vol=2.194340e+06
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name   HA) 3.117 1.215 1.215 weight 1.000 ! spec=Noesy, no=775, id=774, vol=2.556544e+06
assign (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   19 and name   HA) 3.131 1.226 1.226 weight 1.000 ! spec=Noesy, no=776, id=775, vol=2.506722e+06
assign (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   20 and name   HA) 3.011 1.133 1.133 weight 1.000 ! spec=Noesy, no=777, id=776, vol=2.456206e+06
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   20 and name   HA)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   20 and name   HA)
assign (segid "   A" and resid    1 and name  HB2) (segid "   A" and resid    1 and name   HA) 3.021 1.141 1.141 weight 1.000 ! spec=Noesy, no=778, id=777, vol=2.855860e+06
assign (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   37 and name   HB) 4.144 2.146 2.146 weight 1.000 ! spec=Noesy, no=779, id=778, vol=3.830440e+05
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   37 and name   HB)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   37 and name   HB)
assign (segid "   A" and resid    5 and name HG22) (segid "   A" and resid   31 and name   HA) 3.281 3.281 2.719 weight 1.000 ! spec=Noesy, no=780, id=779, vol=1.565856e+06
    or (segid "   A" and resid    5 and name HG23) (segid "   A" and resid   31 and name   HA)
    or (segid "   A" and resid    5 and name HG21) (segid "   A" and resid   31 and name   HA)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   31 and name   HA) 4.162 2.165 2.165 weight 1.000 ! spec=Noesy, no=781, id=780, vol=4.165720e+05
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   32 and name   HA) 3.475 1.509 1.509 weight 1.000 ! spec=Noesy, no=782, id=781, vol=1.414916e+06
assign (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HA) 2.176 0.592 0.592 weight 1.000 ! spec=Noesy, no=783, id=782, vol=1.306775e+07
    or (segid "   A" and resid   37 and name HG22) (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)
assign (segid "   A" and resid   30 and name HG23) (segid "   A" and resid   37 and name   HA) 2.587 0.837 0.837 weight 1.000 ! spec=Noesy, no=784, id=783, vol=3.698948e+06
    or (segid "   A" and resid   30 and name HG22) (segid "   A" and resid   37 and name   HA)
    or (segid "   A" and resid   30 and name HG21) (segid "   A" and resid   37 and name   HA)
assign (segid "   A" and resid    5 and name HG22) (segid "   A" and resid    5 and name   HA) 2.306 0.665 0.665 weight 1.000 ! spec=Noesy, no=785, id=784, vol=1.125726e+07
    or (segid "   A" and resid    5 and name HG23) (segid "   A" and resid    5 and name   HA)
    or (segid "   A" and resid    5 and name HG21) (segid "   A" and resid    5 and name   HA)
assign (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HB) 2.119 0.561 0.561 weight 1.000 ! spec=Noesy, no=786, id=785, vol=1.482112e+07
    or (segid "   A" and resid   37 and name HG22) (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 "   A" and resid   20 and name HG12) (segid "   A" and resid   20 and name   HA) 2.214 0.613 0.613 weight 1.000 ! spec=Noesy, no=787, id=786, vol=1.263199e+07
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   20 and name   HA)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   20 and name   HA)
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   20 and name   HA) 2.233 0.623 0.623 weight 1.000 ! spec=Noesy, no=788, id=787, vol=1.111632e+07
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   20 and name   HA)
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   20 and name   HA)
assign (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   17 and name   HA) 3.420 3.420 2.580 weight 1.000 ! spec=Noesy, no=789, id=788, vol=7.326580e+05
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   17 and name   HA)
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   17 and name   HA)
assign (segid "   A" and resid    9 and name HG13) (segid "   A" and resid    5 and name   HB) 3.931 1.932 1.932 weight 1.000 ! spec=Noesy, no=792, id=791, vol=4.235820e+05
    or (segid "   A" and resid    9 and name HG11) (segid "   A" and resid    5 and name   HB)
    or (segid "   A" and resid    9 and name HG12) (segid "   A" and resid    5 and name   HB)
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   32 and name  HB2) 4.102 2.103 2.103 weight 1.000 ! spec=Noesy, no=795, id=794, vol=4.687100e+05
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name   HA) 3.128 1.223 1.223 weight 1.000 ! spec=Noesy, no=796, id=795, vol=2.633630e+06
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name   HA) 3.243 1.314 1.314 weight 1.000 ! spec=Noesy, no=797, id=796, vol=2.199348e+06
assign (segid "   A" and resid    2 and name  HG1) (segid "   A" and resid   32 and name  HB1) 2.855 1.019 1.019 weight 1.000 ! spec=Noesy, no=798, id=797, vol=4.171820e+06
assign (segid "   A" and resid    2 and name  HG2) (segid "   A" and resid   32 and name  HB1) 3.385 1.432 1.432 weight 1.000 ! spec=Noesy, no=799, id=798, vol=1.635242e+06
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   32 and name  HB2) 3.430 1.471 1.471 weight 1.000 ! spec=Noesy, no=802, id=801, vol=1.380234e+06
assign (segid "   A" and resid   30 and name HG23) (segid "   A" and resid   34 and name   HA) 2.335 0.681 0.681 weight 1.000 ! spec=Noesy, no=803, id=802, vol=7.809750e+06
    or (segid "   A" and resid   30 and name HG22) (segid "   A" and resid   34 and name   HA)
    or (segid "   A" and resid   30 and name HG21) (segid "   A" and resid   34 and name   HA)
assign (segid "   A" and resid   16 and name HG11) (segid "   A" and resid   37 and name   HB) 3.173 1.259 1.259 weight 1.000 ! spec=Noesy, no=804, id=803, vol=2.288936e+06
assign (segid "   A" and resid    9 and name HG13) (segid "   A" and resid    6 and name   HA) 2.473 0.764 0.764 weight 1.000 ! spec=Noesy, no=805, id=804, vol=6.239374e+06
    or (segid "   A" and resid    9 and name HG11) (segid "   A" and resid    6 and name   HA)
    or (segid "   A" and resid    9 and name HG12) (segid "   A" and resid    6 and name   HA)
assign (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   37 and name   HB) 2.934 2.934 3.066 weight 1.000 ! spec=Noesy, no=807, id=806, vol=2.400236e+06
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   37 and name   HB)
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   37 and name   HB)
assign (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   18 and name  HB1) 3.510 1.540 1.540 weight 1.000 ! spec=Noesy, no=808, id=807, vol=9.538800e+05
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   18 and name  HB1)
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   18 and name  HB1)
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   18 and name  HB1) 3.926 1.926 1.926 weight 1.000 ! spec=Noesy, no=809, id=808, vol=5.263260e+05
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   18 and name  HB1)
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   18 and name  HB1)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   18 and name  HB1) 3.076 1.183 1.183 weight 1.000 ! spec=Noesy, no=810, id=809, vol=2.249318e+06
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   18 and name  HB1)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   18 and name  HB1)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   37 and name   HB) 3.056 1.167 1.167 weight 1.000 ! spec=Noesy, no=811, id=810, vol=2.154510e+06
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   37 and name   HB)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   37 and name   HB)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   22 and name  HD2) 3.118 1.215 1.215 weight 1.000 ! spec=Noesy, no=812, id=811, vol=2.100284e+06
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   22 and name  HD2)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   22 and name  HD2)
assign (segid "   A" and resid    9 and name HG21) (segid "   A" and resid    9 and name   HA) 2.630 0.865 0.865 weight 1.000 ! spec=Noesy, no=814, id=813, vol=5.225656e+06
    or (segid "   A" and resid    9 and name HG22) (segid "   A" and resid    9 and name   HA)
    or (segid "   A" and resid    9 and name HG23) (segid "   A" and resid    9 and name   HA)
assign (segid "   A" and resid    9 and name HG13) (segid "   A" and resid    9 and name   HA) 2.490 0.775 0.775 weight 1.000 ! spec=Noesy, no=815, id=814, vol=5.899830e+06
    or (segid "   A" and resid    9 and name HG11) (segid "   A" and resid    9 and name   HA)
    or (segid "   A" and resid    9 and name HG12) (segid "   A" and resid    9 and name   HA)
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    2 and name   HA) 3.003 1.127 1.127 weight 1.000 ! spec=Noesy, no=816, id=815, vol=3.369684e+06
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    5 and name   HB) 4.566 2.606 2.606 weight 1.000 ! spec=Noesy, no=817, id=816, vol=2.485540e+05
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   22 and name  HD1) 3.863 1.865 1.865 weight 1.000 ! spec=Noesy, no=818, id=817, vol=5.353840e+05
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   22 and name  HD1)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   22 and name  HD1)
assign (segid "   A" and resid   40 and name HG12) (segid "   A" and resid   13 and name  HA2) 2.934 1.076 1.076 weight 1.000 ! spec=Noesy, no=819, id=818, vol=2.495144e+06
    or (segid "   A" and resid   40 and name HG11) (segid "   A" and resid   13 and name  HA2)
    or (segid "   A" and resid   40 and name HG13) (segid "   A" and resid   13 and name  HA2)
assign (segid "   A" and resid   40 and name HG21) (segid "   A" and resid   13 and name  HA2) 3.052 3.052 2.948 weight 1.000 ! spec=Noesy, no=820, id=819, vol=1.852570e+06
    or (segid "   A" and resid   40 and name HG22) (segid "   A" and resid   13 and name  HA2)
    or (segid "   A" and resid   40 and name HG23) (segid "   A" and resid   13 and name  HA2)
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid   32 and name  HB1) 4.129 2.131 2.131 weight 1.000 ! spec=Noesy, no=821, id=820, vol=5.298520e+05
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name  HD2) 3.557 1.581 1.581 weight 1.000 ! spec=Noesy, no=822, id=821, vol=4.650120e+05
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   35 and name  HG1) 2.786 0.970 0.970 weight 1.000 ! spec=Noesy, no=823, id=822, vol=8.465820e+06
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   35 and name  HG2) 2.541 0.807 0.807 weight 1.000 ! spec=Noesy, no=824, id=823, vol=8.059092e+06
assign (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   35 and name  HG1) 2.823 0.996 0.996 weight 1.000 ! spec=Noesy, no=825, id=824, vol=4.148844e+06
assign (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   35 and name  HG2) 2.819 0.993 0.993 weight 1.000 ! spec=Noesy, no=826, id=825, vol=2.926428e+06
assign (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   11 and name  HB1) 4.158 2.161 2.161 weight 1.000 ! spec=Noesy, no=830, id=829, vol=4.219620e+05
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name  HD1) 2.910 1.058 1.058 weight 1.000 ! spec=Noesy, no=831, id=830, vol=4.059974e+06
assign (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name  HD2) 2.344 0.687 0.687 weight 1.000 ! spec=Noesy, no=833, id=832, vol=1.075106e+07
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   31 and name  HB1) 3.589 1.610 1.610 weight 1.000 ! spec=Noesy, no=834, id=833, vol=9.054880e+05
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   31 and name  HB2) 2.997 1.123 1.123 weight 1.000 ! spec=Noesy, no=838, id=837, vol=3.126546e+06
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   25 and name  HB2) 3.087 1.192 1.192 weight 1.000 ! spec=Noesy, no=839, id=838, vol=2.082326e+06
assign (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   28 and name  HB1) 3.441 3.441 2.559 weight 1.000 ! spec=Noesy, no=840, id=839, vol=1.427562e+06
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name  HE1) 3.418 1.460 1.460 weight 1.000 ! spec=Noesy, no=841, id=840, vol=1.331034e+06
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name  HD2) 3.433 1.473 1.473 weight 1.000 ! spec=Noesy, no=842, id=841, vol=1.408884e+06
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name  HE2) 3.954 1.954 1.954 weight 1.000 ! spec=Noesy, no=843, id=842, vol=6.311620e+05
assign (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   28 and name  HB2) 3.371 1.421 1.421 weight 1.000 ! spec=Noesy, no=847, id=846, vol=1.573528e+06
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name  HB1) 2.115 0.559 0.559 weight 1.000 ! spec=Noesy, no=848, id=847, vol=2.064932e+07
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   15 and name  HB2) 3.131 1.226 1.226 weight 1.000 ! spec=Noesy, no=849, id=848, vol=2.518000e+06
assign (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   25 and name  HB2) 3.513 1.542 1.542 weight 1.000 ! spec=Noesy, no=854, id=853, vol=8.874480e+05
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   25 and name  HB2)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   25 and name  HB2)
assign (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   28 and name  HB2) 3.207 1.286 1.286 weight 1.000 ! spec=Noesy, no=860, id=859, vol=1.468996e+06
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   28 and name  HB2)
assign (segid "   A" and resid    5 and name HG22) (segid "   A" and resid    2 and name  HD2) 2.649 0.877 0.877 weight 1.000 ! spec=Noesy, no=862, id=861, vol=5.210932e+06
    or (segid "   A" and resid    5 and name HG23) (segid "   A" and resid    2 and name  HD2)
    or (segid "   A" and resid    5 and name HG21) (segid "   A" and resid    2 and name  HD2)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   31 and name  HB2) 2.666 0.888 0.888 weight 1.000 ! spec=Noesy, no=864, id=863, vol=6.868560e+06
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   31 and name  HB1) 3.155 1.244 1.244 weight 1.000 ! spec=Noesy, no=865, id=864, vol=2.391950e+06
assign (segid "   A" and resid   40 and name HG12) (segid "   A" and resid   11 and name  HB1) 2.656 0.881 0.881 weight 1.000 ! spec=Noesy, no=868, id=867, vol=4.360136e+06
    or (segid "   A" and resid   40 and name HG11) (segid "   A" and resid   11 and name  HB1)
    or (segid "   A" and resid   40 and name HG13) (segid "   A" and resid   11 and name  HB1)
assign (segid "   A" and resid   40 and name HG21) (segid "   A" and resid   11 and name  HB1) 2.895 1.048 1.048 weight 1.000 ! spec=Noesy, no=869, id=868, vol=2.592438e+06
    or (segid "   A" and resid   40 and name HG22) (segid "   A" and resid   11 and name  HB1)
    or (segid "   A" and resid   40 and name HG23) (segid "   A" and resid   11 and name  HB1)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HE1) 3.159 1.247 1.247 weight 1.000 ! spec=Noesy, no=873, id=872, vol=2.361364e+06
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HE2) 3.217 1.293 1.293 weight 1.000 ! spec=Noesy, no=874, id=873, vol=2.297926e+06
assign (segid "   A" and resid   30 and name HG23) (segid "   A" and resid    4 and name  HB2) 3.755 1.762 1.762 weight 1.000 ! spec=Noesy, no=875, id=874, vol=5.934360e+05
    or (segid "   A" and resid   30 and name HG22) (segid "   A" and resid    4 and name  HB2)
    or (segid "   A" and resid   30 and name HG21) (segid "   A" and resid    4 and name  HB2)
assign (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   38 and name  HB1) 3.306 1.366 1.366 weight 1.000 ! spec=Noesy, no=877, id=876, vol=1.023190e+06
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   38 and name  HB1)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   38 and name  HB1)
assign (segid "   A" and resid   40 and name HG12) (segid "   A" and resid   28 and name  HB1) 2.756 0.949 0.949 weight 1.000 ! spec=Noesy, no=878, id=877, vol=3.712416e+06
    or (segid "   A" and resid   40 and name HG11) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   40 and name HG13) (segid "   A" and resid   28 and name  HB1)
assign (segid "   A" and resid   40 and name HG21) (segid "   A" and resid   28 and name  HB1) 2.450 0.750 0.750 weight 1.000 ! spec=Noesy, no=879, id=878, vol=7.274536e+06
    or (segid "   A" and resid   40 and name HG22) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   40 and name HG23) (segid "   A" and resid   28 and name  HB1)
assign (segid "   A" and resid   40 and name HG12) (segid "   A" and resid   28 and name  HB2) 2.876 1.034 1.034 weight 1.000 ! spec=Noesy, no=880, id=879, vol=2.655046e+06
    or (segid "   A" and resid   40 and name HG11) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid   40 and name HG13) (segid "   A" and resid   28 and name  HB2)
assign (segid "   A" and resid   40 and name HG21) (segid "   A" and resid   28 and name  HB2) 2.419 0.731 0.731 weight 1.000 ! spec=Noesy, no=881, id=880, vol=7.919818e+06
    or (segid "   A" and resid   40 and name HG22) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid   40 and name HG23) (segid "   A" and resid   28 and name  HB2)
assign (segid "   A" and resid   22 and name  HG1) (segid "   A" and resid   22 and name  HG2) 2.045 0.523 0.523 weight 1.000 ! spec=Noesy, no=882, id=881, vol=2.920506e+07
assign (segid "   A" and resid   22 and name  HB1) (segid "   A" and resid   22 and name  HB2) 1.973 0.486 0.486 weight 1.000 ! spec=Noesy, no=883, id=882, vol=3.707055e+07
assign (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   35 and name  HB2) 2.051 0.526 0.526 weight 1.000 ! spec=Noesy, no=884, id=883, vol=3.590145e+07
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name  HB1) 2.061 0.531 0.531 weight 1.000 ! spec=Noesy, no=885, id=884, vol=3.856546e+07
assign (segid "   A" and resid   22 and name  HB1) (segid "   A" and resid   22 and name  HG1) 2.677 0.896 0.896 weight 1.000 ! spec=Noesy, no=886, id=885, vol=4.597686e+06
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name  HB1) 2.010 0.505 0.505 weight 1.000 ! spec=Noesy, no=887, id=886, vol=3.790995e+07
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name  HB1) 3.238 1.311 1.311 weight 1.000 ! spec=Noesy, no=889, id=888, vol=2.025954e+06
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   15 and name  HB2) 3.148 1.238 1.238 weight 1.000 ! spec=Noesy, no=893, id=892, vol=2.468382e+06
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   35 and name  HB2) 4.000 2.000 2.000 weight 1.000 ! spec=Noesy, no=896, id=895, vol=5.238440e+05
assign (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   38 and name  HB2) 3.653 1.668 1.668 weight 1.000 ! spec=Noesy, no=897, id=896, vol=5.983000e+05
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   38 and name  HB2)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   38 and name  HB2)
assign (segid "   A" and resid   30 and name HG23) (segid "   A" and resid   34 and name  HB1) 2.950 1.088 1.088 weight 1.000 ! spec=Noesy, no=898, id=897, vol=2.080744e+06
    or (segid "   A" and resid   30 and name HG22) (segid "   A" and resid   34 and name  HB1)
    or (segid "   A" and resid   30 and name HG21) (segid "   A" and resid   34 and name  HB1)
assign (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   39 and name  HB1) 3.861 1.863 1.863 weight 1.000 ! spec=Noesy, no=903, id=902, vol=5.355820e+05
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   39 and name  HB1)
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   39 and name  HB1)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   39 and name  HB1) 4.108 2.109 2.109 weight 1.000 ! spec=Noesy, no=904, id=903, vol=4.754320e+05
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   39 and name  HB1)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   39 and name  HB1)
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name  HB1) 2.887 1.042 1.042 weight 1.000 ! spec=Noesy, no=905, id=904, vol=4.362666e+06
assign (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name  HB1) 1.749 0.382 0.382 weight 1.000 ! spec=Noesy, no=906, id=905, vol=7.176309e+07
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name  HB1) 2.027 0.514 0.514 weight 1.000 ! spec=Noesy, no=907, id=906, vol=2.839812e+07
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name  HB2) 2.934 1.076 1.076 weight 1.000 ! spec=Noesy, no=913, id=912, vol=3.769082e+06
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name  HB2) 2.920 1.066 1.066 weight 1.000 ! spec=Noesy, no=914, id=913, vol=3.760068e+06
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name  HB2) 2.655 0.881 0.881 weight 1.000 ! spec=Noesy, no=915, id=914, vol=5.827902e+06
assign (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   19 and name  HB2) 2.713 0.920 0.920 weight 1.000 ! spec=Noesy, no=916, id=915, vol=5.030712e+06
assign (segid "   A" and resid    5 and name HG22) (segid "   A" and resid    9 and name   HB) 3.454 1.491 1.491 weight 1.000 ! spec=Noesy, no=918, id=917, vol=1.275668e+06
    or (segid "   A" and resid    5 and name HG23) (segid "   A" and resid    9 and name   HB)
    or (segid "   A" and resid    5 and name HG21) (segid "   A" and resid    9 and name   HB)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   35 and name  HB1) 3.916 1.917 1.917 weight 1.000 ! spec=Noesy, no=919, id=918, vol=5.995680e+05
assign (segid "   A" and resid   30 and name HG23) (segid "   A" and resid   34 and name  HB2) 2.564 0.822 0.822 weight 1.000 ! spec=Noesy, no=920, id=919, vol=4.607952e+06
    or (segid "   A" and resid   30 and name HG22) (segid "   A" and resid   34 and name  HB2)
    or (segid "   A" and resid   30 and name HG21) (segid "   A" and resid   34 and name  HB2)
assign (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   19 and name  HB2) 3.499 1.530 1.530 weight 1.000 ! spec=Noesy, no=921, id=920, vol=8.881220e+05
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   19 and name  HB2)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   19 and name  HB2)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HB2) 2.168 0.587 0.587 weight 1.000 ! spec=Noesy, no=923, id=922, vol=2.372145e+07
assign (segid "   A" and resid    2 and name  HG2) (segid "   A" and resid    2 and name  HG1) 1.922 0.462 0.462 weight 1.000 ! spec=Noesy, no=926, id=925, vol=4.394748e+07
assign (segid "   A" and resid    1 and name  HB2) (segid "   A" and resid    1 and name   HG) 1.744 1.744 4.256 weight 1.000 ! spec=Noesy, no=927, id=926, vol=8.210799e+07
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name  HG2) 1.811 0.410 0.410 weight 1.000 ! spec=Noesy, no=928, id=927, vol=7.013808e+07
assign (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   27 and name  HB3) 2.046 0.523 0.523 weight 1.000 ! spec=Noesy, no=931, id=930, vol=1.789448e+07
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   27 and name  HB3)
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   27 and name  HB3)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   16 and name HG11) (segid "   A" and resid   16 and name   HB) 3.232 1.306 1.306 weight 1.000 ! spec=Noesy, no=932, id=931, vol=2.121854e+06
assign (segid "   A" and resid   20 and name HG12) (segid "   A" and resid   20 and name   HB) 1.906 0.454 0.454 weight 1.000 ! spec=Noesy, no=933, id=932, vol=2.892129e+07
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   20 and name   HB)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   20 and name   HB)
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   20 and name   HB) 1.961 0.481 0.481 weight 1.000 ! spec=Noesy, no=934, id=933, vol=2.202448e+07
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   20 and name   HB)
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   20 and name   HB)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   16 and name   HB) 2.414 0.728 0.728 weight 1.000 ! spec=Noesy, no=935, id=934, vol=8.630672e+06
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   16 and name   HB)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   16 and name   HB)
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   19 and name  HB1) 2.865 1.026 1.026 weight 1.000 ! spec=Noesy, no=936, id=935, vol=2.401144e+06
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   19 and name  HB1)
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   19 and name  HB1)
assign (segid "   A" and resid    9 and name HG13) (segid "   A" and resid    9 and name   HB) 2.104 0.554 0.554 weight 1.000 ! spec=Noesy, no=938, id=937, vol=1.915447e+07
    or (segid "   A" and resid    9 and name HG11) (segid "   A" and resid    9 and name   HB)
    or (segid "   A" and resid    9 and name HG12) (segid "   A" and resid    9 and name   HB)
assign (segid "   A" and resid    9 and name HG21) (segid "   A" and resid    9 and name   HB) 2.029 0.515 0.515 weight 1.000 ! spec=Noesy, no=939, id=938, vol=1.586227e+07
    or (segid "   A" and resid    9 and name HG22) (segid "   A" and resid    9 and name   HB)
    or (segid "   A" and resid    9 and name HG23) (segid "   A" and resid    9 and name   HB)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   22 and name  HG1) 3.422 1.464 1.464 weight 1.000 ! spec=Noesy, no=940, id=939, vol=1.178998e+06
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   22 and name  HG1)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   22 and name  HG1)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   22 and name  HG2) 3.737 1.745 1.745 weight 1.000 ! spec=Noesy, no=941, id=940, vol=7.301760e+05
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   22 and name  HG2)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   22 and name  HG2)
assign (segid "   A" and resid   16 and name HG11) (segid "   A" and resid   16 and name HG12) 2.148 0.577 0.577 weight 1.000 ! spec=Noesy, no=942, id=941, vol=2.462081e+07
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    2 and name  HG1) 3.440 1.479 1.479 weight 1.000 ! spec=Noesy, no=943, id=942, vol=1.423966e+06
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    2 and name  HB1) 2.519 0.793 0.793 weight 1.000 ! spec=Noesy, no=944, id=943, vol=9.864664e+06
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   16 and name HG12) 2.107 0.555 0.555 weight 1.000 ! spec=Noesy, no=945, id=944, vol=1.913951e+07
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   16 and name HG12)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   16 and name HG12)
assign (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   16 and name HG12) 2.592 0.840 0.840 weight 1.000 ! spec=Noesy, no=946, id=945, vol=3.841712e+06
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   16 and name HG12)
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   16 and name HG12)
assign (segid "   A" and resid   40 and name HG21) (segid "   A" and resid   26 and name  HB1) 2.878 1.035 1.035 weight 1.000 ! spec=Noesy, no=948, id=947, vol=2.624694e+06
    or (segid "   A" and resid   40 and name HG21) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   40 and name HG21) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   40 and name HG22) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   40 and name HG22) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   40 and name HG22) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   40 and name HG23) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   40 and name HG23) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   40 and name HG23) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid    9 and name HG13) (segid "   A" and resid    5 and name HG22) 2.364 0.699 0.699 weight 1.000 ! spec=Noesy, no=950, id=949, vol=6.969630e+06
    or (segid "   A" and resid    9 and name HG13) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    9 and name HG13) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    9 and name HG11) (segid "   A" and resid    5 and name HG22)
    or (segid "   A" and resid    9 and name HG11) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    9 and name HG11) (segid "   A" and resid    5 and name HG21)
    or (segid "   A" and resid    9 and name HG12) (segid "   A" and resid    5 and name HG22)
    or (segid "   A" and resid    9 and name HG12) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    9 and name HG12) (segid "   A" and resid    5 and name HG21)
assign (segid "   A" and resid   16 and name HD13) (segid "   A" and resid   16 and name HG11) 1.935 0.468 0.468 weight 1.000 ! spec=Noesy, no=953, id=952, vol=2.063568e+07
    or (segid "   A" and resid   16 and name HD11) (segid "   A" and resid   16 and name HG11)
    or (segid "   A" and resid   16 and name HD12) (segid "   A" and resid   16 and name HG11)
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   22 and name  HD2) 4.469 2.496 2.496 weight 1.000 ! spec=Noesy, no=954, id=953, vol=2.374280e+05
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   18 and name  HB1) 4.260 2.268 2.268 weight 1.000 ! spec=Noesy, no=955, id=954, vol=2.173320e+05
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name HG21) 3.068 1.177 1.177 weight 1.000 ! spec=Noesy, no=957, id=956, vol=2.213618e+06
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name HG22)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    5 and name HG22) 4.259 2.267 2.267 weight 1.000 ! spec=Noesy, no=958, id=957, vol=2.401300e+05
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    5 and name HG21)
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   18 and name  HB2) 4.403 2.424 2.424 weight 1.000 ! spec=Noesy, no=959, id=958, vol=2.363240e+05
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   33 and name  HB1) 3.761 1.769 1.769 weight 1.000 ! spec=Noesy, no=960, id=959, vol=6.480180e+05
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   32 and name  HB1) 4.228 2.235 2.235 weight 1.000 ! spec=Noesy, no=961, id=960, vol=2.529600e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    7 and name  HG1) 4.662 2.716 2.716 weight 1.000 ! spec=Noesy, no=962, id=961, vol=1.484040e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    7 and name  HG2) 4.439 2.463 2.463 weight 1.000 ! spec=Noesy, no=963, id=962, vol=2.013080e+05
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name   HA) 2.880 1.037 1.037 weight 1.000 ! spec=Noesy, no=964, id=963, vol=6.346786e+06
assign (segid "   A" and resid   28 and name  HD2) (segid "   A" and resid   38 and name  HB2) 4.644 2.696 2.696 weight 1.000 ! spec=Noesy, no=965, id=964, vol=1.894880e+05
    or (segid "   A" and resid   28 and name  HD1) (segid "   A" and resid   38 and name  HB2)
assign (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   13 and name  HA2) 4.435 2.459 2.459 weight 1.000 ! spec=Noesy, no=966, id=965, vol=2.735760e+05
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid   31 and name  HB1) 3.812 1.816 1.816 weight 1.000 ! spec=Noesy, no=967, id=966, vol=6.337660e+05
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    5 and name   HB) 3.597 1.617 1.617 weight 1.000 ! spec=Noesy, no=968, id=967, vol=9.433540e+05
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid   31 and name   HA) 4.634 2.684 2.684 weight 1.000 ! spec=Noesy, no=969, id=968, vol=1.840740e+05
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid   32 and name  HB1) 4.338 2.352 2.352 weight 1.000 ! spec=Noesy, no=970, id=969, vol=3.228340e+05
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid   31 and name  HB2) 4.828 2.914 2.914 weight 1.000 ! spec=Noesy, no=971, id=970, vol=1.842840e+05
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    2 and name  HG2) 4.484 2.513 2.513 weight 1.000 ! spec=Noesy, no=972, id=971, vol=2.569980e+05
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    5 and name HG22) 3.219 1.295 1.295 weight 1.000 ! spec=Noesy, no=973, id=972, vol=1.827186e+06
    or (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    5 and name HG23)
    or (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    5 and name HG21)
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    2 and name  HG1) 4.258 2.266 2.266 weight 1.000 ! spec=Noesy, no=974, id=973, vol=3.015880e+05
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    5 and name   HA) 4.621 2.669 2.669 weight 1.000 ! spec=Noesy, no=975, id=974, vol=2.060180e+05
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   39 and name   HA) 4.319 2.331 2.331 weight 1.000 ! spec=Noesy, no=976, id=975, vol=2.434920e+05
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   39 and name   HA)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name   HA) 4.339 2.353 2.353 weight 1.000 ! spec=Noesy, no=977, id=976, vol=2.761940e+05
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   37 and name HG21) 4.220 2.226 2.226 weight 1.000 ! spec=Noesy, no=978, id=977, vol=2.148300e+05
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   37 and name HG21) 4.265 2.274 2.274 weight 1.000 ! spec=Noesy, no=979, id=978, vol=2.425940e+05
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   36 and name  HB1) 3.858 3.858 2.142 weight 1.000 ! spec=Noesy, no=980, id=979, vol=4.530500e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   26 and name  HB1) 4.247 2.255 2.255 weight 1.000 ! spec=Noesy, no=981, id=980, vol=1.162140e+05
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid    4 and name  HB2) 4.400 2.420 2.420 weight 1.000 ! spec=Noesy, no=982, id=981, vol=2.660340e+05
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   25 and name  HB2) 4.449 2.474 2.474 weight 1.000 ! spec=Noesy, no=984, id=983, vol=1.993240e+05
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   38 and name  HB2) 4.867 2.961 2.961 weight 1.000 ! spec=Noesy, no=985, id=984, vol=1.737960e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name  HB1) 4.337 2.352 2.352 weight 1.000 ! spec=Noesy, no=986, id=985, vol=2.470260e+05
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   25 and name  HB1) 4.466 2.493 2.493 weight 1.000 ! spec=Noesy, no=987, id=986, vol=1.859000e+05
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   40 and name   HA) 4.604 2.650 2.650 weight 1.000 ! spec=Noesy, no=988, id=987, vol=2.185760e+05
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   13 and name  HA1) 4.438 2.462 2.462 weight 1.000 ! spec=Noesy, no=989, id=988, vol=1.924420e+05
assign (segid "   A" and resid   28 and name   HZ) (segid "   A" and resid   28 and name   HA) 4.608 2.654 2.654 weight 1.000 ! spec=Noesy, no=990, id=989, vol=1.708600e+05
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name   HA) 3.269 1.336 1.336 weight 1.000 ! spec=Noesy, no=991, id=990, vol=1.943382e+06
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    5 and name   HB) 4.442 2.467 2.467 weight 1.000 ! spec=Noesy, no=992, id=991, vol=1.535180e+05
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name  HB2) 4.821 2.905 2.905 weight 1.000 ! spec=Noesy, no=993, id=992, vol=1.347260e+05
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name  HD2) 4.348 2.363 2.363 weight 1.000 ! spec=Noesy, no=994, id=993, vol=2.795880e+05
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   13 and name  HA2) 4.369 2.386 2.386 weight 1.000 ! spec=Noesy, no=996, id=995, vol=2.320960e+05
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   13 and name  HA2)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name  HB2) 4.398 2.418 2.418 weight 1.000 ! spec=Noesy, no=997, id=996, vol=2.417980e+05
assign (segid "   A" and resid   33 and name  HZ3) (segid "   A" and resid   33 and name  HB2) 4.255 2.263 2.263 weight 1.000 ! spec=Noesy, no=998, id=997, vol=2.249000e+05
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    4 and name  HB1) 4.373 2.390 2.390 weight 1.000 ! spec=Noesy, no=999, id=998, vol=2.344940e+05
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   40 and name   HB) 2.801 2.801 3.199 weight 1.000 ! spec=Noesy, no=1000, id=999, vol=2.605538e+06
    or (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   40 and name   HB)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   40 and name   HB) 4.566 2.607 2.607 weight 1.000 ! spec=Noesy, no=1001, id=1000, vol=2.032160e+05
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   40 and name   HB) 4.613 2.660 2.660 weight 1.000 ! spec=Noesy, no=1002, id=1001, vol=1.663980e+05
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   36 and name  HB2) 4.331 2.345 2.345 weight 1.000 ! spec=Noesy, no=1003, id=1002, vol=2.604260e+05
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   34 and name  HB2) 4.426 2.449 2.449 weight 1.000 ! spec=Noesy, no=1004, id=1003, vol=2.210280e+05
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   16 and name   HB) 4.527 2.562 2.562 weight 1.000 ! spec=Noesy, no=1005, id=1004, vol=1.385040e+05
assign (segid "   A" and resid   33 and name  HE3) (segid "   A" and resid   34 and name  HG1) 4.117 2.119 2.119 weight 1.000 ! spec=Noesy, no=1006, id=1005, vol=3.249700e+05
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name  HA2) 3.899 1.901 1.901 weight 1.000 ! spec=Noesy, no=1007, id=1006, vol=7.363040e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   31 and name  HB2) 4.119 2.121 2.121 weight 1.000 ! spec=Noesy, no=1009, id=1008, vol=3.240240e+05
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid    2 and name  HG1) 4.897 2.997 2.997 weight 1.000 ! spec=Noesy, no=1010, id=1009, vol=2.011580e+05
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid    2 and name  HB1) 4.326 2.340 2.340 weight 1.000 ! spec=Noesy, no=1011, id=1010, vol=3.814860e+05
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name  HD1) 5.344 3.569 3.569 weight 1.000 ! spec=Noesy, no=1012, id=1011, vol=1.706000e+05
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid    4 and name   HN) 5.061 3.201 3.201 weight 1.000 ! spec=Noesy, no=1013, id=1012, vol=1.686180e+05
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   14 and name   HN) 4.643 2.695 2.695 weight 1.000 ! spec=Noesy, no=1014, id=1013, vol=2.080040e+05
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid    3 and name  HB1) 4.723 2.789 2.789 weight 1.000 ! spec=Noesy, no=1015, id=1014, vol=1.289820e+05
assign (segid "   A" and resid   33 and name  HE1) (segid "   A" and resid    3 and name  HB2) 5.081 3.227 3.227 weight 1.000 ! spec=Noesy, no=1016, id=1015, vol=1.031460e+05
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name  HB1) 3.711 1.722 1.722 weight 1.000 ! spec=Noesy, no=1017, id=1016, vol=1.066198e+06
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   14 and name  HB2) 4.023 2.023 2.023 weight 1.000 ! spec=Noesy, no=1018, id=1017, vol=7.058200e+05
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   14 and name  HB1) 4.333 2.347 2.347 weight 1.000 ! spec=Noesy, no=1019, id=1018, vol=4.089220e+05
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   14 and name  HE2) 4.819 2.903 2.903 weight 1.000 ! spec=Noesy, no=1020, id=1019, vol=1.681920e+05
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   14 and name  HE1)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   14 and name  HD2) 4.748 2.818 2.818 weight 1.000 ! spec=Noesy, no=1021, id=1020, vol=1.385140e+05
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   14 and name  HD1)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   28 and name  HB2) 4.708 2.771 2.771 weight 1.000 ! spec=Noesy, no=1022, id=1021, vol=1.735940e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   22 and name  HG1) 4.892 2.991 2.991 weight 1.000 ! spec=Noesy, no=1023, id=1022, vol=1.184740e+05
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   36 and name  HE2) 3.980 1.980 1.980 weight 1.000 ! spec=Noesy, no=1024, id=1023, vol=4.017100e+05
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   25 and name  HB2) 4.584 2.627 2.627 weight 1.000 ! spec=Noesy, no=1025, id=1024, vol=1.855060e+05
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   37 and name   HB) 4.690 2.750 2.750 weight 1.000 ! spec=Noesy, no=1026, id=1025, vol=1.803560e+05
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    6 and name   HN) 3.353 1.405 1.405 weight 1.000 ! spec=Noesy, no=1027, id=1026, vol=6.085920e+05
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name   HA) 3.888 1.890 1.890 weight 1.000 ! spec=Noesy, no=1028, id=1027, vol=6.920460e+05
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   30 and name   HA) 3.911 3.911 2.089 weight 1.000 ! spec=Noesy, no=1029, id=1028, vol=6.567780e+05
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   22 and name  HD2) 4.855 2.946 2.946 weight 1.000 ! spec=Noesy, no=1030, id=1029, vol=1.681240e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   22 and name  HD2)
assign (segid "   A" and resid   14 and name  HE2) (segid "   A" and resid   13 and name  HA2) 4.895 2.995 2.995 weight 1.000 ! spec=Noesy, no=1031, id=1030, vol=1.532240e+05
    or (segid "   A" and resid   14 and name  HE1) (segid "   A" and resid   13 and name  HA2)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   15 and name   HA) 4.417 2.439 2.439 weight 1.000 ! spec=Noesy, no=1032, id=1031, vol=2.553620e+05
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LEU   1           H1       LEU   1 -12.362   4.046  -8.667
    2    H2   LEU   1           H2       LEU   1 -13.105   4.342  -7.255
    3    H3   LEU   1           H3       LEU   1 -13.551   3.067  -8.152
    4    HA   LEU   1           HA       LEU   1 -11.452   2.010  -7.842
    5    HB2  LEU   1           HB2      LEU   1 -10.931   4.514  -6.256
    6    HB3  LEU   1           HB3      LEU   1 -10.032   3.040  -5.968
    7    HG   LEU   1           HG       LEU   1  -9.408   3.146  -8.460
    8   HD11  LEU   1          HD11      LEU   1 -10.341   5.981  -8.052
    9   HD12  LEU   1          HD12      LEU   1 -11.010   4.806  -9.180
   10   HD13  LEU   1          HD13      LEU   1  -9.374   5.412  -9.409
   11   HD21  LEU   1          HD21      LEU   1  -8.372   5.233  -6.548
   12   HD22  LEU   1          HD22      LEU   1  -7.545   4.655  -7.993
   13   HD23  LEU   1          HD23      LEU   1  -7.840   3.555  -6.648
   14    HA   PRO   2           HA       PRO   2 -13.144  -0.603  -4.761
   15    HB2  PRO   2           HB2      PRO   2 -10.489  -0.038  -3.484
   16    HB3  PRO   2           HB3      PRO   2 -11.382  -1.560  -3.556
   17    HG2  PRO   2           HG2      PRO   2  -9.444  -1.072  -5.295
   18    HG3  PRO   2           HG3      PRO   2 -10.946  -1.856  -5.826
   19    HD2  PRO   2           HD2      PRO   2  -9.951   0.867  -6.373
   20    HD3  PRO   2           HD3      PRO   2 -11.135  -0.104  -7.269
   21    H    ARG   3           H        ARG   3 -11.053   1.220  -2.551
   22    HA   ARG   3           HA       ARG   3 -13.185   2.775  -1.487
   23    HB2  ARG   3           HB2      ARG   3 -13.403   1.686   0.697
   24    HB3  ARG   3           HB3      ARG   3 -13.887   0.626  -0.603
   25    HG2  ARG   3           HG2      ARG   3 -11.914  -0.677  -0.395
   26    HG3  ARG   3           HG3      ARG   3 -11.193   0.491   0.713
   27    HD2  ARG   3           HD2      ARG   3 -13.739  -0.996   1.312
   28    HD3  ARG   3           HD3      ARG   3 -12.143  -1.577   1.789
   29    HE   ARG   3           HE       ARG   3 -12.136   0.892   2.818
   30   HH11  ARG   3          HH11      ARG   3 -14.534  -1.661   2.981
   31   HH12  ARG   3          HH12      ARG   3 -15.143  -1.166   4.527
   32   HH21  ARG   3          HH21      ARG   3 -12.948   1.549   4.851
   33   HH22  ARG   3          HH22      ARG   3 -14.242   0.665   5.593
   34    H    ASP   4           H        ASP   4 -10.054   1.304  -0.560
   35    HA   ASP   4           HA       ASP   4  -9.328   3.866   0.695
   36    HB2  ASP   4           HB2      ASP   4  -8.593   1.018   1.312
   37    HB3  ASP   4           HB3      ASP   4  -7.541   2.338   1.799
   38    H    THR   5           H        THR   5  -8.837   2.107  -2.055
   39    HA   THR   5           HA       THR   5  -6.108   2.220  -2.550
   40    HB   THR   5           HB       THR   5  -8.193   2.775  -4.652
   41    HG1  THR   5           HG1      THR   5  -7.655   0.140  -4.354
   42   HG21  THR   5          HG21      THR   5  -5.836   2.834  -5.349
   43   HG22  THR   5          HG22      THR   5  -6.689   1.468  -6.071
   44   HG23  THR   5          HG23      THR   5  -5.608   1.207  -4.702
   45    H    SER   6           H        SER   6  -8.616   4.640  -3.253
   46    HA   SER   6           HA       SER   6  -6.927   6.545  -4.457
   47    HB2  SER   6           HB2      SER   6  -9.508   7.082  -2.968
   48    HB3  SER   6           HB3      SER   6  -8.794   8.058  -4.250
   49    HG   SER   6           HG       SER   6 -10.398   6.805  -5.152
   50    H    ARG   7           H        ARG   7  -7.638   5.776  -1.170
   51    HA   ARG   7           HA       ARG   7  -6.845   8.184   0.060
   52    HB2  ARG   7           HB2      ARG   7  -8.161   6.653   1.297
   53    HB3  ARG   7           HB3      ARG   7  -7.050   5.331   0.988
   54    HG2  ARG   7           HG2      ARG   7  -5.411   6.315   2.455
   55    HG3  ARG   7           HG3      ARG   7  -6.441   7.728   2.704
   56    HD2  ARG   7           HD2      ARG   7  -8.172   6.270   3.662
   57    HD3  ARG   7           HD3      ARG   7  -7.115   4.879   3.437
   58    HE   ARG   7           HE       ARG   7  -5.892   6.930   4.986
   59   HH11  ARG   7          HH11      ARG   7  -8.122   4.249   5.105
   60   HH12  ARG   7          HH12      ARG   7  -7.910   3.974   6.808
   61   HH21  ARG   7          HH21      ARG   7  -5.584   6.567   7.237
   62   HH22  ARG   7          HH22      ARG   7  -6.446   5.275   8.013
   63    H    CYS   8           H        CYS   8  -5.106   5.139  -0.520
   64    HA   CYS   8           HA       CYS   8  -2.693   6.086   0.637
   65    HB2  CYS   8           HB2      CYS   8  -3.068   3.741  -1.207
   66    HB3  CYS   8           HB3      CYS   8  -1.813   3.972   0.011
   67    H    VAL   9           H        VAL   9  -3.881   5.791  -2.692
   68    HA   VAL   9           HA       VAL   9  -1.362   6.522  -3.846
   69    HB   VAL   9           HB       VAL   9  -3.072   5.225  -5.099
   70   HG11  VAL   9          HG11      VAL   9  -4.597   7.814  -5.222
   71   HG12  VAL   9          HG12      VAL   9  -5.055   6.380  -4.303
   72   HG13  VAL   9          HG13      VAL   9  -5.004   6.317  -6.065
   73   HG21  VAL   9          HG21      VAL   9  -2.345   7.842  -6.403
   74   HG22  VAL   9          HG22      VAL   9  -2.803   6.358  -7.238
   75   HG23  VAL   9          HG23      VAL   9  -1.310   6.419  -6.301
   76    H    GLY  10           H        GLY  10  -3.914   8.231  -2.368
   77    HA2  GLY  10           HA2      GLY  10  -3.437  10.808  -3.438
   78    HA3  GLY  10           HA3      GLY  10  -4.136  10.461  -1.861
   79    H    TYR  11           H        TYR  11  -1.656   8.779  -1.337
   80    HA   TYR  11           HA       TYR  11   0.082  10.930  -0.442
   81    HB2  TYR  11           HB2      TYR  11   0.090   7.943   0.046
   82    HB3  TYR  11           HB3      TYR  11   1.360   9.005   0.638
   83    HD1  TYR  11           HD1      TYR  11   0.997  10.458   2.500
   84    HD2  TYR  11           HD2      TYR  11  -2.195   8.086   0.989
   85    HE1  TYR  11           HE1      TYR  11  -0.307  10.934   4.524
   86    HE2  TYR  11           HE2      TYR  11  -3.505   8.557   3.009
   87    HH   TYR  11           HH       TYR  11  -2.636  10.975   5.242
   88    H    HIS  12           H        HIS  12   1.916   8.182  -1.017
   89    HA   HIS  12           HA       HIS  12   2.579   8.731  -3.778
   90    HB2  HIS  12           HB2      HIS  12   4.726   9.109  -1.672
   91    HB3  HIS  12           HB3      HIS  12   4.938   9.224  -3.409
   92    HD1  HIS  12           HD1      HIS  12   4.202  11.432  -4.545
   93    HD2  HIS  12           HD2      HIS  12   3.624  11.336  -0.433
   94    HE1  HIS  12           HE1      HIS  12   3.752  13.813  -3.874
   95    HE2  HIS  12           HE2      HIS  12   3.294  13.715  -1.397
   96    H    GLY  13           H        GLY  13   2.498   6.660  -4.451
   97    HA2  GLY  13           HA2      GLY  13   4.414   4.791  -4.086
   98    HA3  GLY  13           HA3      GLY  13   3.337   4.504  -2.725
   99    H    TYR  14           H        TYR  14   2.353   2.627  -3.253
  100    HA   TYR  14           HA       TYR  14   0.424   2.639  -5.335
  101    HB2  TYR  14           HB2      TYR  14   1.364   0.799  -6.696
  102    HB3  TYR  14           HB3      TYR  14   2.289   2.285  -6.810
  103    HD1  TYR  14           HD1      TYR  14   4.463   2.442  -5.475
  104    HD2  TYR  14           HD2      TYR  14   2.375  -1.216  -6.073
  105    HE1  TYR  14           HE1      TYR  14   6.514   1.191  -4.954
  106    HE2  TYR  14           HE2      TYR  14   4.418  -2.474  -5.549
  107    HH   TYR  14           HH       TYR  14   6.844  -2.122  -5.589
  108    H    CYS  15           H        CYS  15  -0.441   0.338  -5.694
  109    HA   CYS  15           HA       CYS  15  -0.749  -0.868  -3.025
  110    HB2  CYS  15           HB2      CYS  15  -2.710  -0.732  -5.324
  111    HB3  CYS  15           HB3      CYS  15  -3.011  -1.505  -3.772
  112    H    ILE  16           H        ILE  16  -0.386  -3.015  -2.784
  113    HA   ILE  16           HA       ILE  16   0.060  -4.594  -5.235
  114    HB   ILE  16           HB       ILE  16   1.873  -5.780  -4.195
  115   HG12  ILE  16          HG12      ILE  16   1.437  -4.021  -1.780
  116   HG13  ILE  16          HG13      ILE  16   0.982  -5.714  -1.886
  117   HG21  ILE  16          HG21      ILE  16   2.244  -2.812  -3.846
  118   HG22  ILE  16          HG22      ILE  16   2.469  -3.726  -5.337
  119   HG23  ILE  16          HG23      ILE  16   3.539  -4.003  -3.963
  120   HD11  ILE  16          HD11      ILE  16   3.349  -6.298  -2.191
  121   HD12  ILE  16          HD12      ILE  16   3.031  -5.492  -0.656
  122   HD13  ILE  16          HD13      ILE  16   3.772  -4.599  -1.984
  123    H    ARG  17           H        ARG  17  -0.388  -6.811  -5.069
  124    HA   ARG  17           HA       ARG  17  -2.199  -7.586  -2.938
  125    HB2  ARG  17           HB2      ARG  17  -2.005  -9.828  -4.404
  126    HB3  ARG  17           HB3      ARG  17  -3.111  -8.524  -4.792
  127    HG2  ARG  17           HG2      ARG  17  -2.006  -9.300  -6.787
  128    HG3  ARG  17           HG3      ARG  17  -1.500  -7.656  -6.428
  129    HD2  ARG  17           HD2      ARG  17   0.222  -9.750  -5.296
  130    HD3  ARG  17           HD3      ARG  17   0.175  -9.708  -7.057
  131    HE   ARG  17           HE       ARG  17   0.648  -7.151  -6.556
  132   HH11  ARG  17          HH11      ARG  17   2.066  -9.979  -5.042
  133   HH12  ARG  17          HH12      ARG  17   3.598  -9.212  -4.774
  134   HH21  ARG  17          HH21      ARG  17   2.661  -6.148  -6.175
  135   HH22  ARG  17          HH22      ARG  17   3.924  -7.035  -5.382
  136    H    SER  18           H        SER  18  -0.710  -7.544  -1.249
  137    HA   SER  18           HA       SER  18   0.455  -9.955  -0.504
  138    HB2  SER  18           HB2      SER  18   2.125  -9.288  -2.300
  139    HB3  SER  18           HB3      SER  18   2.533  -7.893  -1.302
  140    HG   SER  18           HG       SER  18   2.929 -10.637  -0.772
  141    H    LYS  19           H        LYS  19   1.357  -9.762   1.671
  142    HA   LYS  19           HA       LYS  19   0.469  -7.271   2.933
  143    HB2  LYS  19           HB2      LYS  19   1.117  -9.915   4.241
  144    HB3  LYS  19           HB3      LYS  19   0.405  -8.514   5.025
  145    HG2  LYS  19           HG2      LYS  19  -1.290  -8.996   2.906
  146    HG3  LYS  19           HG3      LYS  19  -0.849 -10.609   3.459
  147    HD2  LYS  19           HD2      LYS  19  -2.794  -9.971   4.662
  148    HD3  LYS  19           HD3      LYS  19  -1.439  -9.857   5.784
  149    HE2  LYS  19           HE2      LYS  19  -2.865  -7.931   6.054
  150    HE3  LYS  19           HE3      LYS  19  -1.330  -7.426   5.351
  151    HZ1  LYS  19           HZ1      LYS  19  -3.163  -6.390   4.240
  152    HZ2  LYS  19           HZ2      LYS  19  -3.838  -7.824   3.878
  153    HZ3  LYS  19           HZ3      LYS  19  -2.423  -7.401   3.199
  154    H    VAL  20           H        VAL  20   3.209  -8.386   1.679
  155    HA   VAL  20           HA       VAL  20   4.834  -6.929   3.656
  156    HB   VAL  20           HB       VAL  20   5.767  -9.201   1.889
  157   HG11  VAL  20          HG11      VAL  20   7.266  -7.581   3.949
  158   HG12  VAL  20          HG12      VAL  20   7.490  -7.499   2.201
  159   HG13  VAL  20          HG13      VAL  20   7.896  -8.977   3.073
  160   HG21  VAL  20          HG21      VAL  20   6.102 -10.423   3.980
  161   HG22  VAL  20          HG22      VAL  20   4.411  -9.976   3.769
  162   HG23  VAL  20          HG23      VAL  20   5.431  -9.069   4.884
  163    H    CYS  21           H        CYS  21   5.178  -4.990   2.836
  164    HA   CYS  21           HA       CYS  21   5.185  -4.502   0.008
  165    HB2  CYS  21           HB2      CYS  21   5.545  -2.744   2.427
  166    HB3  CYS  21           HB3      CYS  21   5.719  -2.128   0.786
  167    HA   PRO  22           HA       PRO  22   9.581  -4.867  -0.667
  168    HB2  PRO  22           HB2      PRO  22   9.631  -3.303  -2.923
  169    HB3  PRO  22           HB3      PRO  22   9.228  -5.025  -2.915
  170    HG2  PRO  22           HG2      PRO  22   7.430  -2.651  -3.025
  171    HG3  PRO  22           HG3      PRO  22   7.274  -4.221  -3.828
  172    HD2  PRO  22           HD2      PRO  22   5.839  -3.547  -1.637
  173    HD3  PRO  22           HD3      PRO  22   6.339  -5.216  -1.979
  174    H    LYS  23           H        LYS  23  11.374  -3.561  -0.312
  175    HA   LYS  23           HA       LYS  23  10.704  -0.986   0.843
  176    HB2  LYS  23           HB2      LYS  23  13.117  -2.762   1.032
  177    HB3  LYS  23           HB3      LYS  23  13.196  -1.078   1.541
  178    HG2  LYS  23           HG2      LYS  23  12.769  -2.496   3.447
  179    HG3  LYS  23           HG3      LYS  23  11.363  -1.485   3.129
  180    HD2  LYS  23           HD2      LYS  23  10.334  -3.409   1.924
  181    HD3  LYS  23           HD3      LYS  23  11.701  -4.400   2.430
  182    HE2  LYS  23           HE2      LYS  23   9.901  -2.934   4.348
  183    HE3  LYS  23           HE3      LYS  23   9.641  -4.605   3.851
  184    HZ1  LYS  23           HZ1      LYS  23  10.848  -4.412   5.931
  185    HZ2  LYS  23           HZ2      LYS  23  12.061  -3.628   5.187
  186    HZ3  LYS  23           HZ3      LYS  23  11.738  -5.172   4.802
  187    HA   PRO  24           HA       PRO  24  11.752   0.531   1.565
  188    HB2  PRO  24           HB2      PRO  24  12.026   3.168   1.463
  189    HB3  PRO  24           HB3      PRO  24  13.438   2.108   1.404
  190    HG2  PRO  24           HG2      PRO  24  12.083   3.590  -0.805
  191    HG3  PRO  24           HG3      PRO  24  13.811   3.293  -0.551
  192    HD2  PRO  24           HD2      PRO  24  12.103   1.831  -2.234
  193    HD3  PRO  24           HD3      PRO  24  13.722   1.342  -1.702
  194    H    PHE  25           H        PHE  25   9.640   0.142   1.835
  195    HA   PHE  25           HA       PHE  25   7.812   2.340   1.467
  196    HB2  PHE  25           HB2      PHE  25   7.416  -0.321   0.103
  197    HB3  PHE  25           HB3      PHE  25   6.046   0.679   0.561
  198    HD1  PHE  25           HD1      PHE  25   5.791   2.925  -0.431
  199    HD2  PHE  25           HD2      PHE  25   8.696   0.165  -1.846
  200    HE1  PHE  25           HE1      PHE  25   5.971   4.209  -2.513
  201    HE2  PHE  25           HE2      PHE  25   8.895   1.444  -3.940
  202    HZ   PHE  25           HZ       PHE  25   7.532   3.470  -4.276
  203    H    ALA  26           H        ALA  26   5.863   2.033   2.736
  204    HA   ALA  26           HA       ALA  26   6.243   0.047   4.885
  205    HB1  ALA  26           HB1      ALA  26   5.038   2.805   5.084
  206    HB2  ALA  26           HB2      ALA  26   6.633   2.329   5.666
  207    HB3  ALA  26           HB3      ALA  26   5.184   1.646   6.403
  208    H    ALA  27           H        ALA  27   4.417  -0.983   5.693
  209    HA   ALA  27           HA       ALA  27   2.281  -1.355   3.826
  210    HB1  ALA  27           HB1      ALA  27   1.398  -2.936   5.486
  211    HB2  ALA  27           HB2      ALA  27   2.620  -2.396   6.638
  212    HB3  ALA  27           HB3      ALA  27   3.107  -3.216   5.156
  213    H    PHE  28           H        PHE  28   1.248   0.590   3.620
  214    HA   PHE  28           HA       PHE  28   0.217   1.982   5.939
  215    HB2  PHE  28           HB2      PHE  28   1.147   3.141   3.903
  216    HB3  PHE  28           HB3      PHE  28  -0.235   2.566   2.994
  217    HD1  PHE  28           HD1      PHE  28   1.083   5.200   4.920
  218    HD2  PHE  28           HD2      PHE  28  -2.570   3.267   3.918
  219    HE1  PHE  28           HE1      PHE  28  -0.159   7.210   5.584
  220    HE2  PHE  28           HE2      PHE  28  -3.822   5.278   4.575
  221    HZ   PHE  28           HZ       PHE  28  -2.615   7.253   5.409
  222    H    GLY  29           H        GLY  29  -1.220   0.464   6.815
  223    HA2  GLY  29           HA2      GLY  29  -3.283  -0.445   7.185
  224    HA3  GLY  29           HA3      GLY  29  -3.885   0.858   6.176
  225    H    THR  30           H        THR  30  -5.079   0.197   4.569
  226    HA   THR  30           HA       THR  30  -4.346  -2.205   3.075
  227    HB   THR  30           HB       THR  30  -6.845  -2.772   3.027
  228    HG1  THR  30           HG1      THR  30  -7.146  -0.655   4.371
  229   HG21  THR  30          HG21      THR  30  -6.646  -4.118   5.070
  230   HG22  THR  30          HG22      THR  30  -5.239  -3.162   5.549
  231   HG23  THR  30          HG23      THR  30  -5.174  -4.166   4.099
  232    H    CYS  31           H        CYS  31  -4.696  -2.091   1.020
  233    HA   CYS  31           HA       CYS  31  -5.917   0.282  -0.154
  234    HB2  CYS  31           HB2      CYS  31  -4.014  -1.805  -1.086
  235    HB3  CYS  31           HB3      CYS  31  -5.078  -1.099  -2.293
  236    H    SER  32           H        SER  32  -6.699  -0.991  -2.572
  237    HA   SER  32           HA       SER  32  -9.235  -1.258  -2.596
  238    HB2  SER  32           HB2      SER  32  -7.631  -3.512  -3.752
  239    HB3  SER  32           HB3      SER  32  -9.125  -2.823  -4.378
  240    HG   SER  32           HG       SER  32  -7.310  -2.038  -5.522
  241    H    TRP  33           H        TRP  33 -10.556  -1.880  -1.084
  242    HA   TRP  33           HA       TRP  33 -11.755  -3.105   0.360
  243    HB2  TRP  33           HB2      TRP  33 -10.632  -5.503  -1.098
  244    HB3  TRP  33           HB3      TRP  33 -12.138  -5.419  -0.179
  245    HD1  TRP  33           HD1      TRP  33 -11.058  -5.380  -3.630
  246    HE1  TRP  33           HE1      TRP  33 -12.788  -4.225  -5.163
  247    HE3  TRP  33           HE3      TRP  33 -13.820  -2.967  -0.076
  248    HZ2  TRP  33           HZ2      TRP  33 -15.005  -2.494  -4.885
  249    HZ3  TRP  33           HZ3      TRP  33 -15.698  -1.557  -0.785
  250    HH2  TRP  33           HH2      TRP  33 -16.278  -1.334  -3.150
  251    H    ARG  34           H        ARG  34 -10.263  -6.013   0.803
  252    HA   ARG  34           HA       ARG  34  -8.226  -4.915   2.619
  253    HB2  ARG  34           HB2      ARG  34  -8.717  -6.673   4.266
  254    HB3  ARG  34           HB3      ARG  34 -10.090  -5.606   4.020
  255    HG2  ARG  34           HG2      ARG  34 -11.178  -7.272   2.646
  256    HG3  ARG  34           HG3      ARG  34  -9.778  -8.333   2.785
  257    HD2  ARG  34           HD2      ARG  34 -11.575  -8.990   4.318
  258    HD3  ARG  34           HD3      ARG  34 -10.120  -8.507   5.185
  259    HE   ARG  34           HE       ARG  34 -11.759  -6.262   4.958
  260   HH11  ARG  34          HH11      ARG  34 -11.821  -9.398   6.515
  261   HH12  ARG  34          HH12      ARG  34 -12.794  -8.858   7.846
  262   HH21  ARG  34          HH21      ARG  34 -13.038  -5.555   6.714
  263   HH22  ARG  34          HH22      ARG  34 -13.490  -6.679   7.955
  264    H    GLN  35           H        GLN  35  -8.129  -5.926  -0.075
  265    HA   GLN  35           HA       GLN  35  -6.876  -8.559   0.185
  266    HB2  GLN  35           HB2      GLN  35  -7.718  -7.012  -2.270
  267    HB3  GLN  35           HB3      GLN  35  -7.121  -8.667  -2.247
  268    HG2  GLN  35           HG2      GLN  35  -9.562  -7.818  -0.740
  269    HG3  GLN  35           HG3      GLN  35  -9.616  -8.351  -2.414
  270   HE21  GLN  35          HE21      GLN  35  -9.033  -9.291   0.875
  271   HE22  GLN  35          HE22      GLN  35  -9.094 -10.997   0.615
  272    H    LYS  36           H        LYS  36  -6.268  -5.275  -0.897
  273    HA   LYS  36           HA       LYS  36  -3.492  -6.034  -1.489
  274    HB2  LYS  36           HB2      LYS  36  -4.704  -3.424  -2.330
  275    HB3  LYS  36           HB3      LYS  36  -3.376  -4.306  -3.055
  276    HG2  LYS  36           HG2      LYS  36  -4.988  -6.007  -3.833
  277    HG3  LYS  36           HG3      LYS  36  -6.304  -5.008  -3.203
  278    HD2  LYS  36           HD2      LYS  36  -6.268  -4.291  -5.369
  279    HD3  LYS  36           HD3      LYS  36  -5.120  -3.157  -4.663
  280    HE2  LYS  36           HE2      LYS  36  -4.077  -3.908  -6.616
  281    HE3  LYS  36           HE3      LYS  36  -3.318  -4.836  -5.325
  282    HZ1  LYS  36           HZ1      LYS  36  -4.756  -6.667  -5.880
  283    HZ2  LYS  36           HZ2      LYS  36  -3.917  -6.219  -7.196
  284    HZ3  LYS  36           HZ3      LYS  36  -5.484  -5.809  -7.056
  285    H    THR  37           H        THR  37  -1.818  -4.885  -0.558
  286    HA   THR  37           HA       THR  37  -2.557  -3.211   1.740
  287    HB   THR  37           HB       THR  37   0.148  -4.415   1.092
  288    HG1  THR  37           HG1      THR  37  -0.775  -6.226   1.678
  289   HG21  THR  37          HG21      THR  37   0.230  -2.515   2.635
  290   HG22  THR  37          HG22      THR  37   0.608  -4.022   3.473
  291   HG23  THR  37          HG23      THR  37  -0.984  -3.285   3.657
  292    H    CYS  38           H        CYS  38  -1.687  -1.090   1.953
  293    HA   CYS  38           HA       CYS  38  -0.935   0.112  -0.574
  294    HB2  CYS  38           HB2      CYS  38  -1.279   1.359   2.147
  295    HB3  CYS  38           HB3      CYS  38  -1.178   2.216   0.616
  296    H    CYS  39           H        CYS  39   1.085   0.572  -1.165
  297    HA   CYS  39           HA       CYS  39   3.181   0.424   0.895
  298    HB2  CYS  39           HB2      CYS  39   3.421  -0.028  -2.088
  299    HB3  CYS  39           HB3      CYS  39   4.714  -0.208  -0.904
  300    H    VAL  40           H        VAL  40   3.674   2.401   1.532
  301    HA   VAL  40           HA       VAL  40   4.386   4.381  -0.504
  302    HB   VAL  40           HB       VAL  40   3.388   6.179   0.987
  303   HG11  VAL  40          HG11      VAL  40   2.387   5.425  -1.154
  304   HG12  VAL  40          HG12      VAL  40   1.196   6.001   0.016
  305   HG13  VAL  40          HG13      VAL  40   1.409   4.268  -0.244
  306   HG21  VAL  40          HG21      VAL  40   1.569   5.531   2.452
  307   HG22  VAL  40          HG22      VAL  40   3.079   4.782   2.972
  308   HG23  VAL  40          HG23      VAL  40   1.878   3.831   2.097
  Start of MODEL    2
    1    H1   LEU   1           H1       LEU   1 -13.874   4.120  -7.323
    2    H2   LEU   1           H2       LEU   1 -12.735   5.138  -7.868
    3    H3   LEU   1           H3       LEU   1 -13.246   5.244  -6.330
    4    HA   LEU   1           HA       LEU   1 -11.776   3.004  -7.495
    5    HB2  LEU   1           HB2      LEU   1 -10.960   5.127  -5.505
    6    HB3  LEU   1           HB3      LEU   1 -10.036   3.670  -5.797
    7    HG   LEU   1           HG       LEU   1 -10.034   4.504  -8.281
    8   HD11  LEU   1          HD11      LEU   1 -10.478   7.083  -6.788
    9   HD12  LEU   1          HD12      LEU   1 -11.577   6.359  -7.960
   10   HD13  LEU   1          HD13      LEU   1  -9.993   6.934  -8.476
   11   HD21  LEU   1          HD21      LEU   1  -8.354   5.749  -6.114
   12   HD22  LEU   1          HD22      LEU   1  -7.965   5.753  -7.833
   13   HD23  LEU   1          HD23      LEU   1  -8.041   4.230  -6.951
   14    HA   PRO   2           HA       PRO   2 -13.082  -0.037  -4.618
   15    HB2  PRO   2           HB2      PRO   2 -10.354   0.340  -3.444
   16    HB3  PRO   2           HB3      PRO   2 -11.240  -1.157  -3.741
   17    HG2  PRO   2           HG2      PRO   2  -9.366  -0.300  -5.435
   18    HG3  PRO   2           HG3      PRO   2 -10.843  -1.092  -6.022
   19    HD2  PRO   2           HD2      PRO   2 -10.016   1.721  -6.241
   20    HD3  PRO   2           HD3      PRO   2 -11.226   0.827  -7.178
   21    H    ARG   3           H        ARG   3 -10.789   1.537  -2.418
   22    HA   ARG   3           HA       ARG   3 -12.823   2.800  -0.865
   23    HB2  ARG   3           HB2      ARG   3 -12.581   1.363   1.149
   24    HB3  ARG   3           HB3      ARG   3 -13.336   0.551  -0.203
   25    HG2  ARG   3           HG2      ARG   3 -11.398  -0.719  -0.656
   26    HG3  ARG   3           HG3      ARG   3 -10.423   0.259   0.442
   27    HD2  ARG   3           HD2      ARG   3 -12.800  -1.280   1.415
   28    HD3  ARG   3           HD3      ARG   3 -11.220  -2.040   1.251
   29    HE   ARG   3           HE       ARG   3 -10.788   0.267   2.696
   30   HH11  ARG   3          HH11      ARG   3 -12.762  -2.609   3.083
   31   HH12  ARG   3          HH12      ARG   3 -12.607  -2.630   4.808
   32   HH21  ARG   3          HH21      ARG   3 -10.579   0.223   4.958
   33   HH22  ARG   3          HH22      ARG   3 -11.366  -1.021   5.876
   34    H    ASP   4           H        ASP   4  -9.542   1.429  -0.758
   35    HA   ASP   4           HA       ASP   4  -8.712   3.819   0.751
   36    HB2  ASP   4           HB2      ASP   4  -7.884   0.948   1.046
   37    HB3  ASP   4           HB3      ASP   4  -6.802   2.237   1.554
   38    H    THR   5           H        THR   5  -8.493   2.323  -2.172
   39    HA   THR   5           HA       THR   5  -5.854   2.477  -2.970
   40    HB   THR   5           HB       THR   5  -8.102   3.343  -4.761
   41    HG1  THR   5           HG1      THR   5  -7.675   0.636  -4.643
   42   HG21  THR   5          HG21      THR   5  -5.687   1.582  -5.205
   43   HG22  THR   5          HG22      THR   5  -5.804   3.283  -5.655
   44   HG23  THR   5          HG23      THR   5  -6.846   2.091  -6.432
   45    H    SER   6           H        SER   6  -8.349   5.003  -3.332
   46    HA   SER   6           HA       SER   6  -6.602   6.941  -4.397
   47    HB2  SER   6           HB2      SER   6  -8.510   8.525  -3.689
   48    HB3  SER   6           HB3      SER   6  -8.893   7.253  -4.848
   49    HG   SER   6           HG       SER   6 -10.043   7.704  -2.529
   50    H    ARG   7           H        ARG   7  -7.387   5.998  -1.167
   51    HA   ARG   7           HA       ARG   7  -6.337   8.216   0.236
   52    HB2  ARG   7           HB2      ARG   7  -7.776   6.494   1.255
   53    HB3  ARG   7           HB3      ARG   7  -6.514   5.300   1.020
   54    HG2  ARG   7           HG2      ARG   7  -5.074   6.539   2.569
   55    HG3  ARG   7           HG3      ARG   7  -6.385   7.695   2.837
   56    HD2  ARG   7           HD2      ARG   7  -7.821   5.776   3.539
   57    HD3  ARG   7           HD3      ARG   7  -6.399   4.744   3.446
   58    HE   ARG   7           HE       ARG   7  -5.772   6.879   5.118
   59   HH11  ARG   7          HH11      ARG   7  -7.912   4.112   5.020
   60   HH12  ARG   7          HH12      ARG   7  -8.057   4.000   6.747
   61   HH21  ARG   7          HH21      ARG   7  -5.954   6.730   7.404
   62   HH22  ARG   7          HH22      ARG   7  -6.933   5.482   8.102
   63    H    CYS   8           H        CYS   8  -4.967   5.228  -1.001
   64    HA   CYS   8           HA       CYS   8  -2.386   5.532   0.123
   65    HB2  CYS   8           HB2      CYS   8  -3.274   3.375  -0.609
   66    HB3  CYS   8           HB3      CYS   8  -3.317   3.943  -2.275
   67    H    VAL   9           H        VAL   9  -3.769   6.316  -3.042
   68    HA   VAL   9           HA       VAL   9  -1.301   7.358  -4.075
   69    HB   VAL   9           HB       VAL   9  -4.075   7.939  -5.110
   70   HG11  VAL   9          HG11      VAL   9  -2.329   9.304  -6.097
   71   HG12  VAL   9          HG12      VAL   9  -2.949   8.149  -7.277
   72   HG13  VAL   9          HG13      VAL   9  -1.400   7.858  -6.489
   73   HG21  VAL   9          HG21      VAL   9  -3.863   5.546  -4.840
   74   HG22  VAL   9          HG22      VAL   9  -2.327   5.564  -5.709
   75   HG23  VAL   9          HG23      VAL   9  -3.822   5.971  -6.552
   76    H    GLY  10           H        GLY  10  -3.918   8.543  -2.183
   77    HA2  GLY  10           HA2      GLY  10  -3.619  11.305  -2.411
   78    HA3  GLY  10           HA3      GLY  10  -4.081  10.468  -0.933
   79    H    TYR  11           H        TYR  11  -1.733   8.932  -0.644
   80    HA   TYR  11           HA       TYR  11   0.242  10.908   0.125
   81    HB2  TYR  11           HB2      TYR  11   0.155   7.893   0.387
   82    HB3  TYR  11           HB3      TYR  11   1.513   8.874   0.926
   83    HD1  TYR  11           HD1      TYR  11   1.491   9.917   3.015
   84    HD2  TYR  11           HD2      TYR  11  -2.118   8.296   1.459
   85    HE1  TYR  11           HE1      TYR  11   0.403  10.272   5.188
   86    HE2  TYR  11           HE2      TYR  11  -3.220   8.643   3.627
   87    HH   TYR  11           HH       TYR  11  -2.695   8.953   5.933
   88    H    HIS  12           H        HIS  12   1.838   8.133  -0.823
   89    HA   HIS  12           HA       HIS  12   2.081   8.684  -3.645
   90    HB2  HIS  12           HB2      HIS  12   4.579   8.931  -1.947
   91    HB3  HIS  12           HB3      HIS  12   4.456   9.147  -3.682
   92    HD1  HIS  12           HD1      HIS  12   3.479  11.433  -4.516
   93    HD2  HIS  12           HD2      HIS  12   3.980  11.135  -0.400
   94    HE1  HIS  12           HE1      HIS  12   3.327  13.788  -3.645
   95    HE2  HIS  12           HE2      HIS  12   3.812  13.601  -1.177
   96    H    GLY  13           H        GLY  13   1.774   6.552  -4.227
   97    HA2  GLY  13           HA2      GLY  13   3.808   4.680  -3.962
   98    HA3  GLY  13           HA3      GLY  13   2.707   4.390  -2.625
   99    H    TYR  14           H        TYR  14   1.858   2.460  -3.232
  100    HA   TYR  14           HA       TYR  14  -0.021   2.407  -5.383
  101    HB2  TYR  14           HB2      TYR  14   1.068   0.658  -6.733
  102    HB3  TYR  14           HB3      TYR  14   1.980   2.159  -6.739
  103    HD1  TYR  14           HD1      TYR  14   2.022  -1.365  -5.957
  104    HD2  TYR  14           HD2      TYR  14   4.077   2.313  -5.360
  105    HE1  TYR  14           HE1      TYR  14   4.031  -2.604  -5.283
  106    HE2  TYR  14           HE2      TYR  14   6.091   1.081  -4.678
  107    HH   TYR  14           HH       TYR  14   6.419  -2.297  -5.126
  108    H    CYS  15           H        CYS  15  -0.646  -0.021  -5.803
  109    HA   CYS  15           HA       CYS  15  -1.215  -1.104  -3.129
  110    HB2  CYS  15           HB2      CYS  15  -2.751  -1.400  -5.719
  111    HB3  CYS  15           HB3      CYS  15  -3.250  -2.022  -4.149
  112    H    ILE  16           H        ILE  16  -0.669  -3.184  -2.622
  113    HA   ILE  16           HA       ILE  16   0.046  -4.970  -4.851
  114    HB   ILE  16           HB       ILE  16   1.902  -5.872  -3.734
  115   HG12  ILE  16          HG12      ILE  16   1.145  -4.255  -1.302
  116   HG13  ILE  16          HG13      ILE  16   0.899  -5.985  -1.484
  117   HG21  ILE  16          HG21      ILE  16   2.407  -3.752  -4.771
  118   HG22  ILE  16          HG22      ILE  16   3.381  -3.963  -3.317
  119   HG23  ILE  16          HG23      ILE  16   1.975  -2.899  -3.290
  120   HD11  ILE  16          HD11      ILE  16   2.843  -5.563  -0.127
  121   HD12  ILE  16          HD12      ILE  16   3.544  -4.557  -1.394
  122   HD13  ILE  16          HD13      ILE  16   3.333  -6.286  -1.659
  123    H    ARG  17           H        ARG  17  -0.468  -7.146  -4.566
  124    HA   ARG  17           HA       ARG  17  -2.243  -7.791  -2.358
  125    HB2  ARG  17           HB2      ARG  17  -1.986 -10.140  -3.681
  126    HB3  ARG  17           HB3      ARG  17  -3.170  -8.914  -4.092
  127    HG2  ARG  17           HG2      ARG  17  -2.081  -9.767  -6.083
  128    HG3  ARG  17           HG3      ARG  17  -1.697  -8.066  -5.849
  129    HD2  ARG  17           HD2      ARG  17   0.233  -9.899  -4.630
  130    HD3  ARG  17           HD3      ARG  17   0.113 -10.048  -6.382
  131    HE   ARG  17           HE       ARG  17   0.358  -7.412  -6.133
  132   HH11  ARG  17          HH11      ARG  17   2.121  -9.958  -4.505
  133   HH12  ARG  17          HH12      ARG  17   3.594  -9.047  -4.418
  134   HH21  ARG  17          HH21      ARG  17   2.288  -6.217  -6.030
  135   HH22  ARG  17          HH22      ARG  17   3.687  -6.915  -5.279
  136    H    SER  18           H        SER  18  -0.749  -7.636  -0.677
  137    HA   SER  18           HA       SER  18   0.445  -9.964   0.224
  138    HB2  SER  18           HB2      SER  18   2.111  -9.561  -1.595
  139    HB3  SER  18           HB3      SER  18   2.482  -7.996  -0.876
  140    HG   SER  18           HG       SER  18   3.078 -10.578   0.048
  141    H    LYS  19           H        LYS  19   1.276  -9.649   2.373
  142    HA   LYS  19           HA       LYS  19   0.711  -6.999   3.469
  143    HB2  LYS  19           HB2      LYS  19   1.403  -9.561   4.916
  144    HB3  LYS  19           HB3      LYS  19   0.839  -8.070   5.656
  145    HG2  LYS  19           HG2      LYS  19  -0.715  -9.859   3.806
  146    HG3  LYS  19           HG3      LYS  19  -0.953  -9.671   5.538
  147    HD2  LYS  19           HD2      LYS  19  -1.343  -7.533   3.446
  148    HD3  LYS  19           HD3      LYS  19  -2.624  -8.423   4.265
  149    HE2  LYS  19           HE2      LYS  19  -2.000  -7.452   6.385
  150    HE3  LYS  19           HE3      LYS  19  -0.608  -6.659   5.651
  151    HZ1  LYS  19           HZ1      LYS  19  -3.428  -6.085   5.082
  152    HZ2  LYS  19           HZ2      LYS  19  -2.181  -5.418   4.282
  153    HZ3  LYS  19           HZ3      LYS  19  -2.382  -5.114   5.868
  154    H    VAL  20           H        VAL  20   3.173  -8.129   1.916
  155    HA   VAL  20           HA       VAL  20   5.188  -6.999   3.743
  156    HB   VAL  20           HB       VAL  20   5.648  -9.161   1.681
  157   HG11  VAL  20          HG11      VAL  20   7.885  -9.316   2.659
  158   HG12  VAL  20          HG12      VAL  20   7.508  -7.966   3.731
  159   HG13  VAL  20          HG13      VAL  20   7.580  -7.712   1.989
  160   HG21  VAL  20          HG21      VAL  20   5.569  -9.354   4.690
  161   HG22  VAL  20          HG22      VAL  20   6.033 -10.650   3.588
  162   HG23  VAL  20          HG23      VAL  20   4.384 -10.027   3.569
  163    H    CYS  21           H        CYS  21   5.412  -4.976   2.975
  164    HA   CYS  21           HA       CYS  21   5.425  -4.434   0.145
  165    HB2  CYS  21           HB2      CYS  21   5.788  -2.700   2.587
  166    HB3  CYS  21           HB3      CYS  21   5.939  -2.076   0.947
  167    HA   PRO  22           HA       PRO  22   9.837  -4.700  -0.363
  168    HB2  PRO  22           HB2      PRO  22  10.021  -3.337  -2.696
  169    HB3  PRO  22           HB3      PRO  22   9.452  -5.008  -2.602
  170    HG2  PRO  22           HG2      PRO  22   7.905  -2.488  -2.922
  171    HG3  PRO  22           HG3      PRO  22   7.606  -4.091  -3.607
  172    HD2  PRO  22           HD2      PRO  22   6.269  -3.045  -1.440
  173    HD3  PRO  22           HD3      PRO  22   6.423  -4.776  -1.787
  174    H    LYS  23           H        LYS  23  11.672  -3.304  -0.269
  175    HA   LYS  23           HA       LYS  23  10.942  -0.734   0.893
  176    HB2  LYS  23           HB2      LYS  23  13.410  -2.433   1.101
  177    HB3  LYS  23           HB3      LYS  23  13.430  -0.739   1.581
  178    HG2  LYS  23           HG2      LYS  23  13.070  -2.083   3.526
  179    HG3  LYS  23           HG3      LYS  23  11.580  -1.215   3.161
  180    HD2  LYS  23           HD2      LYS  23  10.734  -3.269   2.035
  181    HD3  LYS  23           HD3      LYS  23  12.183  -4.113   2.582
  182    HE2  LYS  23           HE2      LYS  23  10.126  -2.804   4.358
  183    HE3  LYS  23           HE3      LYS  23  10.273  -4.534   4.057
  184    HZ1  LYS  23           HZ1      LYS  23  11.323  -3.933   6.106
  185    HZ2  LYS  23           HZ2      LYS  23  12.286  -2.850   5.368
  186    HZ3  LYS  23           HZ3      LYS  23  12.460  -4.435   5.054
  187    HA   PRO  24           HA       PRO  24  11.816   0.841   1.533
  188    HB2  PRO  24           HB2      PRO  24  12.013   3.481   1.345
  189    HB3  PRO  24           HB3      PRO  24  13.456   2.462   1.393
  190    HG2  PRO  24           HG2      PRO  24  12.190   3.851  -0.918
  191    HG3  PRO  24           HG3      PRO  24  13.904   3.555  -0.585
  192    HD2  PRO  24           HD2      PRO  24  12.225   2.039  -2.276
  193    HD3  PRO  24           HD3      PRO  24  13.852   1.604  -1.728
  194    H    PHE  25           H        PHE  25   9.701   0.408   1.755
  195    HA   PHE  25           HA       PHE  25   7.825   2.533   1.205
  196    HB2  PHE  25           HB2      PHE  25   7.576  -0.199  -0.032
  197    HB3  PHE  25           HB3      PHE  25   6.139   0.706   0.406
  198    HD1  PHE  25           HD1      PHE  25   8.898   0.429  -1.957
  199    HD2  PHE  25           HD2      PHE  25   5.598   2.795  -0.704
  200    HE1  PHE  25           HE1      PHE  25   8.976   1.663  -4.086
  201    HE2  PHE  25           HE2      PHE  25   5.658   4.037  -2.819
  202    HZ   PHE  25           HZ       PHE  25   7.357   3.470  -4.522
  203    H    ALA  26           H        ALA  26   5.856   2.254   2.436
  204    HA   ALA  26           HA       ALA  26   6.250   0.464   4.742
  205    HB1  ALA  26           HB1      ALA  26   4.774   3.098   4.663
  206    HB2  ALA  26           HB2      ALA  26   6.395   2.852   5.313
  207    HB3  ALA  26           HB3      ALA  26   5.012   2.078   6.082
  208    H    ALA  27           H        ALA  27   4.614  -0.850   5.366
  209    HA   ALA  27           HA       ALA  27   2.491  -1.371   3.533
  210    HB1  ALA  27           HB1      ALA  27   1.801  -3.083   5.136
  211    HB2  ALA  27           HB2      ALA  27   2.936  -2.439   6.323
  212    HB3  ALA  27           HB3      ALA  27   3.536  -3.163   4.829
  213    H    PHE  28           H        PHE  28   1.260   0.441   3.386
  214    HA   PHE  28           HA       PHE  28   0.204   1.751   5.739
  215    HB2  PHE  28           HB2      PHE  28   0.959   3.008   3.752
  216    HB3  PHE  28           HB3      PHE  28  -0.277   2.228   2.782
  217    HD1  PHE  28           HD1      PHE  28   0.538   4.988   4.865
  218    HD2  PHE  28           HD2      PHE  28  -2.721   2.673   3.409
  219    HE1  PHE  28           HE1      PHE  28  -0.999   6.825   5.391
  220    HE2  PHE  28           HE2      PHE  28  -4.264   4.511   3.933
  221    HZ   PHE  28           HZ       PHE  28  -3.407   6.590   4.919
  222    H    GLY  29           H        GLY  29  -1.052   0.086   6.641
  223    HA2  GLY  29           HA2      GLY  29  -2.964  -1.094   7.043
  224    HA3  GLY  29           HA3      GLY  29  -3.739   0.301   6.313
  225    H    THR  30           H        THR  30  -4.691   0.114   4.402
  226    HA   THR  30           HA       THR  30  -4.361  -2.363   2.882
  227    HB   THR  30           HB       THR  30  -6.883  -2.426   2.642
  228    HG1  THR  30           HG1      THR  30  -7.809  -0.724   3.533
  229   HG21  THR  30          HG21      THR  30  -5.654  -2.936   5.351
  230   HG22  THR  30          HG22      THR  30  -5.638  -4.038   3.973
  231   HG23  THR  30          HG23      THR  30  -7.165  -3.642   4.768
  232    H    CYS  31           H        CYS  31  -5.141  -2.267   0.787
  233    HA   CYS  31           HA       CYS  31  -5.518   0.417  -0.356
  234    HB2  CYS  31           HB2      CYS  31  -3.652  -1.620  -1.032
  235    HB3  CYS  31           HB3      CYS  31  -4.808  -1.492  -2.349
  236    H    SER  32           H        SER  32  -6.385  -0.568  -2.889
  237    HA   SER  32           HA       SER  32  -8.991  -0.858  -2.946
  238    HB2  SER  32           HB2      SER  32  -7.296  -2.858  -4.407
  239    HB3  SER  32           HB3      SER  32  -8.785  -2.095  -4.951
  240    HG   SER  32           HG       SER  32  -6.634  -1.267  -5.754
  241    H    TRP  33           H        TRP  33 -10.212  -1.797  -1.453
  242    HA   TRP  33           HA       TRP  33 -11.204  -3.295  -0.101
  243    HB2  TRP  33           HB2      TRP  33 -10.181  -5.337  -2.075
  244    HB3  TRP  33           HB3      TRP  33 -11.564  -5.505  -0.992
  245    HD1  TRP  33           HD1      TRP  33 -11.009  -4.926  -4.465
  246    HE1  TRP  33           HE1      TRP  33 -12.900  -3.563  -5.567
  247    HE3  TRP  33           HE3      TRP  33 -13.212  -3.034  -0.254
  248    HZ2  TRP  33           HZ2      TRP  33 -15.026  -1.892  -4.749
  249    HZ3  TRP  33           HZ3      TRP  33 -15.149  -1.543  -0.503
  250    HH2  TRP  33           HH2      TRP  33 -16.037  -0.991  -2.714
  251    H    ARG  34           H        ARG  34 -10.852  -5.359   1.250
  252    HA   ARG  34           HA       ARG  34  -8.373  -4.957   2.652
  253    HB2  ARG  34           HB2      ARG  34  -9.233  -6.565   4.262
  254    HB3  ARG  34           HB3      ARG  34 -10.470  -5.385   3.859
  255    HG2  ARG  34           HG2      ARG  34 -11.529  -7.001   2.361
  256    HG3  ARG  34           HG3      ARG  34 -10.287  -8.187   2.766
  257    HD2  ARG  34           HD2      ARG  34 -12.237  -6.933   4.696
  258    HD3  ARG  34           HD3      ARG  34 -12.338  -8.566   4.041
  259    HE   ARG  34           HE       ARG  34  -9.876  -8.463   5.214
  260   HH11  ARG  34          HH11      ARG  34 -13.143  -7.846   6.305
  261   HH12  ARG  34          HH12      ARG  34 -12.824  -8.322   7.941
  262   HH21  ARG  34          HH21      ARG  34  -9.449  -9.089   7.364
  263   HH22  ARG  34          HH22      ARG  34 -10.714  -9.016   8.549
  264    H    GLN  35           H        GLN  35  -8.281  -6.045  -0.065
  265    HA   GLN  35           HA       GLN  35  -7.200  -8.742   0.353
  266    HB2  GLN  35           HB2      GLN  35  -7.810  -7.356  -2.258
  267    HB3  GLN  35           HB3      GLN  35  -7.514  -9.071  -1.999
  268    HG2  GLN  35           HG2      GLN  35  -9.841  -7.615  -0.793
  269    HG3  GLN  35           HG3      GLN  35  -9.902  -8.390  -2.368
  270   HE21  GLN  35          HE21      GLN  35  -9.625  -8.883   1.051
  271   HE22  GLN  35          HE22      GLN  35  -9.999 -10.565   1.047
  272    H    LYS  36           H        LYS  36  -6.475  -5.498  -0.652
  273    HA   LYS  36           HA       LYS  36  -3.713  -6.293  -1.293
  274    HB2  LYS  36           HB2      LYS  36  -4.959  -3.735  -2.254
  275    HB3  LYS  36           HB3      LYS  36  -3.597  -4.604  -2.911
  276    HG2  LYS  36           HG2      LYS  36  -6.319  -5.821  -2.967
  277    HG3  LYS  36           HG3      LYS  36  -5.844  -4.621  -4.170
  278    HD2  LYS  36           HD2      LYS  36  -4.165  -7.035  -3.572
  279    HD3  LYS  36           HD3      LYS  36  -5.470  -7.069  -4.761
  280    HE2  LYS  36           HE2      LYS  36  -3.382  -4.934  -4.862
  281    HE3  LYS  36           HE3      LYS  36  -3.058  -6.524  -5.530
  282    HZ1  LYS  36           HZ1      LYS  36  -3.940  -4.976  -7.162
  283    HZ2  LYS  36           HZ2      LYS  36  -5.313  -4.823  -6.309
  284    HZ3  LYS  36           HZ3      LYS  36  -4.928  -6.254  -6.973
  285    H    THR  37           H        THR  37  -2.056  -5.133  -0.388
  286    HA   THR  37           HA       THR  37  -2.770  -3.274   1.771
  287    HB   THR  37           HB       THR  37  -0.119  -4.625   1.176
  288    HG1  THR  37           HG1      THR  37  -1.093  -6.280   2.040
  289   HG21  THR  37          HG21      THR  37   0.114  -2.527   2.448
  290   HG22  THR  37          HG22      THR  37   0.525  -3.936   3.427
  291   HG23  THR  37          HG23      THR  37  -1.032  -3.134   3.643
  292    H    CYS  38           H        CYS  38  -1.850  -1.197   1.832
  293    HA   CYS  38           HA       CYS  38  -0.988  -0.156  -0.735
  294    HB2  CYS  38           HB2      CYS  38  -2.557   1.236   0.363
  295    HB3  CYS  38           HB3      CYS  38  -1.705   1.118   1.900
  296    H    CYS  39           H        CYS  39   1.021   0.615  -1.187
  297    HA   CYS  39           HA       CYS  39   3.031   0.389   0.954
  298    HB2  CYS  39           HB2      CYS  39   3.388  -0.157  -2.000
  299    HB3  CYS  39           HB3      CYS  39   4.680  -0.184  -0.798
  300    H    VAL  40           H        VAL  40   3.487   2.365   1.587
  301    HA   VAL  40           HA       VAL  40   4.231   4.335  -0.452
  302    HB   VAL  40           HB       VAL  40   3.256   6.128   1.097
  303   HG11  VAL  40          HG11      VAL  40   2.300   5.500  -1.083
  304   HG12  VAL  40          HG12      VAL  40   1.062   5.971   0.084
  305   HG13  VAL  40          HG13      VAL  40   1.327   4.264  -0.279
  306   HG21  VAL  40          HG21      VAL  40   1.412   5.479   2.509
  307   HG22  VAL  40          HG22      VAL  40   2.873   4.631   3.021
  308   HG23  VAL  40          HG23      VAL  40   1.645   3.785   2.075
  Start of MODEL    3
    1    H1   LEU   1           H1       LEU   1 -14.102   3.273  -7.738
    2    H2   LEU   1           H2       LEU   1 -12.970   4.336  -8.211
    3    H3   LEU   1           H3       LEU   1 -13.554   4.395  -6.695
    4    HA   LEU   1           HA       LEU   1 -12.056   2.145  -7.792
    5    HB2  LEU   1           HB2      LEU   1 -11.167   4.398  -5.991
    6    HB3  LEU   1           HB3      LEU   1 -10.247   2.928  -6.239
    7    HG   LEU   1           HG       LEU   1 -10.944   4.935  -8.384
    8   HD11  LEU   1          HD11      LEU   1  -9.324   5.819  -6.803
    9   HD12  LEU   1          HD12      LEU   1  -8.556   5.462  -8.350
   10   HD13  LEU   1          HD13      LEU   1  -8.335   4.369  -6.985
   11   HD21  LEU   1          HD21      LEU   1 -10.771   2.697  -9.296
   12   HD22  LEU   1          HD22      LEU   1  -9.234   2.452  -8.466
   13   HD23  LEU   1          HD23      LEU   1  -9.358   3.647  -9.757
   14    HA   PRO   2           HA       PRO   2 -13.202  -0.790  -4.737
   15    HB2  PRO   2           HB2      PRO   2 -10.525  -0.080  -3.604
   16    HB3  PRO   2           HB3      PRO   2 -11.272  -1.666  -3.773
   17    HG2  PRO   2           HG2      PRO   2  -9.473  -0.650  -5.543
   18    HG3  PRO   2           HG3      PRO   2 -10.727  -1.822  -5.993
   19    HD2  PRO   2           HD2      PRO   2 -10.465   0.927  -6.825
   20    HD3  PRO   2           HD3      PRO   2 -11.697  -0.253  -7.312
   21    H    ARG   3           H        ARG   3 -11.058   1.100  -2.664
   22    HA   ARG   3           HA       ARG   3 -13.161   2.476  -1.338
   23    HB2  ARG   3           HB2      ARG   3 -12.951   1.323   0.854
   24    HB3  ARG   3           HB3      ARG   3 -13.675   0.342  -0.399
   25    HG2  ARG   3           HG2      ARG   3 -11.718  -0.973  -0.627
   26    HG3  ARG   3           HG3      ARG   3 -10.786   0.132   0.386
   27    HD2  ARG   3           HD2      ARG   3 -13.192  -1.390   1.360
   28    HD3  ARG   3           HD3      ARG   3 -11.535  -1.971   1.527
   29    HE   ARG   3           HE       ARG   3 -11.206   0.303   2.713
   30   HH11  ARG   3          HH11      ARG   3 -14.140  -1.617   2.860
   31   HH12  ARG   3          HH12      ARG   3 -14.533  -1.120   4.474
   32   HH21  ARG   3          HH21      ARG   3 -11.739   0.967   4.823
   33   HH22  ARG   3          HH22      ARG   3 -13.175   0.360   5.584
   34    H    ASP   4           H        ASP   4  -9.871   1.192  -0.866
   35    HA   ASP   4           HA       ASP   4  -9.181   3.714   0.469
   36    HB2  ASP   4           HB2      ASP   4  -8.195   0.903   0.815
   37    HB3  ASP   4           HB3      ASP   4  -7.198   2.262   1.304
   38    H    THR   5           H        THR   5  -8.853   2.184  -2.434
   39    HA   THR   5           HA       THR   5  -6.234   2.521  -3.235
   40    HB   THR   5           HB       THR   5  -8.542   3.305  -4.996
   41    HG1  THR   5           HG1      THR   5  -7.805   0.610  -4.835
   42   HG21  THR   5          HG21      THR   5  -5.970   1.804  -5.513
   43   HG22  THR   5          HG22      THR   5  -6.280   3.494  -5.920
   44   HG23  THR   5          HG23      THR   5  -7.188   2.208  -6.722
   45    H    SER   6           H        SER   6  -8.870   4.901  -3.491
   46    HA   SER   6           HA       SER   6  -7.319   7.015  -4.483
   47    HB2  SER   6           HB2      SER   6  -9.806   7.295  -2.782
   48    HB3  SER   6           HB3      SER   6  -9.223   8.398  -4.028
   49    HG   SER   6           HG       SER   6 -10.277   7.262  -5.428
   50    H    ARG   7           H        ARG   7  -7.945   5.881  -1.252
   51    HA   ARG   7           HA       ARG   7  -6.942   8.086   0.188
   52    HB2  ARG   7           HB2      ARG   7  -8.270   6.401   1.285
   53    HB3  ARG   7           HB3      ARG   7  -7.124   5.144   0.849
   54    HG2  ARG   7           HG2      ARG   7  -5.452   6.193   2.313
   55    HG3  ARG   7           HG3      ARG   7  -6.653   7.401   2.784
   56    HD2  ARG   7           HD2      ARG   7  -8.102   5.625   3.632
   57    HD3  ARG   7           HD3      ARG   7  -6.915   4.418   3.151
   58    HE   ARG   7           HE       ARG   7  -5.921   6.427   4.968
   59   HH11  ARG   7          HH11      ARG   7  -7.446   3.290   4.633
   60   HH12  ARG   7          HH12      ARG   7  -6.972   2.758   6.221
   61   HH21  ARG   7          HH21      ARG   7  -5.302   5.732   7.051
   62   HH22  ARG   7          HH22      ARG   7  -5.749   4.146   7.598
   63    H    CYS   8           H        CYS   8  -5.427   5.053  -0.870
   64    HA   CYS   8           HA       CYS   8  -2.876   5.595   0.181
   65    HB2  CYS   8           HB2      CYS   8  -3.518   3.352  -0.401
   66    HB3  CYS   8           HB3      CYS   8  -3.750   3.806  -2.088
   67    H    VAL   9           H        VAL   9  -4.271   6.220  -3.018
   68    HA   VAL   9           HA       VAL   9  -1.765   7.227  -4.031
   69    HB   VAL   9           HB       VAL   9  -3.386   6.094  -5.519
   70   HG11  VAL   9          HG11      VAL   9  -5.461   6.791  -4.595
   71   HG12  VAL   9          HG12      VAL   9  -5.396   7.293  -6.284
   72   HG13  VAL   9          HG13      VAL   9  -5.135   8.476  -5.001
   73   HG21  VAL   9          HG21      VAL   9  -3.307   7.691  -7.387
   74   HG22  VAL   9          HG22      VAL   9  -1.776   7.596  -6.518
   75   HG23  VAL   9          HG23      VAL   9  -2.855   8.965  -6.253
   76    H    GLY  10           H        GLY  10  -4.224   8.480  -2.104
   77    HA2  GLY  10           HA2      GLY  10  -3.889  11.248  -2.685
   78    HA3  GLY  10           HA3      GLY  10  -4.449  10.574  -1.155
   79    H    TYR  11           H        TYR  11  -2.002   8.858  -1.130
   80    HA   TYR  11           HA       TYR  11  -0.100  10.815  -0.101
   81    HB2  TYR  11           HB2      TYR  11  -0.194   7.790   0.082
   82    HB3  TYR  11           HB3      TYR  11   1.080   8.783   0.780
   83    HD1  TYR  11           HD1      TYR  11  -2.543   8.037   0.954
   84    HD2  TYR  11           HD2      TYR  11   0.797   9.844   2.862
   85    HE1  TYR  11           HE1      TYR  11  -3.870   8.312   3.001
   86    HE2  TYR  11           HE2      TYR  11  -0.520  10.121   4.918
   87    HH   TYR  11           HH       TYR  11  -2.846  10.261   5.612
   88    H    HIS  12           H        HIS  12   1.633   8.144  -0.934
   89    HA   HIS  12           HA       HIS  12   2.168   8.788  -3.693
   90    HB2  HIS  12           HB2      HIS  12   4.325   9.302  -1.619
   91    HB3  HIS  12           HB3      HIS  12   4.542   9.367  -3.358
   92    HD1  HIS  12           HD1      HIS  12   3.829  11.520  -4.554
   93    HD2  HIS  12           HD2      HIS  12   2.991  11.497  -0.485
   94    HE1  HIS  12           HE1      HIS  12   3.221  13.889  -3.978
   95    HE2  HIS  12           HE2      HIS  12   2.478  13.785  -1.573
   96    H    GLY  13           H        GLY  13   2.124   6.683  -4.351
   97    HA2  GLY  13           HA2      GLY  13   4.228   4.950  -4.010
   98    HA3  GLY  13           HA3      GLY  13   3.119   4.559  -2.705
   99    H    TYR  14           H        TYR  14   2.178   2.692  -3.264
  100    HA   TYR  14           HA       TYR  14   0.430   2.629  -5.514
  101    HB2  TYR  14           HB2      TYR  14   1.469   0.802  -6.755
  102    HB3  TYR  14           HB3      TYR  14   2.500   2.218  -6.734
  103    HD1  TYR  14           HD1      TYR  14   2.315  -1.284  -6.176
  104    HD2  TYR  14           HD2      TYR  14   4.423   2.216  -4.984
  105    HE1  TYR  14           HE1      TYR  14   4.182  -2.683  -5.410
  106    HE2  TYR  14           HE2      TYR  14   6.296   0.827  -4.209
  107    HH   TYR  14           HH       TYR  14   6.558  -2.498  -4.960
  108    H    CYS  15           H        CYS  15  -0.344   0.260  -5.862
  109    HA   CYS  15           HA       CYS  15  -0.933  -0.780  -3.166
  110    HB2  CYS  15           HB2      CYS  15  -2.728  -0.554  -5.587
  111    HB3  CYS  15           HB3      CYS  15  -3.170  -1.379  -4.097
  112    H    ILE  16           H        ILE  16  -0.378  -2.835  -2.823
  113    HA   ILE  16           HA       ILE  16   0.049  -4.564  -5.178
  114    HB   ILE  16           HB       ILE  16   1.703  -5.788  -3.972
  115   HG12  ILE  16          HG12      ILE  16   1.049  -4.070  -1.574
  116   HG13  ILE  16          HG13      ILE  16   0.569  -5.748  -1.775
  117   HG21  ILE  16          HG21      ILE  16   2.510  -3.749  -4.984
  118   HG22  ILE  16          HG22      ILE  16   3.394  -4.085  -3.494
  119   HG23  ILE  16          HG23      ILE  16   2.136  -2.847  -3.515
  120   HD11  ILE  16          HD11      ILE  16   2.934  -6.397  -1.815
  121   HD12  ILE  16          HD12      ILE  16   2.469  -5.599  -0.313
  122   HD13  ILE  16          HD13      ILE  16   3.382  -4.714  -1.537
  123    H    ARG  17           H        ARG  17  -0.733  -6.670  -5.092
  124    HA   ARG  17           HA       ARG  17  -2.748  -7.171  -3.065
  125    HB2  ARG  17           HB2      ARG  17  -2.895  -9.400  -4.522
  126    HB3  ARG  17           HB3      ARG  17  -3.702  -7.918  -4.986
  127    HG2  ARG  17           HG2      ARG  17  -2.705  -8.841  -6.926
  128    HG3  ARG  17           HG3      ARG  17  -1.771  -7.418  -6.492
  129    HD2  ARG  17           HD2      ARG  17  -0.867 -10.052  -5.457
  130    HD3  ARG  17           HD3      ARG  17  -0.642  -9.724  -7.170
  131    HE   ARG  17           HE       ARG  17   0.450  -7.537  -6.095
  132   HH11  ARG  17          HH11      ARG  17   0.815 -10.919  -5.258
  133   HH12  ARG  17          HH12      ARG  17   2.450 -10.738  -4.711
  134   HH21  ARG  17          HH21      ARG  17   2.600  -7.297  -5.365
  135   HH22  ARG  17          HH22      ARG  17   3.467  -8.675  -4.767
  136    H    SER  18           H        SER  18  -1.359  -7.313  -1.348
  137    HA   SER  18           HA       SER  18  -0.536  -9.819  -0.459
  138    HB2  SER  18           HB2      SER  18   1.667  -8.079  -1.603
  139    HB3  SER  18           HB3      SER  18   1.982  -9.264  -0.339
  140    HG   SER  18           HG       SER  18   0.600 -10.095  -2.628
  141    H    LYS  19           H        LYS  19   0.975  -9.400   1.591
  142    HA   LYS  19           HA       LYS  19   0.387  -6.725   2.659
  143    HB2  LYS  19           HB2      LYS  19   0.242  -9.340   4.166
  144    HB3  LYS  19           HB3      LYS  19   0.115  -7.749   4.907
  145    HG2  LYS  19           HG2      LYS  19  -1.823  -7.401   3.219
  146    HG3  LYS  19           HG3      LYS  19  -1.813  -9.162   3.117
  147    HD2  LYS  19           HD2      LYS  19  -2.149  -9.317   5.521
  148    HD3  LYS  19           HD3      LYS  19  -2.106  -7.558   5.654
  149    HE2  LYS  19           HE2      LYS  19  -4.156  -9.218   4.195
  150    HE3  LYS  19           HE3      LYS  19  -4.397  -8.297   5.677
  151    HZ1  LYS  19           HZ1      LYS  19  -3.741  -7.129   3.071
  152    HZ2  LYS  19           HZ2      LYS  19  -4.029  -6.302   4.440
  153    HZ3  LYS  19           HZ3      LYS  19  -5.228  -7.149   3.737
  154    H    VAL  20           H        VAL  20   2.699  -7.817   1.308
  155    HA   VAL  20           HA       VAL  20   4.693  -7.221   3.383
  156    HB   VAL  20           HB       VAL  20   5.063  -9.210   1.128
  157   HG11  VAL  20          HG11      VAL  20   7.112  -8.016   1.661
  158   HG12  VAL  20          HG12      VAL  20   7.215  -9.691   2.204
  159   HG13  VAL  20          HG13      VAL  20   6.911  -8.403   3.369
  160   HG21  VAL  20          HG21      VAL  20   5.190 -10.906   2.891
  161   HG22  VAL  20          HG22      VAL  20   3.617 -10.110   2.871
  162   HG23  VAL  20          HG23      VAL  20   4.808  -9.679   4.098
  163    H    CYS  21           H        CYS  21   5.183  -5.172   2.844
  164    HA   CYS  21           HA       CYS  21   5.353  -4.381   0.062
  165    HB2  CYS  21           HB2      CYS  21   5.530  -2.857   2.657
  166    HB3  CYS  21           HB3      CYS  21   5.822  -2.104   1.090
  167    HA   PRO  22           HA       PRO  22   9.757  -4.998  -0.039
  168    HB2  PRO  22           HB2      PRO  22  10.138  -3.844  -2.471
  169    HB3  PRO  22           HB3      PRO  22   9.568  -5.503  -2.259
  170    HG2  PRO  22           HG2      PRO  22   8.043  -3.043  -2.944
  171    HG3  PRO  22           HG3      PRO  22   7.798  -4.710  -3.483
  172    HD2  PRO  22           HD2      PRO  22   6.284  -3.481  -1.562
  173    HD3  PRO  22           HD3      PRO  22   6.513  -5.235  -1.674
  174    H    LYS  23           H        LYS  23  11.568  -3.723   0.272
  175    HA   LYS  23           HA       LYS  23  11.063  -1.049   1.120
  176    HB2  LYS  23           HB2      LYS  23  13.466  -1.045   1.670
  177    HB3  LYS  23           HB3      LYS  23  12.615  -2.437   2.331
  178    HG2  LYS  23           HG2      LYS  23  13.408  -3.731   0.327
  179    HG3  LYS  23           HG3      LYS  23  14.451  -2.353  -0.041
  180    HD2  LYS  23           HD2      LYS  23  15.505  -2.556   2.129
  181    HD3  LYS  23           HD3      LYS  23  14.427  -3.896   2.530
  182    HE2  LYS  23           HE2      LYS  23  16.376  -3.901   0.230
  183    HE3  LYS  23           HE3      LYS  23  16.692  -4.628   1.805
  184    HZ1  LYS  23           HZ1      LYS  23  14.528  -5.404  -0.022
  185    HZ2  LYS  23           HZ2      LYS  23  14.816  -6.075   1.431
  186    HZ3  LYS  23           HZ3      LYS  23  15.898  -6.243   0.232
  187    HA   PRO  24           HA       PRO  24  11.950   0.505   1.557
  188    HB2  PRO  24           HB2      PRO  24  12.205   3.146   1.263
  189    HB3  PRO  24           HB3      PRO  24  13.618   2.087   1.275
  190    HG2  PRO  24           HG2      PRO  24  12.290   3.452  -1.005
  191    HG3  PRO  24           HG3      PRO  24  14.001   3.062  -0.770
  192    HD2  PRO  24           HD2      PRO  24  12.118   1.606  -2.302
  193    HD3  PRO  24           HD3      PRO  24  13.760   1.102  -1.868
  194    H    PHE  25           H        PHE  25   9.809   0.119   1.869
  195    HA   PHE  25           HA       PHE  25   7.975   2.303   1.435
  196    HB2  PHE  25           HB2      PHE  25   7.607  -0.373   0.104
  197    HB3  PHE  25           HB3      PHE  25   6.213   0.576   0.596
  198    HD1  PHE  25           HD1      PHE  25   8.803   0.151  -1.883
  199    HD2  PHE  25           HD2      PHE  25   5.860   2.829  -0.380
  200    HE1  PHE  25           HE1      PHE  25   8.901   1.435  -3.981
  201    HE2  PHE  25           HE2      PHE  25   5.942   4.116  -2.467
  202    HZ   PHE  25           HZ       PHE  25   7.472   3.422  -4.277
  203    H    ALA  26           H        ALA  26   5.994   2.000   2.681
  204    HA   ALA  26           HA       ALA  26   6.410   0.127   4.922
  205    HB1  ALA  26           HB1      ALA  26   5.244   1.716   6.336
  206    HB2  ALA  26           HB2      ALA  26   4.964   2.773   4.953
  207    HB3  ALA  26           HB3      ALA  26   6.605   2.503   5.539
  208    H    ALA  27           H        ALA  27   4.673  -1.066   5.664
  209    HA   ALA  27           HA       ALA  27   2.554  -1.577   3.818
  210    HB1  ALA  27           HB1      ALA  27   3.468  -3.363   5.205
  211    HB2  ALA  27           HB2      ALA  27   1.743  -3.158   5.515
  212    HB3  ALA  27           HB3      ALA  27   2.928  -2.526   6.660
  213    H    PHE  28           H        PHE  28   1.430   0.313   3.560
  214    HA   PHE  28           HA       PHE  28   0.394   1.751   5.850
  215    HB2  PHE  28           HB2      PHE  28   1.289   2.944   3.867
  216    HB3  PHE  28           HB3      PHE  28   0.026   2.231   2.877
  217    HD1  PHE  28           HD1      PHE  28  -2.398   2.819   3.446
  218    HD2  PHE  28           HD2      PHE  28   0.952   4.949   4.976
  219    HE1  PHE  28           HE1      PHE  28  -3.851   4.732   3.945
  220    HE2  PHE  28           HE2      PHE  28  -0.501   6.862   5.492
  221    HZ   PHE  28           HZ       PHE  28  -2.905   6.754   4.968
  222    H    GLY  29           H        GLY  29  -1.038   0.239   6.747
  223    HA2  GLY  29           HA2      GLY  29  -3.070  -0.764   7.083
  224    HA3  GLY  29           HA3      GLY  29  -3.684   0.641   6.228
  225    H    THR  30           H        THR  30  -4.849   0.241   4.508
  226    HA   THR  30           HA       THR  30  -4.310  -2.145   2.913
  227    HB   THR  30           HB       THR  30  -6.810  -2.488   2.747
  228    HG1  THR  30           HG1      THR  30  -7.233  -0.351   3.775
  229   HG21  THR  30          HG21      THR  30  -6.921  -3.739   4.863
  230   HG22  THR  30          HG22      THR  30  -5.485  -2.881   5.432
  231   HG23  THR  30          HG23      THR  30  -5.371  -3.968   4.046
  232    H    CYS  31           H        CYS  31  -4.931  -2.056   0.843
  233    HA   CYS  31           HA       CYS  31  -5.718   0.535  -0.285
  234    HB2  CYS  31           HB2      CYS  31  -4.006  -1.690  -1.227
  235    HB3  CYS  31           HB3      CYS  31  -5.030  -0.944  -2.442
  236    H    SER  32           H        SER  32  -6.665  -0.547  -2.746
  237    HA   SER  32           HA       SER  32  -9.215  -1.090  -2.710
  238    HB2  SER  32           HB2      SER  32  -7.432  -3.034  -4.123
  239    HB3  SER  32           HB3      SER  32  -8.939  -2.320  -4.686
  240    HG   SER  32           HG       SER  32  -7.007  -1.393  -5.632
  241    H    TRP  33           H        TRP  33 -10.297  -2.069  -1.135
  242    HA   TRP  33           HA       TRP  33 -11.081  -3.566   0.348
  243    HB2  TRP  33           HB2      TRP  33  -9.985  -5.672  -1.519
  244    HB3  TRP  33           HB3      TRP  33 -11.351  -5.815  -0.415
  245    HD1  TRP  33           HD1      TRP  33 -10.840  -5.502  -3.930
  246    HE1  TRP  33           HE1      TRP  33 -12.814  -4.376  -5.130
  247    HE3  TRP  33           HE3      TRP  33 -13.156  -3.392   0.109
  248    HZ2  TRP  33           HZ2      TRP  33 -15.042  -2.782  -4.460
  249    HZ3  TRP  33           HZ3      TRP  33 -15.185  -2.057  -0.264
  250    HH2  TRP  33           HH2      TRP  33 -16.109  -1.769  -2.508
  251    H    ARG  34           H        ARG  34 -10.462  -5.534   1.769
  252    HA   ARG  34           HA       ARG  34  -8.020  -4.794   3.050
  253    HB2  ARG  34           HB2      ARG  34  -8.574  -6.499   4.701
  254    HB3  ARG  34           HB3      ARG  34  -9.971  -5.498   4.347
  255    HG2  ARG  34           HG2      ARG  34 -10.853  -7.253   2.884
  256    HG3  ARG  34           HG3      ARG  34  -9.453  -8.259   3.260
  257    HD2  ARG  34           HD2      ARG  34 -11.497  -7.261   5.243
  258    HD3  ARG  34           HD3      ARG  34 -11.411  -8.892   4.585
  259    HE   ARG  34           HE       ARG  34  -9.032  -7.952   5.951
  260   HH11  ARG  34          HH11      ARG  34 -12.007  -9.784   6.152
  261   HH12  ARG  34          HH12      ARG  34 -11.532 -10.641   7.582
  262   HH21  ARG  34          HH21      ARG  34  -8.383  -9.110   7.806
  263   HH22  ARG  34          HH22      ARG  34  -9.465 -10.258   8.523
  264    H    GLN  35           H        GLN  35  -8.093  -6.154   0.331
  265    HA   GLN  35           HA       GLN  35  -6.562  -8.588   0.808
  266    HB2  GLN  35           HB2      GLN  35  -7.475  -7.363  -1.798
  267    HB3  GLN  35           HB3      GLN  35  -6.878  -8.998  -1.553
  268    HG2  GLN  35           HG2      GLN  35  -9.373  -7.935  -0.268
  269    HG3  GLN  35           HG3      GLN  35  -9.352  -8.783  -1.807
  270   HE21  GLN  35          HE21      GLN  35  -8.968  -9.054   1.612
  271   HE22  GLN  35          HE22      GLN  35  -8.988 -10.776   1.689
  272    H    LYS  36           H        LYS  36  -6.319  -5.464  -0.848
  273    HA   LYS  36           HA       LYS  36  -3.491  -5.962  -1.370
  274    HB2  LYS  36           HB2      LYS  36  -5.070  -3.535  -2.209
  275    HB3  LYS  36           HB3      LYS  36  -3.546  -4.102  -2.858
  276    HG2  LYS  36           HG2      LYS  36  -4.757  -6.130  -3.685
  277    HG3  LYS  36           HG3      LYS  36  -6.264  -5.336  -3.221
  278    HD2  LYS  36           HD2      LYS  36  -5.925  -4.943  -5.549
  279    HD3  LYS  36           HD3      LYS  36  -5.610  -3.428  -4.703
  280    HE2  LYS  36           HE2      LYS  36  -3.245  -3.736  -4.894
  281    HE3  LYS  36           HE3      LYS  36  -3.459  -5.367  -5.527
  282    HZ1  LYS  36           HZ1      LYS  36  -4.293  -2.898  -6.881
  283    HZ2  LYS  36           HZ2      LYS  36  -4.490  -4.401  -7.463
  284    HZ3  LYS  36           HZ3      LYS  36  -2.995  -3.799  -7.271
  285    H    THR  37           H        THR  37  -1.891  -4.841  -0.412
  286    HA   THR  37           HA       THR  37  -2.644  -3.010   1.757
  287    HB   THR  37           HB       THR  37   0.020  -4.364   1.246
  288    HG1  THR  37           HG1      THR  37  -1.241  -5.985   1.912
  289   HG21  THR  37          HG21      THR  37   0.231  -2.287   2.531
  290   HG22  THR  37          HG22      THR  37   0.548  -3.694   3.546
  291   HG23  THR  37          HG23      THR  37  -0.999  -2.855   3.661
  292    H    CYS  38           H        CYS  38  -1.754  -0.936   1.850
  293    HA   CYS  38           HA       CYS  38  -0.864   0.141  -0.681
  294    HB2  CYS  38           HB2      CYS  38  -2.463   1.452   0.539
  295    HB3  CYS  38           HB3      CYS  38  -1.470   1.412   1.991
  296    H    CYS  39           H        CYS  39   1.163   0.722  -1.186
  297    HA   CYS  39           HA       CYS  39   3.191   0.509   0.937
  298    HB2  CYS  39           HB2      CYS  39   3.529  -0.021  -2.024
  299    HB3  CYS  39           HB3      CYS  39   4.797  -0.146  -0.803
  300    H    VAL  40           H        VAL  40   3.735   2.477   1.548
  301    HA   VAL  40           HA       VAL  40   4.389   4.466  -0.499
  302    HB   VAL  40           HB       VAL  40   3.388   6.236   1.031
  303   HG11  VAL  40          HG11      VAL  40   1.179   6.010   0.087
  304   HG12  VAL  40          HG12      VAL  40   1.446   4.291  -0.202
  305   HG13  VAL  40          HG13      VAL  40   2.375   5.491  -1.103
  306   HG21  VAL  40          HG21      VAL  40   1.938   3.852   2.140
  307   HG22  VAL  40          HG22      VAL  40   1.609   5.545   2.519
  308   HG23  VAL  40          HG23      VAL  40   3.139   4.811   3.006
  Start of MODEL    4
    1    H1   LEU   1           H1       LEU   1 -13.765   4.561  -7.641
    2    H2   LEU   1           H2       LEU   1 -14.451   4.397  -6.179
    3    H3   LEU   1           H3       LEU   1 -14.690   3.264  -7.316
    4    HA   LEU   1           HA       LEU   1 -12.400   2.640  -7.298
    5    HB2  LEU   1           HB2      LEU   1 -10.880   3.581  -5.690
    6    HB3  LEU   1           HB3      LEU   1 -11.567   4.883  -6.636
    7    HG   LEU   1           HG       LEU   1 -12.872   4.245  -4.039
    8   HD11  LEU   1          HD11      LEU   1 -11.254   5.649  -2.841
    9   HD12  LEU   1          HD12      LEU   1 -10.242   5.697  -4.286
   10   HD13  LEU   1          HD13      LEU   1 -10.518   4.167  -3.453
   11   HD21  LEU   1          HD21      LEU   1 -13.160   6.668  -3.996
   12   HD22  LEU   1          HD22      LEU   1 -13.757   5.991  -5.509
   13   HD23  LEU   1          HD23      LEU   1 -12.201   6.817  -5.466
   14    HA   PRO   2           HA       PRO   2 -13.289  -0.672  -4.469
   15    HB2  PRO   2           HB2      PRO   2 -10.594   0.073  -3.388
   16    HB3  PRO   2           HB3      PRO   2 -11.265  -1.529  -3.693
   17    HG2  PRO   2           HG2      PRO   2  -9.595  -0.457  -5.430
   18    HG3  PRO   2           HG3      PRO   2 -11.041  -1.316  -6.010
   19    HD2  PRO   2           HD2      PRO   2 -10.469   1.597  -5.947
   20    HD3  PRO   2           HD3      PRO   2 -11.484   0.669  -7.067
   21    H    ARG   3           H        ARG   3 -11.138   1.235  -2.399
   22    HA   ARG   3           HA       ARG   3 -13.257   2.311  -0.813
   23    HB2  ARG   3           HB2      ARG   3 -12.672   1.080   1.274
   24    HB3  ARG   3           HB3      ARG   3 -13.421   0.085   0.043
   25    HG2  ARG   3           HG2      ARG   3 -11.394  -0.995  -0.470
   26    HG3  ARG   3           HG3      ARG   3 -10.451   0.190   0.432
   27    HD2  ARG   3           HD2      ARG   3 -12.500  -1.576   1.733
   28    HD3  ARG   3           HD3      ARG   3 -10.813  -2.055   1.548
   29    HE   ARG   3           HE       ARG   3 -10.750   0.438   2.728
   30   HH11  ARG   3          HH11      ARG   3 -12.101  -2.699   3.524
   31   HH12  ARG   3          HH12      ARG   3 -11.938  -2.468   5.237
   32   HH21  ARG   3          HH21      ARG   3 -10.515   0.724   4.966
   33   HH22  ARG   3          HH22      ARG   3 -11.031  -0.523   6.058
   34    H    ASP   4           H        ASP   4  -9.807   1.419  -0.808
   35    HA   ASP   4           HA       ASP   4  -9.263   3.978   0.532
   36    HB2  ASP   4           HB2      ASP   4  -8.297   1.222   1.164
   37    HB3  ASP   4           HB3      ASP   4  -7.238   2.587   1.468
   38    H    THR   5           H        THR   5  -8.775   2.248  -2.232
   39    HA   THR   5           HA       THR   5  -6.149   2.304  -2.917
   40    HB   THR   5           HB       THR   5  -8.208   3.276  -4.869
   41    HG1  THR   5           HG1      THR   5  -8.031   0.538  -4.545
   42   HG21  THR   5          HG21      THR   5  -6.972   1.882  -6.412
   43   HG22  THR   5          HG22      THR   5  -5.988   1.238  -5.098
   44   HG23  THR   5          HG23      THR   5  -5.839   2.934  -5.559
   45    H    SER   6           H        SER   6  -8.365   5.010  -3.714
   46    HA   SER   6           HA       SER   6  -6.300   6.664  -4.689
   47    HB2  SER   6           HB2      SER   6  -9.052   7.442  -3.701
   48    HB3  SER   6           HB3      SER   6  -7.986   8.459  -4.670
   49    HG   SER   6           HG       SER   6  -8.079   6.352  -6.069
   50    H    ARG   7           H        ARG   7  -7.523   6.102  -1.513
   51    HA   ARG   7           HA       ARG   7  -6.609   8.436  -0.243
   52    HB2  ARG   7           HB2      ARG   7  -8.157   7.042   0.908
   53    HB3  ARG   7           HB3      ARG   7  -7.120   5.633   0.740
   54    HG2  ARG   7           HG2      ARG   7  -5.588   6.464   2.350
   55    HG3  ARG   7           HG3      ARG   7  -6.373   8.047   2.372
   56    HD2  ARG   7           HD2      ARG   7  -7.682   5.460   3.210
   57    HD3  ARG   7           HD3      ARG   7  -6.960   6.625   4.322
   58    HE   ARG   7           HE       ARG   7  -8.647   8.231   3.215
   59   HH11  ARG   7          HH11      ARG   7  -9.253   4.819   3.811
   60   HH12  ARG   7          HH12      ARG   7 -10.959   5.059   4.050
   61   HH21  ARG   7          HH21      ARG   7 -10.881   8.512   3.513
   62   HH22  ARG   7          HH22      ARG   7 -11.884   7.144   3.876
   63    H    CYS   8           H        CYS   8  -5.083   5.241  -0.664
   64    HA   CYS   8           HA       CYS   8  -2.699   6.001   0.671
   65    HB2  CYS   8           HB2      CYS   8  -3.171   3.719  -1.236
   66    HB3  CYS   8           HB3      CYS   8  -1.896   3.854  -0.027
   67    H    VAL   9           H        VAL   9  -3.598   5.723  -2.773
   68    HA   VAL   9           HA       VAL   9  -0.953   6.294  -3.704
   69    HB   VAL   9           HB       VAL   9  -3.493   6.732  -5.269
   70   HG11  VAL   9          HG11      VAL   9  -2.090   6.190  -7.199
   71   HG12  VAL   9          HG12      VAL   9  -0.700   6.007  -6.131
   72   HG13  VAL   9          HG13      VAL   9  -1.469   7.583  -6.314
   73   HG21  VAL   9          HG21      VAL   9  -3.574   4.517  -4.261
   74   HG22  VAL   9          HG22      VAL   9  -1.974   4.155  -4.913
   75   HG23  VAL   9          HG23      VAL   9  -3.335   4.412  -6.006
   76    H    GLY  10           H        GLY  10  -3.598   8.177  -2.598
   77    HA2  GLY  10           HA2      GLY  10  -2.971  10.691  -3.685
   78    HA3  GLY  10           HA3      GLY  10  -3.773  10.423  -2.145
   79    H    TYR  11           H        TYR  11  -1.473   8.849  -1.134
   80    HA   TYR  11           HA       TYR  11   0.186  11.033  -0.262
   81    HB2  TYR  11           HB2      TYR  11   0.291   8.061   0.297
   82    HB3  TYR  11           HB3      TYR  11   1.428   9.215   0.984
   83    HD1  TYR  11           HD1      TYR  11  -1.989   7.931   1.096
   84    HD2  TYR  11           HD2      TYR  11   0.695  10.830   2.673
   85    HE1  TYR  11           HE1      TYR  11  -3.544   8.351   2.949
   86    HE2  TYR  11           HE2      TYR  11  -0.856  11.258   4.532
   87    HH   TYR  11           HH       TYR  11  -3.524   9.226   5.211
   88    H    HIS  12           H        HIS  12   1.988   8.165  -0.766
   89    HA   HIS  12           HA       HIS  12   2.852   8.834  -3.458
   90    HB2  HIS  12           HB2      HIS  12   4.881   8.809  -1.204
   91    HB3  HIS  12           HB3      HIS  12   5.227   9.021  -2.912
   92    HD1  HIS  12           HD1      HIS  12   4.629  11.362  -3.950
   93    HD2  HIS  12           HD2      HIS  12   4.140  11.076   0.164
   94    HE1  HIS  12           HE1      HIS  12   4.424  13.725  -3.130
   95    HE2  HIS  12           HE2      HIS  12   4.357  13.529  -0.623
   96    H    GLY  13           H        GLY  13   2.483   6.781  -4.259
   97    HA2  GLY  13           HA2      GLY  13   4.267   4.772  -4.110
   98    HA3  GLY  13           HA3      GLY  13   3.287   4.476  -2.683
   99    H    TYR  14           H        TYR  14   2.273   2.611  -3.275
  100    HA   TYR  14           HA       TYR  14   0.226   2.769  -5.264
  101    HB2  TYR  14           HB2      TYR  14   1.030   1.080  -6.791
  102    HB3  TYR  14           HB3      TYR  14   2.185   2.394  -6.716
  103    HD1  TYR  14           HD1      TYR  14   1.828  -1.079  -6.766
  104    HD2  TYR  14           HD2      TYR  14   4.154   1.981  -4.936
  105    HE1  TYR  14           HE1      TYR  14   3.625  -2.701  -6.361
  106    HE2  TYR  14           HE2      TYR  14   5.956   0.361  -4.517
  107    HH   TYR  14           HH       TYR  14   6.135  -2.613  -6.009
  108    H    CYS  15           H        CYS  15  -0.527   0.348  -5.724
  109    HA   CYS  15           HA       CYS  15  -0.984  -0.791  -3.048
  110    HB2  CYS  15           HB2      CYS  15  -2.717  -0.859  -5.526
  111    HB3  CYS  15           HB3      CYS  15  -3.121  -1.612  -3.986
  112    H    ILE  16           H        ILE  16  -0.619  -2.947  -2.688
  113    HA   ILE  16           HA       ILE  16   0.156  -4.575  -5.015
  114    HB   ILE  16           HB       ILE  16   2.086  -5.401  -4.017
  115   HG12  ILE  16          HG12      ILE  16   1.293  -4.158  -1.377
  116   HG13  ILE  16          HG13      ILE  16   1.044  -5.852  -1.788
  117   HG21  ILE  16          HG21      ILE  16   3.435  -3.485  -3.358
  118   HG22  ILE  16          HG22      ILE  16   1.968  -2.535  -3.123
  119   HG23  ILE  16          HG23      ILE  16   2.401  -3.104  -4.735
  120   HD11  ILE  16          HD11      ILE  16   3.691  -4.441  -1.556
  121   HD12  ILE  16          HD12      ILE  16   3.471  -6.126  -2.026
  122   HD13  ILE  16          HD13      ILE  16   3.006  -5.593  -0.410
  123    H    ARG  17           H        ARG  17  -0.317  -6.774  -4.854
  124    HA   ARG  17           HA       ARG  17  -2.064  -7.553  -2.665
  125    HB2  ARG  17           HB2      ARG  17  -1.744  -9.816  -4.217
  126    HB3  ARG  17           HB3      ARG  17  -3.072  -8.679  -4.315
  127    HG2  ARG  17           HG2      ARG  17  -2.367  -8.987  -6.514
  128    HG3  ARG  17           HG3      ARG  17  -1.689  -7.436  -6.044
  129    HD2  ARG  17           HD2      ARG  17  -0.074  -9.941  -5.782
  130    HD3  ARG  17           HD3      ARG  17  -0.234  -9.148  -7.343
  131    HE   ARG  17           HE       ARG  17   1.253  -8.201  -5.034
  132   HH11  ARG  17          HH11      ARG  17  -0.096  -7.411  -8.171
  133   HH12  ARG  17          HH12      ARG  17   1.040  -6.135  -8.472
  134   HH21  ARG  17          HH21      ARG  17   2.748  -6.534  -5.438
  135   HH22  ARG  17          HH22      ARG  17   2.658  -5.635  -6.921
  136    H    SER  18           H        SER  18  -0.617  -7.549  -1.005
  137    HA   SER  18           HA       SER  18   0.618  -9.926  -0.281
  138    HB2  SER  18           HB2      SER  18   2.320  -9.355  -1.994
  139    HB3  SER  18           HB3      SER  18   2.587  -7.803  -1.205
  140    HG   SER  18           HG       SER  18   4.135  -9.412  -0.618
  141    H    LYS  19           H        LYS  19   1.338  -9.782   1.917
  142    HA   LYS  19           HA       LYS  19   0.511  -7.315   3.227
  143    HB2  LYS  19           HB2      LYS  19   1.392  -9.923   4.472
  144    HB3  LYS  19           HB3      LYS  19   0.621  -8.578   5.299
  145    HG2  LYS  19           HG2      LYS  19  -0.592 -10.413   3.252
  146    HG3  LYS  19           HG3      LYS  19  -1.019 -10.257   4.951
  147    HD2  LYS  19           HD2      LYS  19  -1.393  -8.149   2.826
  148    HD3  LYS  19           HD3      LYS  19  -2.666  -9.152   3.520
  149    HE2  LYS  19           HE2      LYS  19  -2.380  -8.132   5.671
  150    HE3  LYS  19           HE3      LYS  19  -0.947  -7.263   5.120
  151    HZ1  LYS  19           HZ1      LYS  19  -3.676  -6.849   4.129
  152    HZ2  LYS  19           HZ2      LYS  19  -2.357  -6.059   3.592
  153    HZ3  LYS  19           HZ3      LYS  19  -2.865  -5.849   5.123
  154    H    VAL  20           H        VAL  20   3.257  -8.462   1.899
  155    HA   VAL  20           HA       VAL  20   4.970  -7.037   3.827
  156    HB   VAL  20           HB       VAL  20   5.803  -9.140   1.816
  157   HG11  VAL  20          HG11      VAL  20   7.374  -7.796   4.013
  158   HG12  VAL  20          HG12      VAL  20   7.558  -7.508   2.283
  159   HG13  VAL  20          HG13      VAL  20   7.960  -9.086   2.960
  160   HG21  VAL  20          HG21      VAL  20   5.528  -9.350   4.813
  161   HG22  VAL  20          HG22      VAL  20   6.151 -10.602   3.737
  162   HG23  VAL  20          HG23      VAL  20   4.465 -10.100   3.622
  163    H    CYS  21           H        CYS  21   5.271  -5.027   3.105
  164    HA   CYS  21           HA       CYS  21   5.174  -4.422   0.292
  165    HB2  CYS  21           HB2      CYS  21   5.489  -2.775   2.781
  166    HB3  CYS  21           HB3      CYS  21   5.761  -2.068   1.191
  167    HA   PRO  22           HA       PRO  22   9.506  -4.972  -0.475
  168    HB2  PRO  22           HB2      PRO  22   9.563  -3.508  -2.792
  169    HB3  PRO  22           HB3      PRO  22   9.050  -5.197  -2.697
  170    HG2  PRO  22           HG2      PRO  22   7.402  -2.715  -2.815
  171    HG3  PRO  22           HG3      PRO  22   7.127  -4.288  -3.583
  172    HD2  PRO  22           HD2      PRO  22   5.799  -3.513  -1.370
  173    HD3  PRO  22           HD3      PRO  22   6.228  -5.209  -1.674
  174    H    LYS  23           H        LYS  23  11.384  -3.762  -0.254
  175    HA   LYS  23           HA       LYS  23  10.991  -1.142   0.850
  176    HB2  LYS  23           HB2      LYS  23  13.435  -1.259   1.329
  177    HB3  LYS  23           HB3      LYS  23  12.496  -2.579   2.008
  178    HG2  LYS  23           HG2      LYS  23  14.349  -3.677   1.206
  179    HG3  LYS  23           HG3      LYS  23  13.205  -3.872  -0.116
  180    HD2  LYS  23           HD2      LYS  23  15.324  -3.285  -1.052
  181    HD3  LYS  23           HD3      LYS  23  14.251  -1.893  -1.219
  182    HE2  LYS  23           HE2      LYS  23  15.270  -0.860   0.741
  183    HE3  LYS  23           HE3      LYS  23  16.315  -2.262   0.949
  184    HZ1  LYS  23           HZ1      LYS  23  17.274  -1.744  -1.206
  185    HZ2  LYS  23           HZ2      LYS  23  17.470  -0.515  -0.163
  186    HZ3  LYS  23           HZ3      LYS  23  16.341  -0.413  -1.326
  187    HA   PRO  24           HA       PRO  24  11.855   0.443   1.309
  188    HB2  PRO  24           HB2      PRO  24  12.195   3.060   1.072
  189    HB3  PRO  24           HB3      PRO  24  13.578   1.959   0.982
  190    HG2  PRO  24           HG2      PRO  24  12.144   3.394  -1.208
  191    HG3  PRO  24           HG3      PRO  24  13.871   3.039  -1.044
  192    HD2  PRO  24           HD2      PRO  24  11.992   1.572  -2.547
  193    HD3  PRO  24           HD3      PRO  24  13.638   1.066  -2.132
  194    H    PHE  25           H        PHE  25   9.734   0.177   1.752
  195    HA   PHE  25           HA       PHE  25   7.916   2.353   1.192
  196    HB2  PHE  25           HB2      PHE  25   7.530  -0.380   0.019
  197    HB3  PHE  25           HB3      PHE  25   6.132   0.557   0.516
  198    HD1  PHE  25           HD1      PHE  25   5.723   2.774  -0.523
  199    HD2  PHE  25           HD2      PHE  25   8.632   0.063  -2.026
  200    HE1  PHE  25           HE1      PHE  25   5.702   3.967  -2.667
  201    HE2  PHE  25           HE2      PHE  25   8.628   1.250  -4.179
  202    HZ   PHE  25           HZ       PHE  25   7.163   3.205  -4.506
  203    H    ALA  26           H        ALA  26   5.943   2.171   2.442
  204    HA   ALA  26           HA       ALA  26   6.264   0.411   4.786
  205    HB1  ALA  26           HB1      ALA  26   6.573   2.786   5.326
  206    HB2  ALA  26           HB2      ALA  26   5.146   2.114   6.114
  207    HB3  ALA  26           HB3      ALA  26   4.966   3.131   4.686
  208    H    ALA  27           H        ALA  27   4.562  -0.816   5.407
  209    HA   ALA  27           HA       ALA  27   2.367  -1.154   3.617
  210    HB1  ALA  27           HB1      ALA  27   3.295  -3.044   4.857
  211    HB2  ALA  27           HB2      ALA  27   1.581  -2.828   5.225
  212    HB3  ALA  27           HB3      ALA  27   2.804  -2.296   6.377
  213    H    PHE  28           H        PHE  28   0.995   0.473   3.476
  214    HA   PHE  28           HA       PHE  28   0.085   1.866   5.884
  215    HB2  PHE  28           HB2      PHE  28   0.934   3.152   3.914
  216    HB3  PHE  28           HB3      PHE  28  -0.391   2.519   2.961
  217    HD1  PHE  28           HD1      PHE  28   0.729   5.205   4.871
  218    HD2  PHE  28           HD2      PHE  28  -2.801   3.006   3.971
  219    HE1  PHE  28           HE1      PHE  28  -0.635   7.127   5.543
  220    HE2  PHE  28           HE2      PHE  28  -4.175   4.931   4.644
  221    HZ   PHE  28           HZ       PHE  28  -3.093   6.997   5.427
  222    H    GLY  29           H        GLY  29  -1.379   0.428   6.767
  223    HA2  GLY  29           HA2      GLY  29  -3.398  -0.601   7.082
  224    HA3  GLY  29           HA3      GLY  29  -4.021   0.728   6.124
  225    H    THR  30           H        THR  30  -5.180   0.143   4.453
  226    HA   THR  30           HA       THR  30  -4.463  -2.251   2.932
  227    HB   THR  30           HB       THR  30  -6.941  -2.830   2.854
  228    HG1  THR  30           HG1      THR  30  -7.628  -0.837   3.881
  229   HG21  THR  30          HG21      THR  30  -5.297  -4.180   4.036
  230   HG22  THR  30          HG22      THR  30  -6.814  -4.123   4.936
  231   HG23  THR  30          HG23      THR  30  -5.443  -3.140   5.453
  232    H    CYS  31           H        CYS  31  -4.834  -2.114   0.856
  233    HA   CYS  31           HA       CYS  31  -5.809   0.384  -0.274
  234    HB2  CYS  31           HB2      CYS  31  -4.056  -1.801  -1.169
  235    HB3  CYS  31           HB3      CYS  31  -5.120  -1.159  -2.412
  236    H    SER  32           H        SER  32  -6.724  -0.684  -2.742
  237    HA   SER  32           HA       SER  32  -9.316  -1.150  -2.630
  238    HB2  SER  32           HB2      SER  32  -7.605  -3.011  -4.235
  239    HB3  SER  32           HB3      SER  32  -9.139  -2.273  -4.683
  240    HG   SER  32           HG       SER  32  -7.209  -1.319  -5.653
  241    H    TRP  33           H        TRP  33 -10.320  -2.209  -1.046
  242    HA   TRP  33           HA       TRP  33 -11.042  -3.807   0.367
  243    HB2  TRP  33           HB2      TRP  33 -10.041  -5.756  -1.706
  244    HB3  TRP  33           HB3      TRP  33 -11.363  -5.986  -0.563
  245    HD1  TRP  33           HD1      TRP  33 -11.019  -5.490  -4.045
  246    HE1  TRP  33           HE1      TRP  33 -13.017  -4.259  -5.099
  247    HE3  TRP  33           HE3      TRP  33 -13.051  -3.465   0.188
  248    HZ2  TRP  33           HZ2      TRP  33 -15.156  -2.631  -4.247
  249    HZ3  TRP  33           HZ3      TRP  33 -15.064  -2.073  -0.024
  250    HH2  TRP  33           HH2      TRP  33 -16.090  -1.665  -2.204
  251    H    ARG  34           H        ARG  34 -10.332  -5.923   1.582
  252    HA   ARG  34           HA       ARG  34  -7.710  -5.355   2.630
  253    HB2  ARG  34           HB2      ARG  34  -8.163  -7.135   4.254
  254    HB3  ARG  34           HB3      ARG  34  -9.476  -5.972   4.179
  255    HG2  ARG  34           HG2      ARG  34 -10.839  -7.498   2.930
  256    HG3  ARG  34           HG3      ARG  34  -9.498  -8.634   2.773
  257    HD2  ARG  34           HD2      ARG  34 -10.752  -7.792   5.385
  258    HD3  ARG  34           HD3      ARG  34 -11.127  -9.283   4.521
  259    HE   ARG  34           HE       ARG  34  -8.493  -9.515   4.792
  260   HH11  ARG  34          HH11      ARG  34 -10.926  -8.575   7.138
  261   HH12  ARG  34          HH12      ARG  34 -10.038  -9.209   8.489
  262   HH21  ARG  34          HH21      ARG  34  -7.338 -10.349   6.571
  263   HH22  ARG  34          HH22      ARG  34  -8.000 -10.208   8.167
  264    H    GLN  35           H        GLN  35  -7.939  -6.304  -0.102
  265    HA   GLN  35           HA       GLN  35  -6.610  -8.918  -0.019
  266    HB2  GLN  35           HB2      GLN  35  -7.651  -7.381  -2.404
  267    HB3  GLN  35           HB3      GLN  35  -7.135  -9.063  -2.375
  268    HG2  GLN  35           HG2      GLN  35  -9.420  -8.054  -0.722
  269    HG3  GLN  35           HG3      GLN  35  -9.622  -8.618  -2.376
  270   HE21  GLN  35          HE21      GLN  35  -8.823  -9.520   0.881
  271   HE22  GLN  35          HE22      GLN  35  -9.007 -11.227   0.672
  272    H    LYS  36           H        LYS  36  -6.217  -5.564  -0.785
  273    HA   LYS  36           HA       LYS  36  -3.442  -6.080  -1.627
  274    HB2  LYS  36           HB2      LYS  36  -4.936  -3.587  -2.379
  275    HB3  LYS  36           HB3      LYS  36  -3.531  -4.289  -3.133
  276    HG2  LYS  36           HG2      LYS  36  -6.137  -5.745  -3.205
  277    HG3  LYS  36           HG3      LYS  36  -5.824  -4.412  -4.319
  278    HD2  LYS  36           HD2      LYS  36  -3.912  -6.702  -3.979
  279    HD3  LYS  36           HD3      LYS  36  -5.244  -6.746  -5.137
  280    HE2  LYS  36           HE2      LYS  36  -3.364  -4.426  -5.102
  281    HE3  LYS  36           HE3      LYS  36  -2.890  -5.924  -5.885
  282    HZ1  LYS  36           HZ1      LYS  36  -5.253  -4.307  -6.534
  283    HZ2  LYS  36           HZ2      LYS  36  -4.900  -5.732  -7.231
  284    HZ3  LYS  36           HZ3      LYS  36  -3.914  -4.456  -7.451
  285    H    THR  37           H        THR  37  -1.869  -4.980  -0.572
  286    HA   THR  37           HA       THR  37  -2.691  -3.250   1.657
  287    HB   THR  37           HB       THR  37   0.045  -4.439   1.118
  288    HG1  THR  37           HG1      THR  37  -0.836  -6.245   1.749
  289   HG21  THR  37          HG21      THR  37   0.438  -3.982   3.497
  290   HG22  THR  37          HG22      THR  37  -1.168  -3.264   3.626
  291   HG23  THR  37          HG23      THR  37   0.061  -2.500   2.617
  292    H    CYS  38           H        CYS  38  -1.819  -1.143   1.854
  293    HA   CYS  38           HA       CYS  38  -0.989   0.043  -0.653
  294    HB2  CYS  38           HB2      CYS  38  -1.380   1.313   2.054
  295    HB3  CYS  38           HB3      CYS  38  -1.241   2.155   0.519
  296    H    CYS  39           H        CYS  39   1.044   0.694  -1.140
  297    HA   CYS  39           HA       CYS  39   3.056   0.482   1.000
  298    HB2  CYS  39           HB2      CYS  39   3.382  -0.060  -1.958
  299    HB3  CYS  39           HB3      CYS  39   4.686  -0.099  -0.772
  300    H    VAL  40           H        VAL  40   3.617   2.427   1.632
  301    HA   VAL  40           HA       VAL  40   4.255   4.452  -0.379
  302    HB   VAL  40           HB       VAL  40   3.159   6.181   1.180
  303   HG11  VAL  40          HG11      VAL  40   2.316   5.465  -1.064
  304   HG12  VAL  40          HG12      VAL  40   1.055   6.000   0.052
  305   HG13  VAL  40          HG13      VAL  40   1.301   4.276  -0.238
  306   HG21  VAL  40          HG21      VAL  40   1.707   3.699   2.074
  307   HG22  VAL  40          HG22      VAL  40   1.267   5.357   2.487
  308   HG23  VAL  40          HG23      VAL  40   2.786   4.675   3.072
  Start of MODEL    5
    1    H1   LEU   1           H1       LEU   1 -14.465   4.592  -5.933
    2    H2   LEU   1           H2       LEU   1 -14.592   3.477  -7.102
    3    H3   LEU   1           H3       LEU   1 -13.742   4.836  -7.370
    4    HA   LEU   1           HA       LEU   1 -12.309   2.957  -7.013
    5    HB2  LEU   1           HB2      LEU   1 -10.798   4.008  -5.508
    6    HB3  LEU   1           HB3      LEU   1 -11.605   5.269  -6.403
    7    HG   LEU   1           HG       LEU   1 -11.399   6.115  -4.248
    8   HD11  LEU   1          HD11      LEU   1 -13.664   6.420  -5.084
    9   HD12  LEU   1          HD12      LEU   1 -13.612   6.330  -3.324
   10   HD13  LEU   1          HD13      LEU   1 -14.164   4.943  -4.260
   11   HD21  LEU   1          HD21      LEU   1 -12.329   3.475  -3.149
   12   HD22  LEU   1          HD22      LEU   1 -11.952   4.911  -2.198
   13   HD23  LEU   1          HD23      LEU   1 -10.682   4.108  -3.123
   14    HA   PRO   2           HA       PRO   2 -13.295  -0.478  -4.473
   15    HB2  PRO   2           HB2      PRO   2 -10.592   0.091  -3.329
   16    HB3  PRO   2           HB3      PRO   2 -11.301  -1.456  -3.781
   17    HG2  PRO   2           HG2      PRO   2  -9.578  -0.220  -5.384
   18    HG3  PRO   2           HG3      PRO   2 -10.983  -1.084  -6.047
   19    HD2  PRO   2           HD2      PRO   2 -10.466   1.819  -5.884
   20    HD3  PRO   2           HD3      PRO   2 -11.541   0.925  -6.974
   21    H    ARG   3           H        ARG   3 -11.096   1.202  -2.275
   22    HA   ARG   3           HA       ARG   3 -13.164   2.258  -0.637
   23    HB2  ARG   3           HB2      ARG   3 -12.805   0.869   1.348
   24    HB3  ARG   3           HB3      ARG   3 -13.399  -0.076   0.002
   25    HG2  ARG   3           HG2      ARG   3 -11.314  -1.099  -0.346
   26    HG3  ARG   3           HG3      ARG   3 -10.487   0.058   0.701
   27    HD2  ARG   3           HD2      ARG   3 -12.606  -1.857   1.660
   28    HD3  ARG   3           HD3      ARG   3 -10.877  -2.201   1.717
   29    HE   ARG   3           HE       ARG   3 -10.854   0.038   3.052
   30   HH11  ARG   3          HH11      ARG   3 -13.306  -2.477   3.227
   31   HH12  ARG   3          HH12      ARG   3 -13.694  -2.143   4.885
   32   HH21  ARG   3          HH21      ARG   3 -11.379   0.455   5.229
   33   HH22  ARG   3          HH22      ARG   3 -12.611  -0.474   6.015
   34    H    ASP   4           H        ASP   4  -9.765   1.208  -0.702
   35    HA   ASP   4           HA       ASP   4  -9.105   3.646   0.814
   36    HB2  ASP   4           HB2      ASP   4  -8.055   0.857   1.045
   37    HB3  ASP   4           HB3      ASP   4  -7.020   2.209   1.486
   38    H    THR   5           H        THR   5  -8.795   2.216  -2.149
   39    HA   THR   5           HA       THR   5  -6.267   2.590  -3.075
   40    HB   THR   5           HB       THR   5  -8.661   3.548  -4.617
   41    HG1  THR   5           HG1      THR   5  -7.963   0.849  -4.709
   42   HG21  THR   5          HG21      THR   5  -7.458   2.531  -6.505
   43   HG22  THR   5          HG22      THR   5  -6.149   2.068  -5.418
   44   HG23  THR   5          HG23      THR   5  -6.489   3.775  -5.715
   45    H    SER   6           H        SER   6  -8.776   5.153  -3.064
   46    HA   SER   6           HA       SER   6  -7.027   7.105  -4.139
   47    HB2  SER   6           HB2      SER   6  -9.668   7.468  -2.716
   48    HB3  SER   6           HB3      SER   6  -8.854   8.681  -3.706
   49    HG   SER   6           HG       SER   6  -9.894   7.805  -5.299
   50    H    ARG   7           H        ARG   7  -7.732   6.055  -0.921
   51    HA   ARG   7           HA       ARG   7  -6.633   8.286   0.453
   52    HB2  ARG   7           HB2      ARG   7  -8.059   6.806   1.668
   53    HB3  ARG   7           HB3      ARG   7  -7.093   5.407   1.228
   54    HG2  ARG   7           HG2      ARG   7  -5.299   6.133   2.652
   55    HG3  ARG   7           HG3      ARG   7  -6.140   7.645   3.001
   56    HD2  ARG   7           HD2      ARG   7  -7.253   4.923   3.649
   57    HD3  ARG   7           HD3      ARG   7  -6.318   5.891   4.787
   58    HE   ARG   7           HE       ARG   7  -8.140   7.636   4.332
   59   HH11  ARG   7          HH11      ARG   7  -8.710   4.173   4.326
   60   HH12  ARG   7          HH12      ARG   7 -10.353   4.330   4.864
   61   HH21  ARG   7          HH21      ARG   7 -10.291   7.828   5.045
   62   HH22  ARG   7          HH22      ARG   7 -11.248   6.401   5.281
   63    H    CYS   8           H        CYS   8  -5.335   5.236  -0.746
   64    HA   CYS   8           HA       CYS   8  -2.746   5.554   0.385
   65    HB2  CYS   8           HB2      CYS   8  -3.530   3.361  -0.173
   66    HB3  CYS   8           HB3      CYS   8  -3.806   3.827  -1.849
   67    H    VAL   9           H        VAL   9  -4.102   6.202  -2.832
   68    HA   VAL   9           HA       VAL   9  -1.532   6.984  -3.879
   69    HB   VAL   9           HB       VAL   9  -3.272   5.906  -5.296
   70   HG11  VAL   9          HG11      VAL   9  -5.149   7.214  -6.132
   71   HG12  VAL   9          HG12      VAL   9  -4.717   8.531  -5.038
   72   HG13  VAL   9          HG13      VAL   9  -5.235   6.975  -4.388
   73   HG21  VAL   9          HG21      VAL   9  -1.489   7.130  -6.364
   74   HG22  VAL   9          HG22      VAL   9  -2.381   8.640  -6.184
   75   HG23  VAL   9          HG23      VAL   9  -2.992   7.377  -7.255
   76    H    GLY  10           H        GLY  10  -3.918   8.483  -2.047
   77    HA2  GLY  10           HA2      GLY  10  -3.508  11.187  -2.763
   78    HA3  GLY  10           HA3      GLY  10  -4.027  10.611  -1.182
   79    H    TYR  11           H        TYR  11  -1.589   8.868  -1.087
   80    HA   TYR  11           HA       TYR  11   0.300  10.897  -0.185
   81    HB2  TYR  11           HB2      TYR  11   0.187   7.902   0.206
   82    HB3  TYR  11           HB3      TYR  11   1.537   8.890   0.753
   83    HD1  TYR  11           HD1      TYR  11   1.377  10.201   2.732
   84    HD2  TYR  11           HD2      TYR  11  -2.061   8.204   1.230
   85    HE1  TYR  11           HE1      TYR  11   0.204  10.659   4.836
   86    HE2  TYR  11           HE2      TYR  11  -3.250   8.657   3.333
   87    HH   TYR  11           HH       TYR  11  -2.741   9.151   5.668
   88    H    HIS  12           H        HIS  12   1.911   8.050  -0.965
   89    HA   HIS  12           HA       HIS  12   2.501   8.646  -3.722
   90    HB2  HIS  12           HB2      HIS  12   4.731   8.969  -1.687
   91    HB3  HIS  12           HB3      HIS  12   4.900   9.057  -3.432
   92    HD1  HIS  12           HD1      HIS  12   4.083  11.259  -4.588
   93    HD2  HIS  12           HD2      HIS  12   3.827  11.260  -0.438
   94    HE1  HIS  12           HE1      HIS  12   3.744  13.663  -3.933
   95    HE2  HIS  12           HE2      HIS  12   3.654  13.651  -1.415
   96    H    GLY  13           H        GLY  13   2.318   6.554  -4.388
   97    HA2  GLY  13           HA2      GLY  13   4.256   4.661  -4.079
   98    HA3  GLY  13           HA3      GLY  13   3.179   4.374  -2.719
   99    H    TYR  14           H        TYR  14   2.211   2.488  -3.275
  100    HA   TYR  14           HA       TYR  14   0.266   2.518  -5.349
  101    HB2  TYR  14           HB2      TYR  14   1.184   0.761  -6.780
  102    HB3  TYR  14           HB3      TYR  14   2.192   2.193  -6.799
  103    HD1  TYR  14           HD1      TYR  14   2.086  -1.345  -6.282
  104    HD2  TYR  14           HD2      TYR  14   4.326   2.158  -5.375
  105    HE1  TYR  14           HE1      TYR  14   4.051  -2.739  -5.790
  106    HE2  TYR  14           HE2      TYR  14   6.293   0.774  -4.874
  107    HH   TYR  14           HH       TYR  14   6.485  -2.514  -5.714
  108    H    CYS  15           H        CYS  15  -0.528   0.170  -5.755
  109    HA   CYS  15           HA       CYS  15  -0.963  -0.978  -3.085
  110    HB2  CYS  15           HB2      CYS  15  -2.628  -1.247  -5.599
  111    HB3  CYS  15           HB3      CYS  15  -3.063  -1.826  -3.995
  112    H    ILE  16           H        ILE  16  -0.493  -3.104  -2.670
  113    HA   ILE  16           HA       ILE  16   0.206  -4.807  -4.970
  114    HB   ILE  16           HB       ILE  16   2.042  -5.777  -3.869
  115   HG12  ILE  16          HG12      ILE  16   1.324  -4.215  -1.387
  116   HG13  ILE  16          HG13      ILE  16   0.995  -5.925  -1.627
  117   HG21  ILE  16          HG21      ILE  16   2.530  -3.604  -4.837
  118   HG22  ILE  16          HG22      ILE  16   3.552  -3.925  -3.435
  119   HG23  ILE  16          HG23      ILE  16   2.174  -2.830  -3.294
  120   HD11  ILE  16          HD11      ILE  16   3.707  -4.632  -1.492
  121   HD12  ILE  16          HD12      ILE  16   3.407  -6.341  -1.809
  122   HD13  ILE  16          HD13      ILE  16   2.952  -5.639  -0.256
  123    H    ARG  17           H        ARG  17  -0.398  -6.962  -4.801
  124    HA   ARG  17           HA       ARG  17  -2.162  -7.646  -2.602
  125    HB2  ARG  17           HB2      ARG  17  -2.136  -9.933  -3.988
  126    HB3  ARG  17           HB3      ARG  17  -3.180  -8.587  -4.395
  127    HG2  ARG  17           HG2      ARG  17  -2.246  -9.417  -6.405
  128    HG3  ARG  17           HG3      ARG  17  -1.483  -7.871  -6.077
  129    HD2  ARG  17           HD2      ARG  17  -0.054 -10.174  -4.970
  130    HD3  ARG  17           HD3      ARG  17  -0.179 -10.185  -6.725
  131    HE   ARG  17           HE       ARG  17   1.180  -8.145  -5.093
  132   HH11  ARG  17          HH11      ARG  17   0.427  -9.514  -8.229
  133   HH12  ARG  17          HH12      ARG  17   1.714  -8.680  -9.041
  134   HH21  ARG  17          HH21      ARG  17   2.872  -7.054  -6.159
  135   HH22  ARG  17          HH22      ARG  17   3.099  -7.277  -7.862
  136    H    SER  18           H        SER  18  -0.718  -7.634  -0.940
  137    HA   SER  18           HA       SER  18   0.393 -10.061  -0.146
  138    HB2  SER  18           HB2      SER  18   2.141  -9.581  -1.840
  139    HB3  SER  18           HB3      SER  18   2.452  -8.027  -1.073
  140    HG   SER  18           HG       SER  18   3.830  -9.959  -0.522
  141    H    LYS  19           H        LYS  19   1.489  -9.803   1.982
  142    HA   LYS  19           HA       LYS  19   0.636  -7.305   3.267
  143    HB2  LYS  19           HB2      LYS  19   1.335  -9.940   4.565
  144    HB3  LYS  19           HB3      LYS  19   0.606  -8.543   5.344
  145    HG2  LYS  19           HG2      LYS  19  -0.641 -10.276   3.223
  146    HG3  LYS  19           HG3      LYS  19  -1.070 -10.218   4.926
  147    HD2  LYS  19           HD2      LYS  19  -1.382  -7.985   2.921
  148    HD3  LYS  19           HD3      LYS  19  -2.680  -8.965   3.601
  149    HE2  LYS  19           HE2      LYS  19  -2.231  -8.073   5.811
  150    HE3  LYS  19           HE3      LYS  19  -0.862  -7.155   5.186
  151    HZ1  LYS  19           HZ1      LYS  19  -3.659  -6.763   4.405
  152    HZ2  LYS  19           HZ2      LYS  19  -2.394  -5.913   3.832
  153    HZ3  LYS  19           HZ3      LYS  19  -2.810  -5.792   5.399
  154    H    VAL  20           H        VAL  20   3.262  -8.330   1.831
  155    HA   VAL  20           HA       VAL  20   5.050  -7.065   3.805
  156    HB   VAL  20           HB       VAL  20   5.845  -9.192   1.801
  157   HG11  VAL  20          HG11      VAL  20   7.416  -7.878   4.016
  158   HG12  VAL  20          HG12      VAL  20   7.627  -7.601   2.287
  159   HG13  VAL  20          HG13      VAL  20   7.991  -9.183   2.977
  160   HG21  VAL  20          HG21      VAL  20   4.480 -10.152   3.583
  161   HG22  VAL  20          HG22      VAL  20   5.527  -9.411   4.794
  162   HG23  VAL  20          HG23      VAL  20   6.161 -10.666   3.730
  163    H    CYS  21           H        CYS  21   5.280  -5.047   3.050
  164    HA   CYS  21           HA       CYS  21   5.305  -4.492   0.220
  165    HB2  CYS  21           HB2      CYS  21   5.555  -2.759   2.674
  166    HB3  CYS  21           HB3      CYS  21   5.710  -2.116   1.041
  167    HA   PRO  22           HA       PRO  22   9.732  -4.822  -0.237
  168    HB2  PRO  22           HB2      PRO  22   9.859  -3.549  -2.649
  169    HB3  PRO  22           HB3      PRO  22   9.433  -5.254  -2.459
  170    HG2  PRO  22           HG2      PRO  22   7.672  -2.890  -2.905
  171    HG3  PRO  22           HG3      PRO  22   7.526  -4.539  -3.534
  172    HD2  PRO  22           HD2      PRO  22   6.031  -3.596  -1.471
  173    HD3  PRO  22           HD3      PRO  22   6.485  -5.303  -1.638
  174    H    LYS  23           H        LYS  23  11.528  -3.429  -0.091
  175    HA   LYS  23           HA       LYS  23  10.851  -0.804   0.892
  176    HB2  LYS  23           HB2      LYS  23  13.171  -0.688   1.597
  177    HB3  LYS  23           HB3      LYS  23  12.447  -2.215   2.092
  178    HG2  LYS  23           HG2      LYS  23  13.482  -3.185  -0.030
  179    HG3  LYS  23           HG3      LYS  23  14.448  -1.706  -0.074
  180    HD2  LYS  23           HD2      LYS  23  15.198  -2.177   2.224
  181    HD3  LYS  23           HD3      LYS  23  14.295  -3.692   2.172
  182    HE2  LYS  23           HE2      LYS  23  16.650  -4.084   1.707
  183    HE3  LYS  23           HE3      LYS  23  15.665  -4.448   0.291
  184    HZ1  LYS  23           HZ1      LYS  23  17.602  -3.208  -0.316
  185    HZ2  LYS  23           HZ2      LYS  23  17.230  -2.003   0.707
  186    HZ3  LYS  23           HZ3      LYS  23  16.284  -2.290  -0.583
  187    HA   PRO  24           HA       PRO  24  11.748   0.793   1.387
  188    HB2  PRO  24           HB2      PRO  24  11.894   3.439   1.134
  189    HB3  PRO  24           HB3      PRO  24  13.351   2.443   1.082
  190    HG2  PRO  24           HG2      PRO  24  11.866   3.754  -1.147
  191    HG3  PRO  24           HG3      PRO  24  13.610   3.510  -0.952
  192    HD2  PRO  24           HD2      PRO  24  11.860   1.918  -2.480
  193    HD3  PRO  24           HD3      PRO  24  13.522   1.513  -2.017
  194    H    PHE  25           H        PHE  25   9.652   0.331   1.759
  195    HA   PHE  25           HA       PHE  25   7.691   2.401   1.286
  196    HB2  PHE  25           HB2      PHE  25   7.426  -0.361   0.110
  197    HB3  PHE  25           HB3      PHE  25   6.015   0.598   0.512
  198    HD1  PHE  25           HD1      PHE  25   8.675   0.058  -1.885
  199    HD2  PHE  25           HD2      PHE  25   5.614   2.729  -0.640
  200    HE1  PHE  25           HE1      PHE  25   8.769   1.187  -4.071
  201    HE2  PHE  25           HE2      PHE  25   5.693   3.863  -2.810
  202    HZ   PHE  25           HZ       PHE  25   7.279   3.094  -4.536
  203    H    ALA  26           H        ALA  26   5.833   2.142   2.625
  204    HA   ALA  26           HA       ALA  26   6.257   0.262   4.858
  205    HB1  ALA  26           HB1      ALA  26   4.882   2.950   4.886
  206    HB2  ALA  26           HB2      ALA  26   6.481   2.593   5.540
  207    HB3  ALA  26           HB3      ALA  26   5.048   1.865   6.267
  208    H    ALA  27           H        ALA  27   4.518  -0.918   5.612
  209    HA   ALA  27           HA       ALA  27   2.385  -1.416   3.781
  210    HB1  ALA  27           HB1      ALA  27   3.308  -3.216   5.144
  211    HB2  ALA  27           HB2      ALA  27   1.587  -3.009   5.470
  212    HB3  ALA  27           HB3      ALA  27   2.780  -2.391   6.611
  213    H    PHE  28           H        PHE  28   1.253   0.463   3.544
  214    HA   PHE  28           HA       PHE  28   0.213   1.875   5.851
  215    HB2  PHE  28           HB2      PHE  28   1.093   3.056   3.841
  216    HB3  PHE  28           HB3      PHE  28  -0.208   2.366   2.888
  217    HD1  PHE  28           HD1      PHE  28  -2.618   2.959   3.616
  218    HD2  PHE  28           HD2      PHE  28   0.840   5.102   4.874
  219    HE1  PHE  28           HE1      PHE  28  -4.023   4.902   4.146
  220    HE2  PHE  28           HE2      PHE  28  -0.567   7.045   5.421
  221    HZ   PHE  28           HZ       PHE  28  -3.000   6.946   5.051
  222    H    GLY  29           H        GLY  29  -1.169   0.309   6.742
  223    HA2  GLY  29           HA2      GLY  29  -3.168  -0.735   7.107
  224    HA3  GLY  29           HA3      GLY  29  -3.837   0.642   6.250
  225    H    THR  30           H        THR  30  -4.838   0.300   4.417
  226    HA   THR  30           HA       THR  30  -4.363  -2.165   2.908
  227    HB   THR  30           HB       THR  30  -6.879  -2.390   2.665
  228    HG1  THR  30           HG1      THR  30  -6.982  -0.168   3.935
  229   HG21  THR  30          HG21      THR  30  -5.527  -3.923   3.989
  230   HG22  THR  30          HG22      THR  30  -7.082  -3.635   4.779
  231   HG23  THR  30          HG23      THR  30  -5.624  -2.836   5.375
  232    H    CYS  31           H        CYS  31  -5.085  -2.104   0.797
  233    HA   CYS  31           HA       CYS  31  -5.626   0.557  -0.333
  234    HB2  CYS  31           HB2      CYS  31  -3.737  -1.474  -1.052
  235    HB3  CYS  31           HB3      CYS  31  -4.879  -1.255  -2.370
  236    H    SER  32           H        SER  32  -6.512  -0.441  -2.859
  237    HA   SER  32           HA       SER  32  -9.110  -0.886  -2.817
  238    HB2  SER  32           HB2      SER  32  -7.352  -2.704  -4.431
  239    HB3  SER  32           HB3      SER  32  -8.900  -1.999  -4.887
  240    HG   SER  32           HG       SER  32  -6.731  -1.039  -5.645
  241    H    TRP  33           H        TRP  33 -10.187  -1.977  -1.301
  242    HA   TRP  33           HA       TRP  33 -10.995  -3.612   0.026
  243    HB2  TRP  33           HB2      TRP  33  -9.850  -5.501  -2.037
  244    HB3  TRP  33           HB3      TRP  33 -11.182  -5.818  -0.929
  245    HD1  TRP  33           HD1      TRP  33 -10.784  -5.149  -4.408
  246    HE1  TRP  33           HE1      TRP  33 -12.824  -3.965  -5.443
  247    HE3  TRP  33           HE3      TRP  33 -13.048  -3.523  -0.116
  248    HZ2  TRP  33           HZ2      TRP  33 -15.079  -2.526  -4.553
  249    HZ3  TRP  33           HZ3      TRP  33 -15.131  -2.228  -0.303
  250    HH2  TRP  33           HH2      TRP  33 -16.125  -1.750  -2.485
  251    H    ARG  34           H        ARG  34 -10.387  -5.602   1.374
  252    HA   ARG  34           HA       ARG  34  -7.784  -5.118   2.509
  253    HB2  ARG  34           HB2      ARG  34  -8.380  -6.901   4.126
  254    HB3  ARG  34           HB3      ARG  34  -9.586  -5.628   4.026
  255    HG2  ARG  34           HG2      ARG  34 -11.055  -7.016   2.768
  256    HG3  ARG  34           HG3      ARG  34  -9.811  -8.252   2.574
  257    HD2  ARG  34           HD2      ARG  34 -11.495  -8.810   4.305
  258    HD3  ARG  34           HD3      ARG  34  -9.847  -8.735   4.925
  259    HE   ARG  34           HE       ARG  34 -11.256  -6.258   5.218
  260   HH11  ARG  34          HH11      ARG  34 -10.772  -9.421   6.631
  261   HH12  ARG  34          HH12      ARG  34 -11.156  -8.901   8.239
  262   HH21  ARG  34          HH21      ARG  34 -11.768  -5.574   7.334
  263   HH22  ARG  34          HH22      ARG  34 -11.732  -6.719   8.638
  264    H    GLN  35           H        GLN  35  -7.948  -6.119  -0.198
  265    HA   GLN  35           HA       GLN  35  -6.692  -8.765  -0.012
  266    HB2  GLN  35           HB2      GLN  35  -7.650  -7.294  -2.472
  267    HB3  GLN  35           HB3      GLN  35  -7.209  -8.993  -2.353
  268    HG2  GLN  35           HG2      GLN  35  -9.497  -7.778  -0.839
  269    HG3  GLN  35           HG3      GLN  35  -9.663  -8.494  -2.434
  270   HE21  GLN  35          HE21      GLN  35  -9.062  -9.092   0.923
  271   HE22  GLN  35          HE22      GLN  35  -9.277 -10.805   0.872
  272    H    LYS  36           H        LYS  36  -6.234  -5.438  -0.845
  273    HA   LYS  36           HA       LYS  36  -3.446  -6.018  -1.595
  274    HB2  LYS  36           HB2      LYS  36  -4.861  -3.507  -2.426
  275    HB3  LYS  36           HB3      LYS  36  -3.444  -4.244  -3.120
  276    HG2  LYS  36           HG2      LYS  36  -6.069  -5.652  -3.262
  277    HG3  LYS  36           HG3      LYS  36  -5.699  -4.339  -4.382
  278    HD2  LYS  36           HD2      LYS  36  -3.854  -6.670  -3.949
  279    HD3  LYS  36           HD3      LYS  36  -5.134  -6.679  -5.166
  280    HE2  LYS  36           HE2      LYS  36  -3.135  -4.451  -5.030
  281    HE3  LYS  36           HE3      LYS  36  -2.769  -5.947  -5.866
  282    HZ1  LYS  36           HZ1      LYS  36  -3.690  -4.242  -7.316
  283    HZ2  LYS  36           HZ2      LYS  36  -5.074  -4.240  -6.463
  284    HZ3  LYS  36           HZ3      LYS  36  -4.634  -5.570  -7.285
  285    H    THR  37           H        THR  37  -1.889  -4.932  -0.512
  286    HA   THR  37           HA       THR  37  -2.744  -3.183   1.688
  287    HB   THR  37           HB       THR  37  -0.020  -4.420   1.167
  288    HG1  THR  37           HG1      THR  37  -0.874  -6.172   1.947
  289   HG21  THR  37          HG21      THR  37   0.044  -2.414   2.590
  290   HG22  THR  37          HG22      THR  37   0.446  -3.870   3.499
  291   HG23  THR  37          HG23      THR  37  -1.154  -3.142   3.663
  292    H    CYS  38           H        CYS  38  -1.908  -1.061   1.852
  293    HA   CYS  38           HA       CYS  38  -1.012   0.078  -0.645
  294    HB2  CYS  38           HB2      CYS  38  -2.590   1.397   0.565
  295    HB3  CYS  38           HB3      CYS  38  -1.649   1.275   2.049
  296    H    CYS  39           H        CYS  39   1.013   0.620  -1.155
  297    HA   CYS  39           HA       CYS  39   3.040   0.442   0.969
  298    HB2  CYS  39           HB2      CYS  39   3.351  -0.213  -1.969
  299    HB3  CYS  39           HB3      CYS  39   4.630  -0.290  -0.758
  300    H    VAL  40           H        VAL  40   3.697   2.388   1.492
  301    HA   VAL  40           HA       VAL  40   4.274   4.308  -0.643
  302    HB   VAL  40           HB       VAL  40   3.454   6.129   0.977
  303   HG11  VAL  40          HG11      VAL  40   1.221   6.028   0.088
  304   HG12  VAL  40          HG12      VAL  40   1.379   4.299  -0.219
  305   HG13  VAL  40          HG13      VAL  40   2.347   5.449  -1.144
  306   HG21  VAL  40          HG21      VAL  40   3.205   4.690   2.934
  307   HG22  VAL  40          HG22      VAL  40   1.960   3.767   2.088
  308   HG23  VAL  40          HG23      VAL  40   1.679   5.461   2.500
  Start of MODEL    6
    1    H1   LEU   1           H1       LEU   1 -13.910   4.424  -6.538
    2    H2   LEU   1           H2       LEU   1 -14.220   3.231  -7.593
    3    H3   LEU   1           H3       LEU   1 -13.219   4.435  -8.012
    4    HA   LEU   1           HA       LEU   1 -11.972   2.470  -7.519
    5    HB2  LEU   1           HB2      LEU   1 -11.691   4.605  -5.394
    6    HB3  LEU   1           HB3      LEU   1 -10.484   3.398  -5.782
    7    HG   LEU   1           HG       LEU   1 -10.635   4.475  -8.184
    8   HD11  LEU   1          HD11      LEU   1 -12.495   5.972  -7.610
    9   HD12  LEU   1          HD12      LEU   1 -11.058   6.853  -8.123
   10   HD13  LEU   1          HD13      LEU   1 -11.471   6.763  -6.412
   11   HD21  LEU   1          HD21      LEU   1  -8.791   5.954  -7.578
   12   HD22  LEU   1          HD22      LEU   1  -8.638   4.384  -6.791
   13   HD23  LEU   1          HD23      LEU   1  -9.205   5.779  -5.873
   14    HA   PRO   2           HA       PRO   2 -13.162  -0.687  -4.674
   15    HB2  PRO   2           HB2      PRO   2 -10.515  -0.045  -3.444
   16    HB3  PRO   2           HB3      PRO   2 -11.224  -1.617  -3.788
   17    HG2  PRO   2           HG2      PRO   2  -9.382  -0.453  -5.383
   18    HG3  PRO   2           HG3      PRO   2 -10.642  -1.536  -6.006
   19    HD2  PRO   2           HD2      PRO   2 -10.316   1.335  -6.403
   20    HD3  PRO   2           HD3      PRO   2 -11.419   0.215  -7.223
   21    H    ARG   3           H        ARG   3 -11.037   1.080  -2.489
   22    HA   ARG   3           HA       ARG   3 -13.117   2.495  -1.186
   23    HB2  ARG   3           HB2      ARG   3 -13.002   1.295   0.996
   24    HB3  ARG   3           HB3      ARG   3 -13.750   0.384  -0.291
   25    HG2  ARG   3           HG2      ARG   3 -11.864  -1.031  -0.515
   26    HG3  ARG   3           HG3      ARG   3 -10.896  -0.003   0.544
   27    HD2  ARG   3           HD2      ARG   3 -13.412  -1.379   1.451
   28    HD3  ARG   3           HD3      ARG   3 -11.814  -2.109   1.596
   29    HE   ARG   3           HE       ARG   3 -11.343   0.162   2.826
   30   HH11  ARG   3          HH11      ARG   3 -14.177  -1.895   3.093
   31   HH12  ARG   3          HH12      ARG   3 -14.530  -1.404   4.717
   32   HH21  ARG   3          HH21      ARG   3 -11.813   0.806   4.947
   33   HH22  ARG   3          HH22      ARG   3 -13.181   0.134   5.778
   34    H    ASP   4           H        ASP   4  -9.889   1.078  -0.644
   35    HA   ASP   4           HA       ASP   4  -9.162   3.508   0.828
   36    HB2  ASP   4           HB2      ASP   4  -7.999   0.735   0.810
   37    HB3  ASP   4           HB3      ASP   4  -7.132   2.100   1.505
   38    H    THR   5           H        THR   5  -8.726   2.069  -2.188
   39    HA   THR   5           HA       THR   5  -6.197   2.594  -3.020
   40    HB   THR   5           HB       THR   5  -8.562   3.433  -4.676
   41    HG1  THR   5           HG1      THR   5  -7.728   0.762  -4.712
   42   HG21  THR   5          HG21      THR   5  -7.220   2.497  -6.502
   43   HG22  THR   5          HG22      THR   5  -5.955   2.059  -5.353
   44   HG23  THR   5          HG23      THR   5  -6.331   3.762  -5.643
   45    H    SER   6           H        SER   6  -8.840   5.000  -2.985
   46    HA   SER   6           HA       SER   6  -7.381   7.150  -3.998
   47    HB2  SER   6           HB2      SER   6  -9.691   7.265  -2.042
   48    HB3  SER   6           HB3      SER   6  -9.181   8.545  -3.142
   49    HG   SER   6           HG       SER   6  -9.971   7.455  -4.826
   50    H    ARG   7           H        ARG   7  -7.824   6.007  -0.700
   51    HA   ARG   7           HA       ARG   7  -6.616   8.173   0.616
   52    HB2  ARG   7           HB2      ARG   7  -7.997   6.538   1.785
   53    HB3  ARG   7           HB3      ARG   7  -6.835   5.271   1.427
   54    HG2  ARG   7           HG2      ARG   7  -5.192   6.311   2.840
   55    HG3  ARG   7           HG3      ARG   7  -6.258   7.691   3.121
   56    HD2  ARG   7           HD2      ARG   7  -6.819   4.834   3.913
   57    HD3  ARG   7           HD3      ARG   7  -6.297   6.121   5.001
   58    HE   ARG   7           HE       ARG   7  -8.589   7.035   3.753
   59   HH11  ARG   7          HH11      ARG   7  -7.714   4.385   5.873
   60   HH12  ARG   7          HH12      ARG   7  -9.293   4.277   6.584
   61   HH21  ARG   7          HH21      ARG   7 -10.657   6.896   4.696
   62   HH22  ARG   7          HH22      ARG   7 -10.960   5.701   5.921
   63    H    CYS   8           H        CYS   8  -5.325   5.142  -0.661
   64    HA   CYS   8           HA       CYS   8  -2.690   5.498   0.314
   65    HB2  CYS   8           HB2      CYS   8  -3.488   3.308  -0.296
   66    HB3  CYS   8           HB3      CYS   8  -3.789   3.830  -1.951
   67    H    VAL   9           H        VAL   9  -4.237   6.281  -2.774
   68    HA   VAL   9           HA       VAL   9  -1.733   7.038  -3.974
   69    HB   VAL   9           HB       VAL   9  -3.594   6.039  -5.291
   70   HG11  VAL   9          HG11      VAL   9  -4.954   8.695  -4.915
   71   HG12  VAL   9          HG12      VAL   9  -5.461   7.157  -4.216
   72   HG13  VAL   9          HG13      VAL   9  -5.494   7.382  -5.964
   73   HG21  VAL   9          HG21      VAL   9  -3.388   7.519  -7.238
   74   HG22  VAL   9          HG22      VAL   9  -1.841   7.262  -6.435
   75   HG23  VAL   9          HG23      VAL   9  -2.715   8.776  -6.199
   76    H    GLY  10           H        GLY  10  -4.114   8.614  -2.084
   77    HA2  GLY  10           HA2      GLY  10  -3.603  11.296  -2.799
   78    HA3  GLY  10           HA3      GLY  10  -4.165  10.749  -1.225
   79    H    TYR  11           H        TYR  11  -1.765   8.952  -1.064
   80    HA   TYR  11           HA       TYR  11   0.162  10.926  -0.139
   81    HB2  TYR  11           HB2      TYR  11   0.056   7.909   0.111
   82    HB3  TYR  11           HB3      TYR  11   1.393   8.886   0.709
   83    HD1  TYR  11           HD1      TYR  11  -2.258   8.329   1.071
   84    HD2  TYR  11           HD2      TYR  11   1.280   9.908   2.817
   85    HE1  TYR  11           HE1      TYR  11  -3.461   8.670   3.181
   86    HE2  TYR  11           HE2      TYR  11   0.084  10.256   4.937
   87    HH   TYR  11           HH       TYR  11  -2.986   8.907   5.558
   88    H    HIS  12           H        HIS  12   1.730   8.112  -1.042
   89    HA   HIS  12           HA       HIS  12   2.243   8.701  -3.805
   90    HB2  HIS  12           HB2      HIS  12   4.613   8.959  -1.937
   91    HB3  HIS  12           HB3      HIS  12   4.592   9.215  -3.670
   92    HD1  HIS  12           HD1      HIS  12   3.417  11.477  -4.485
   93    HD2  HIS  12           HD2      HIS  12   4.145  11.149  -0.405
   94    HE1  HIS  12           HE1      HIS  12   3.226  13.812  -3.574
   95    HE2  HIS  12           HE2      HIS  12   3.694  13.597  -1.108
   96    H    GLY  13           H        GLY  13   2.056   6.583  -4.410
   97    HA2  GLY  13           HA2      GLY  13   4.032   4.711  -3.964
   98    HA3  GLY  13           HA3      GLY  13   2.852   4.449  -2.690
   99    H    TYR  14           H        TYR  14   1.907   2.575  -3.274
  100    HA   TYR  14           HA       TYR  14   0.122   2.539  -5.470
  101    HB2  TYR  14           HB2      TYR  14   1.202   0.774  -6.818
  102    HB3  TYR  14           HB3      TYR  14   2.103   2.277  -6.834
  103    HD1  TYR  14           HD1      TYR  14   4.102   2.428  -5.154
  104    HD2  TYR  14           HD2      TYR  14   2.282  -1.220  -6.367
  105    HE1  TYR  14           HE1      TYR  14   6.131   1.203  -4.503
  106    HE2  TYR  14           HE2      TYR  14   4.304  -2.449  -5.716
  107    HH   TYR  14           HH       TYR  14   6.817  -1.020  -3.885
  108    H    CYS  15           H        CYS  15  -0.653   0.235  -5.892
  109    HA   CYS  15           HA       CYS  15  -1.079  -0.996  -3.253
  110    HB2  CYS  15           HB2      CYS  15  -2.843  -0.974  -5.715
  111    HB3  CYS  15           HB3      CYS  15  -3.237  -1.756  -4.189
  112    H    ILE  16           H        ILE  16  -0.522  -3.085  -2.951
  113    HA   ILE  16           HA       ILE  16   0.061  -4.698  -5.349
  114    HB   ILE  16           HB       ILE  16   1.890  -5.768  -4.265
  115   HG12  ILE  16          HG12      ILE  16   1.297  -4.117  -1.809
  116   HG13  ILE  16          HG13      ILE  16   0.856  -5.806  -1.995
  117   HG21  ILE  16          HG21      ILE  16   2.436  -3.648  -5.299
  118   HG22  ILE  16          HG22      ILE  16   3.443  -3.917  -3.875
  119   HG23  ILE  16          HG23      ILE  16   2.077  -2.803  -3.793
  120   HD11  ILE  16          HD11      ILE  16   2.848  -5.628  -0.676
  121   HD12  ILE  16          HD12      ILE  16   3.641  -4.675  -1.931
  122   HD13  ILE  16          HD13      ILE  16   3.241  -6.366  -2.230
  123    H    ARG  17           H        ARG  17  -0.371  -6.912  -5.184
  124    HA   ARG  17           HA       ARG  17  -2.295  -7.671  -3.167
  125    HB2  ARG  17           HB2      ARG  17  -1.952  -9.962  -4.518
  126    HB3  ARG  17           HB3      ARG  17  -3.032  -8.690  -5.053
  127    HG2  ARG  17           HG2      ARG  17  -1.774  -9.523  -6.920
  128    HG3  ARG  17           HG3      ARG  17  -1.274  -7.873  -6.580
  129    HD2  ARG  17           HD2      ARG  17   0.305  -9.962  -5.241
  130    HD3  ARG  17           HD3      ARG  17   0.416  -9.955  -6.998
  131    HE   ARG  17           HE       ARG  17   0.898  -7.399  -6.511
  132   HH11  ARG  17          HH11      ARG  17   2.077 -10.210  -4.783
  133   HH12  ARG  17          HH12      ARG  17   3.605  -9.488  -4.392
  134   HH21  ARG  17          HH21      ARG  17   2.923  -6.448  -5.994
  135   HH22  ARG  17          HH22      ARG  17   4.088  -7.355  -5.081
  136    H    SER  18           H        SER  18  -0.959  -7.507  -1.380
  137    HA   SER  18           HA       SER  18   0.082  -9.877  -0.368
  138    HB2  SER  18           HB2      SER  18   1.963  -9.441  -1.959
  139    HB3  SER  18           HB3      SER  18   2.226  -7.881  -1.183
  140    HG   SER  18           HG       SER  18   2.751 -10.470  -0.234
  141    H    LYS  19           H        LYS  19   1.248  -9.348   1.801
  142    HA   LYS  19           HA       LYS  19   0.374  -6.701   2.752
  143    HB2  LYS  19           HB2      LYS  19   0.485  -9.276   4.334
  144    HB3  LYS  19           HB3      LYS  19   0.086  -7.696   4.996
  145    HG2  LYS  19           HG2      LYS  19  -1.782  -7.674   3.216
  146    HG3  LYS  19           HG3      LYS  19  -1.498  -9.413   3.129
  147    HD2  LYS  19           HD2      LYS  19  -3.278  -9.033   4.677
  148    HD3  LYS  19           HD3      LYS  19  -1.854  -9.516   5.599
  149    HE2  LYS  19           HE2      LYS  19  -3.052  -7.646   6.653
  150    HE3  LYS  19           HE3      LYS  19  -1.413  -7.204   6.187
  151    HZ1  LYS  19           HZ1      LYS  19  -3.846  -6.542   4.680
  152    HZ2  LYS  19           HZ2      LYS  19  -2.334  -6.119   4.254
  153    HZ3  LYS  19           HZ3      LYS  19  -2.995  -5.507   5.606
  154    H    VAL  20           H        VAL  20   2.949  -8.189   1.740
  155    HA   VAL  20           HA       VAL  20   4.722  -6.967   3.758
  156    HB   VAL  20           HB       VAL  20   5.415  -9.154   1.779
  157   HG11  VAL  20          HG11      VAL  20   7.302  -7.680   2.283
  158   HG12  VAL  20          HG12      VAL  20   7.542  -9.285   2.976
  159   HG13  VAL  20          HG13      VAL  20   7.050  -7.943   4.008
  160   HG21  VAL  20          HG21      VAL  20   5.022  -9.298   4.767
  161   HG22  VAL  20          HG22      VAL  20   5.595 -10.613   3.742
  162   HG23  VAL  20          HG23      VAL  20   3.958  -9.989   3.542
  163    H    CYS  21           H        CYS  21   5.184  -4.982   3.044
  164    HA   CYS  21           HA       CYS  21   5.221  -4.413   0.216
  165    HB2  CYS  21           HB2      CYS  21   5.431  -2.718   2.687
  166    HB3  CYS  21           HB3      CYS  21   5.720  -2.051   1.083
  167    HA   PRO  22           HA       PRO  22   9.610  -4.857  -0.331
  168    HB2  PRO  22           HB2      PRO  22   9.721  -3.374  -2.640
  169    HB3  PRO  22           HB3      PRO  22   9.288  -5.085  -2.575
  170    HG2  PRO  22           HG2      PRO  22   7.527  -2.687  -2.778
  171    HG3  PRO  22           HG3      PRO  22   7.365  -4.273  -3.549
  172    HD2  PRO  22           HD2      PRO  22   5.895  -3.557  -1.408
  173    HD3  PRO  22           HD3      PRO  22   6.416  -5.231  -1.686
  174    H    LYS  23           H        LYS  23  11.470  -3.504  -0.287
  175    HA   LYS  23           HA       LYS  23  10.849  -0.962   0.999
  176    HB2  LYS  23           HB2      LYS  23  13.368  -2.621   0.988
  177    HB3  LYS  23           HB3      LYS  23  13.252  -1.034   1.737
  178    HG2  LYS  23           HG2      LYS  23  12.968  -2.577   3.479
  179    HG3  LYS  23           HG3      LYS  23  11.349  -1.979   3.117
  180    HD2  LYS  23           HD2      LYS  23  10.967  -3.983   1.721
  181    HD3  LYS  23           HD3      LYS  23  12.549  -4.591   2.207
  182    HE2  LYS  23           HE2      LYS  23  10.898  -5.650   3.570
  183    HE3  LYS  23           HE3      LYS  23  11.780  -4.502   4.574
  184    HZ1  LYS  23           HZ1      LYS  23   9.959  -2.981   4.343
  185    HZ2  LYS  23           HZ2      LYS  23   9.408  -4.391   4.930
  186    HZ3  LYS  23           HZ3      LYS  23   9.148  -4.008   3.369
  187    HA   PRO  24           HA       PRO  24  11.793   0.554   1.682
  188    HB2  PRO  24           HB2      PRO  24  12.097   3.202   1.595
  189    HB3  PRO  24           HB3      PRO  24  13.496   2.124   1.611
  190    HG2  PRO  24           HG2      PRO  24  12.298   3.646  -0.650
  191    HG3  PRO  24           HG3      PRO  24  13.997   3.260  -0.330
  192    HD2  PRO  24           HD2      PRO  24  12.261   1.893  -2.079
  193    HD3  PRO  24           HD3      PRO  24  13.858   1.352  -1.535
  194    H    PHE  25           H        PHE  25   9.683   0.235   1.940
  195    HA   PHE  25           HA       PHE  25   7.846   2.398   1.454
  196    HB2  PHE  25           HB2      PHE  25   7.522  -0.275   0.103
  197    HB3  PHE  25           HB3      PHE  25   6.133   0.711   0.507
  198    HD1  PHE  25           HD1      PHE  25   8.913   0.259  -1.793
  199    HD2  PHE  25           HD2      PHE  25   5.807   2.881  -0.555
  200    HE1  PHE  25           HE1      PHE  25   9.127   1.508  -3.904
  201    HE2  PHE  25           HE2      PHE  25   6.000   4.138  -2.650
  202    HZ   PHE  25           HZ       PHE  25   7.673   3.453  -4.338
  203    H    ALA  26           H        ALA  26   5.976   2.195   2.740
  204    HA   ALA  26           HA       ALA  26   6.280   0.243   4.925
  205    HB1  ALA  26           HB1      ALA  26   6.443   2.592   5.611
  206    HB2  ALA  26           HB2      ALA  26   5.019   1.818   6.304
  207    HB3  ALA  26           HB3      ALA  26   4.848   2.901   4.923
  208    H    ALA  27           H        ALA  27   4.535  -0.985   5.574
  209    HA   ALA  27           HA       ALA  27   2.462  -1.421   3.653
  210    HB1  ALA  27           HB1      ALA  27   2.807  -2.510   6.447
  211    HB2  ALA  27           HB2      ALA  27   3.345  -3.275   4.952
  212    HB3  ALA  27           HB3      ALA  27   1.623  -3.074   5.270
  213    H    PHE  28           H        PHE  28   1.346   0.472   3.472
  214    HA   PHE  28           HA       PHE  28   0.326   1.851   5.792
  215    HB2  PHE  28           HB2      PHE  28   1.157   3.069   3.808
  216    HB3  PHE  28           HB3      PHE  28  -0.112   2.350   2.832
  217    HD1  PHE  28           HD1      PHE  28  -2.547   2.875   3.530
  218    HD2  PHE  28           HD2      PHE  28   0.834   5.096   4.853
  219    HE1  PHE  28           HE1      PHE  28  -4.010   4.777   4.058
  220    HE2  PHE  28           HE2      PHE  28  -0.627   6.996   5.394
  221    HZ   PHE  28           HZ       PHE  28  -3.052   6.838   4.993
  222    H    GLY  29           H        GLY  29  -1.102   0.432   6.755
  223    HA2  GLY  29           HA2      GLY  29  -3.131  -0.526   7.176
  224    HA3  GLY  29           HA3      GLY  29  -3.758   0.806   6.221
  225    H    THR  30           H        THR  30  -4.721   0.384   4.378
  226    HA   THR  30           HA       THR  30  -4.217  -2.122   2.981
  227    HB   THR  30           HB       THR  30  -6.743  -2.398   2.725
  228    HG1  THR  30           HG1      THR  30  -7.830  -0.834   3.677
  229   HG21  THR  30          HG21      THR  30  -6.912  -3.647   4.848
  230   HG22  THR  30          HG22      THR  30  -5.438  -2.852   5.410
  231   HG23  THR  30          HG23      THR  30  -5.381  -3.935   4.018
  232    H    CYS  31           H        CYS  31  -4.982  -2.150   0.875
  233    HA   CYS  31           HA       CYS  31  -5.500   0.471  -0.347
  234    HB2  CYS  31           HB2      CYS  31  -3.824  -1.801  -1.101
  235    HB3  CYS  31           HB3      CYS  31  -4.877  -1.263  -2.400
  236    H    SER  32           H        SER  32  -6.426  -0.560  -2.804
  237    HA   SER  32           HA       SER  32  -9.013  -0.957  -2.832
  238    HB2  SER  32           HB2      SER  32  -7.228  -2.894  -4.266
  239    HB3  SER  32           HB3      SER  32  -8.754  -2.217  -4.820
  240    HG   SER  32           HG       SER  32  -6.735  -1.277  -5.702
  241    H    TRP  33           H        TRP  33 -10.205  -1.945  -1.338
  242    HA   TRP  33           HA       TRP  33 -11.068  -3.441   0.109
  243    HB2  TRP  33           HB2      TRP  33  -9.933  -5.511  -1.779
  244    HB3  TRP  33           HB3      TRP  33 -11.268  -5.729  -0.650
  245    HD1  TRP  33           HD1      TRP  33 -10.854  -5.354  -4.158
  246    HE1  TRP  33           HE1      TRP  33 -12.875  -4.223  -5.292
  247    HE3  TRP  33           HE3      TRP  33 -13.118  -3.362  -0.023
  248    HZ2  TRP  33           HZ2      TRP  33 -15.120  -2.693  -4.533
  249    HZ3  TRP  33           HZ3      TRP  33 -15.184  -2.066  -0.317
  250    HH2  TRP  33           HH2      TRP  33 -16.164  -1.747  -2.534
  251    H    ARG  34           H        ARG  34 -10.554  -5.339   1.600
  252    HA   ARG  34           HA       ARG  34  -8.028  -4.771   2.839
  253    HB2  ARG  34           HB2      ARG  34  -8.739  -6.331   4.579
  254    HB3  ARG  34           HB3      ARG  34 -10.021  -5.193   4.192
  255    HG2  ARG  34           HG2      ARG  34 -11.111  -6.917   2.822
  256    HG3  ARG  34           HG3      ARG  34  -9.841  -8.056   3.273
  257    HD2  ARG  34           HD2      ARG  34 -11.769  -6.686   5.144
  258    HD3  ARG  34           HD3      ARG  34 -11.808  -8.382   4.664
  259    HE   ARG  34           HE       ARG  34  -9.376  -8.225   5.721
  260   HH11  ARG  34          HH11      ARG  34 -12.456  -7.065   6.905
  261   HH12  ARG  34          HH12      ARG  34 -11.990  -7.134   8.573
  262   HH21  ARG  34          HH21      ARG  34  -8.758  -8.335   7.914
  263   HH22  ARG  34          HH22      ARG  34  -9.886  -7.880   9.151
  264    H    GLN  35           H        GLN  35  -8.029  -5.996   0.193
  265    HA   GLN  35           HA       GLN  35  -6.797  -8.611   0.679
  266    HB2  GLN  35           HB2      GLN  35  -7.634  -7.379  -1.950
  267    HB3  GLN  35           HB3      GLN  35  -7.218  -9.061  -1.644
  268    HG2  GLN  35           HG2      GLN  35  -9.555  -7.677  -0.365
  269    HG3  GLN  35           HG3      GLN  35  -9.660  -8.567  -1.876
  270   HE21  GLN  35          HE21      GLN  35  -9.160  -8.790   1.549
  271   HE22  GLN  35          HE22      GLN  35  -9.424 -10.490   1.685
  272    H    LYS  36           H        LYS  36  -6.316  -5.465  -0.870
  273    HA   LYS  36           HA       LYS  36  -3.510  -6.186  -1.373
  274    HB2  LYS  36           HB2      LYS  36  -4.813  -3.687  -2.431
  275    HB3  LYS  36           HB3      LYS  36  -3.424  -4.550  -3.057
  276    HG2  LYS  36           HG2      LYS  36  -4.984  -6.411  -3.682
  277    HG3  LYS  36           HG3      LYS  36  -6.319  -5.336  -3.253
  278    HD2  LYS  36           HD2      LYS  36  -5.955  -5.244  -5.635
  279    HD3  LYS  36           HD3      LYS  36  -5.493  -3.704  -4.913
  280    HE2  LYS  36           HE2      LYS  36  -3.161  -4.274  -5.056
  281    HE3  LYS  36           HE3      LYS  36  -3.548  -5.907  -5.600
  282    HZ1  LYS  36           HZ1      LYS  36  -4.454  -4.967  -7.594
  283    HZ2  LYS  36           HZ2      LYS  36  -2.925  -4.448  -7.413
  284    HZ3  LYS  36           HZ3      LYS  36  -4.164  -3.448  -7.088
  285    H    THR  37           H        THR  37  -1.877  -5.024  -0.412
  286    HA   THR  37           HA       THR  37  -2.714  -3.129   1.667
  287    HB   THR  37           HB       THR  37  -0.019  -4.469   1.302
  288    HG1  THR  37           HG1      THR  37  -1.313  -6.109   1.886
  289   HG21  THR  37          HG21      THR  37  -1.193  -3.008   3.673
  290   HG22  THR  37          HG22      THR  37   0.055  -2.377   2.597
  291   HG23  THR  37          HG23      THR  37   0.390  -3.783   3.607
  292    H    CYS  38           H        CYS  38  -1.764  -1.063   1.803
  293    HA   CYS  38           HA       CYS  38  -0.873   0.008  -0.732
  294    HB2  CYS  38           HB2      CYS  38  -2.456   1.346   0.471
  295    HB3  CYS  38           HB3      CYS  38  -1.482   1.281   1.938
  296    H    CYS  39           H        CYS  39   1.149   0.626  -1.235
  297    HA   CYS  39           HA       CYS  39   3.183   0.392   0.880
  298    HB2  CYS  39           HB2      CYS  39   3.510  -0.144  -2.080
  299    HB3  CYS  39           HB3      CYS  39   4.778  -0.276  -0.861
  300    H    VAL  40           H        VAL  40   3.736   2.350   1.488
  301    HA   VAL  40           HA       VAL  40   4.425   4.328  -0.567
  302    HB   VAL  40           HB       VAL  40   3.529   6.113   1.032
  303   HG11  VAL  40          HG11      VAL  40   2.469   5.501  -1.104
  304   HG12  VAL  40          HG12      VAL  40   1.285   5.972   0.122
  305   HG13  VAL  40          HG13      VAL  40   1.528   4.266  -0.265
  306   HG21  VAL  40          HG21      VAL  40   3.237   4.639   2.972
  307   HG22  VAL  40          HG22      VAL  40   1.995   3.750   2.088
  308   HG23  VAL  40          HG23      VAL  40   1.732   5.441   2.517
  Start of MODEL    7
    1    H1   LEU   1           H1       LEU   1 -13.495   3.378  -8.289
    2    H2   LEU   1           H2       LEU   1 -12.375   4.507  -8.617
    3    H3   LEU   1           H3       LEU   1 -13.197   4.563  -7.216
    4    HA   LEU   1           HA       LEU   1 -11.335   2.453  -7.999
    5    HB2  LEU   1           HB2      LEU   1 -11.078   4.718  -6.018
    6    HB3  LEU   1           HB3      LEU   1  -9.987   3.349  -6.075
    7    HG   LEU   1           HG       LEU   1 -10.377   5.414  -8.240
    8   HD11  LEU   1          HD11      LEU   1  -8.054   5.996  -7.740
    9   HD12  LEU   1          HD12      LEU   1  -8.043   4.815  -6.432
   10   HD13  LEU   1          HD13      LEU   1  -9.099   6.224  -6.337
   11   HD21  LEU   1          HD21      LEU   1  -9.961   3.263  -9.257
   12   HD22  LEU   1          HD22      LEU   1  -8.604   2.978  -8.167
   13   HD23  LEU   1          HD23      LEU   1  -8.513   4.261  -9.372
   14    HA   PRO   2           HA       PRO   2 -12.954  -0.508  -5.188
   15    HB2  PRO   2           HB2      PRO   2 -10.346  -0.098  -3.783
   16    HB3  PRO   2           HB3      PRO   2 -11.186  -1.601  -4.145
   17    HG2  PRO   2           HG2      PRO   2  -9.165  -0.806  -5.650
   18    HG3  PRO   2           HG3      PRO   2 -10.607  -1.528  -6.399
   19    HD2  PRO   2           HD2      PRO   2  -9.696   1.294  -6.381
   20    HD3  PRO   2           HD3      PRO   2 -10.699   0.438  -7.567
   21    H    ARG   3           H        ARG   3 -10.826   1.209  -2.943
   22    HA   ARG   3           HA       ARG   3 -12.958   2.477  -1.523
   23    HB2  ARG   3           HB2      ARG   3 -13.380   0.197  -0.798
   24    HB3  ARG   3           HB3      ARG   3 -11.707  -0.015  -0.338
   25    HG2  ARG   3           HG2      ARG   3 -12.186   1.982   1.258
   26    HG3  ARG   3           HG3      ARG   3 -13.869   1.493   1.020
   27    HD2  ARG   3           HD2      ARG   3 -12.905  -0.899   1.495
   28    HD3  ARG   3           HD3      ARG   3 -11.618   0.007   2.289
   29    HE   ARG   3           HE       ARG   3 -14.457   0.202   2.994
   30   HH11  ARG   3          HH11      ARG   3 -11.073   0.376   3.876
   31   HH12  ARG   3          HH12      ARG   3 -11.398   0.444   5.584
   32   HH21  ARG   3          HH21      ARG   3 -14.881   0.312   5.252
   33   HH22  ARG   3          HH22      ARG   3 -13.551   0.407   6.363
   34    H    ASP   4           H        ASP   4  -9.976   0.970  -0.304
   35    HA   ASP   4           HA       ASP   4  -9.120   3.524   0.758
   36    HB2  ASP   4           HB2      ASP   4  -8.204   0.689   1.073
   37    HB3  ASP   4           HB3      ASP   4  -7.122   2.000   1.525
   38    H    THR   5           H        THR   5  -8.798   2.013  -2.168
   39    HA   THR   5           HA       THR   5  -6.147   2.410  -2.902
   40    HB   THR   5           HB       THR   5  -8.512   2.912  -4.704
   41    HG1  THR   5           HG1      THR   5  -7.475   0.373  -4.711
   42   HG21  THR   5          HG21      THR   5  -5.762   1.786  -5.246
   43   HG22  THR   5          HG22      THR   5  -6.287   3.428  -5.625
   44   HG23  THR   5          HG23      THR   5  -7.034   2.052  -6.439
   45    H    SER   6           H        SER   6  -8.900   4.659  -3.185
   46    HA   SER   6           HA       SER   6  -7.488   6.795  -4.330
   47    HB2  SER   6           HB2      SER   6  -9.856   7.107  -2.477
   48    HB3  SER   6           HB3      SER   6  -9.427   8.092  -3.877
   49    HG   SER   6           HG       SER   6 -10.998   6.771  -4.605
   50    H    ARG   7           H        ARG   7  -7.943   5.764  -1.045
   51    HA   ARG   7           HA       ARG   7  -6.899   8.026   0.281
   52    HB2  ARG   7           HB2      ARG   7  -8.245   6.386   1.438
   53    HB3  ARG   7           HB3      ARG   7  -7.099   5.113   1.057
   54    HG2  ARG   7           HG2      ARG   7  -5.445   6.147   2.503
   55    HG3  ARG   7           HG3      ARG   7  -6.567   7.459   2.864
   56    HD2  ARG   7           HD2      ARG   7  -8.148   5.830   3.799
   57    HD3  ARG   7           HD3      ARG   7  -7.004   4.534   3.459
   58    HE   ARG   7           HE       ARG   7  -5.806   6.539   5.056
   59   HH11  ARG   7          HH11      ARG   7  -8.043   3.854   5.191
   60   HH12  ARG   7          HH12      ARG   7  -7.782   3.562   6.883
   61   HH21  ARG   7          HH21      ARG   7  -5.454   6.153   7.279
   62   HH22  ARG   7          HH22      ARG   7  -6.310   4.867   8.068
   63    H    CYS   8           H        CYS   8  -5.444   4.935  -0.693
   64    HA   CYS   8           HA       CYS   8  -2.860   5.458   0.269
   65    HB2  CYS   8           HB2      CYS   8  -3.565   3.218  -0.248
   66    HB3  CYS   8           HB3      CYS   8  -3.836   3.643  -1.935
   67    H    VAL   9           H        VAL   9  -4.318   6.029  -2.916
   68    HA   VAL   9           HA       VAL   9  -1.814   6.930  -4.038
   69    HB   VAL   9           HB       VAL   9  -3.589   5.807  -5.401
   70   HG11  VAL   9          HG11      VAL   9  -5.544   6.833  -4.406
   71   HG12  VAL   9          HG12      VAL   9  -5.527   7.057  -6.154
   72   HG13  VAL   9          HG13      VAL   9  -5.087   8.394  -5.089
   73   HG21  VAL   9          HG21      VAL   9  -1.873   7.088  -6.518
   74   HG22  VAL   9          HG22      VAL   9  -2.803   8.571  -6.300
   75   HG23  VAL   9          HG23      VAL   9  -3.412   7.295  -7.355
   76    H    GLY  10           H        GLY  10  -4.274   8.319  -2.161
   77    HA2  GLY  10           HA2      GLY  10  -3.964  11.042  -2.850
   78    HA3  GLY  10           HA3      GLY  10  -4.468  10.431  -1.277
   79    H    TYR  11           H        TYR  11  -1.986   8.782  -1.153
   80    HA   TYR  11           HA       TYR  11  -0.152  10.852  -0.246
   81    HB2  TYR  11           HB2      TYR  11  -0.140   7.842   0.074
   82    HB3  TYR  11           HB3      TYR  11   1.153   8.886   0.657
   83    HD1  TYR  11           HD1      TYR  11  -2.443   8.089   1.058
   84    HD2  TYR  11           HD2      TYR  11   0.954  10.062   2.686
   85    HE1  TYR  11           HE1      TYR  11  -3.661   8.444   3.157
   86    HE2  TYR  11           HE2      TYR  11  -0.257  10.422   4.792
   87    HH   TYR  11           HH       TYR  11  -3.208   8.860   5.505
   88    H    HIS  12           H        HIS  12   1.596   8.128  -1.052
   89    HA   HIS  12           HA       HIS  12   2.176   8.782  -3.793
   90    HB2  HIS  12           HB2      HIS  12   4.341   9.266  -1.722
   91    HB3  HIS  12           HB3      HIS  12   4.539   9.360  -3.463
   92    HD1  HIS  12           HD1      HIS  12   3.713  11.518  -4.633
   93    HD2  HIS  12           HD2      HIS  12   3.160  11.468  -0.513
   94    HE1  HIS  12           HE1      HIS  12   3.165  13.889  -3.997
   95    HE2  HIS  12           HE2      HIS  12   2.765  13.826  -1.511
   96    H    GLY  13           H        GLY  13   2.136   6.697  -4.447
   97    HA2  GLY  13           HA2      GLY  13   4.199   4.954  -4.199
   98    HA3  GLY  13           HA3      GLY  13   3.198   4.584  -2.801
   99    H    TYR  14           H        TYR  14   2.308   2.658  -3.318
  100    HA   TYR  14           HA       TYR  14   0.336   2.608  -5.372
  101    HB2  TYR  14           HB2      TYR  14   1.287   0.844  -6.766
  102    HB3  TYR  14           HB3      TYR  14   2.258   2.301  -6.821
  103    HD1  TYR  14           HD1      TYR  14   4.341   2.330  -5.213
  104    HD2  TYR  14           HD2      TYR  14   2.297  -1.200  -6.424
  105    HE1  TYR  14           HE1      TYR  14   6.343   0.998  -4.700
  106    HE2  TYR  14           HE2      TYR  14   4.291  -2.535  -5.911
  107    HH   TYR  14           HH       TYR  14   6.667  -2.273  -5.674
  108    H    CYS  15           H        CYS  15  -0.511   0.339  -5.686
  109    HA   CYS  15           HA       CYS  15  -0.771  -0.836  -3.002
  110    HB2  CYS  15           HB2      CYS  15  -2.718  -0.806  -5.317
  111    HB3  CYS  15           HB3      CYS  15  -3.014  -1.540  -3.746
  112    H    ILE  16           H        ILE  16  -0.322  -2.960  -2.705
  113    HA   ILE  16           HA       ILE  16   0.069  -4.593  -5.126
  114    HB   ILE  16           HB       ILE  16   1.932  -5.703  -4.192
  115   HG12  ILE  16          HG12      ILE  16   1.397  -4.213  -1.625
  116   HG13  ILE  16          HG13      ILE  16   1.076  -5.917  -1.899
  117   HG21  ILE  16          HG21      ILE  16   2.488  -3.538  -5.124
  118   HG22  ILE  16          HG22      ILE  16   3.545  -3.910  -3.765
  119   HG23  ILE  16          HG23      ILE  16   2.214  -2.774  -3.560
  120   HD11  ILE  16          HD11      ILE  16   3.100  -5.659  -0.633
  121   HD12  ILE  16          HD12      ILE  16   3.773  -4.586  -1.861
  122   HD13  ILE  16          HD13      ILE  16   3.486  -6.286  -2.236
  123    H    ARG  17           H        ARG  17  -0.560  -6.750  -4.995
  124    HA   ARG  17           HA       ARG  17  -2.259  -7.459  -2.753
  125    HB2  ARG  17           HB2      ARG  17  -2.225  -9.692  -4.302
  126    HB3  ARG  17           HB3      ARG  17  -3.362  -8.373  -4.496
  127    HG2  ARG  17           HG2      ARG  17  -2.479  -9.043  -6.640
  128    HG3  ARG  17           HG3      ARG  17  -1.940  -7.414  -6.252
  129    HD2  ARG  17           HD2      ARG  17  -0.097  -9.512  -5.381
  130    HD3  ARG  17           HD3      ARG  17  -0.340  -9.460  -7.125
  131    HE   ARG  17           HE       ARG  17   0.158  -6.900  -6.653
  132   HH11  ARG  17          HH11      ARG  17   1.750  -9.715  -5.306
  133   HH12  ARG  17          HH12      ARG  17   3.308  -8.953  -5.229
  134   HH21  ARG  17          HH21      ARG  17   2.219  -5.901  -6.571
  135   HH22  ARG  17          HH22      ARG  17   3.574  -6.790  -5.948
  136    H    SER  18           H        SER  18  -0.662  -7.501  -1.193
  137    HA   SER  18           HA       SER  18   0.446  -9.993  -0.535
  138    HB2  SER  18           HB2      SER  18   2.410  -7.903  -1.545
  139    HB3  SER  18           HB3      SER  18   2.881  -9.258  -0.525
  140    HG   SER  18           HG       SER  18   1.421  -9.933  -2.772
  141    H    LYS  19           H        LYS  19   1.327  -9.885   1.649
  142    HA   LYS  19           HA       LYS  19   0.370  -7.498   3.025
  143    HB2  LYS  19           HB2      LYS  19   1.276 -10.140   4.172
  144    HB3  LYS  19           HB3      LYS  19   0.477  -8.843   5.051
  145    HG2  LYS  19           HG2      LYS  19  -0.689 -10.544   2.862
  146    HG3  LYS  19           HG3      LYS  19  -1.123 -10.551   4.567
  147    HD2  LYS  19           HD2      LYS  19  -1.523  -8.259   2.643
  148    HD3  LYS  19           HD3      LYS  19  -2.780  -9.348   3.228
  149    HE2  LYS  19           HE2      LYS  19  -2.524  -8.536   5.470
  150    HE3  LYS  19           HE3      LYS  19  -1.111  -7.586   5.016
  151    HZ1  LYS  19           HZ1      LYS  19  -3.841  -7.130   4.038
  152    HZ2  LYS  19           HZ2      LYS  19  -2.535  -6.247   3.634
  153    HZ3  LYS  19           HZ3      LYS  19  -3.080  -6.232   5.166
  154    H    VAL  20           H        VAL  20   3.271  -8.746   1.897
  155    HA   VAL  20           HA       VAL  20   4.803  -7.138   3.830
  156    HB   VAL  20           HB       VAL  20   5.835  -9.263   1.937
  157   HG11  VAL  20          HG11      VAL  20   7.929  -9.058   3.191
  158   HG12  VAL  20          HG12      VAL  20   7.234  -7.743   4.137
  159   HG13  VAL  20          HG13      VAL  20   7.494  -7.541   2.404
  160   HG21  VAL  20          HG21      VAL  20   5.391  -9.361   4.920
  161   HG22  VAL  20          HG22      VAL  20   6.188 -10.610   3.961
  162   HG23  VAL  20          HG23      VAL  20   4.482 -10.249   3.696
  163    H    CYS  21           H        CYS  21   5.430  -5.198   3.133
  164    HA   CYS  21           HA       CYS  21   5.286  -4.580   0.306
  165    HB2  CYS  21           HB2      CYS  21   5.628  -2.925   2.796
  166    HB3  CYS  21           HB3      CYS  21   5.874  -2.231   1.195
  167    HA   PRO  22           HA       PRO  22   9.675  -4.903  -0.394
  168    HB2  PRO  22           HB2      PRO  22   9.749  -3.396  -2.661
  169    HB3  PRO  22           HB3      PRO  22   9.236  -5.086  -2.632
  170    HG2  PRO  22           HG2      PRO  22   7.591  -2.599  -2.721
  171    HG3  PRO  22           HG3      PRO  22   7.333  -4.153  -3.532
  172    HD2  PRO  22           HD2      PRO  22   5.979  -3.397  -1.298
  173    HD3  PRO  22           HD3      PRO  22   6.332  -5.091  -1.695
  174    H    LYS  23           H        LYS  23  11.529  -3.536  -0.351
  175    HA   LYS  23           HA       LYS  23  11.027  -0.982   0.911
  176    HB2  LYS  23           HB2      LYS  23  13.606  -2.461   0.370
  177    HB3  LYS  23           HB3      LYS  23  13.501  -0.922   1.213
  178    HG2  LYS  23           HG2      LYS  23  12.418  -3.582   2.099
  179    HG3  LYS  23           HG3      LYS  23  13.693  -2.622   2.853
  180    HD2  LYS  23           HD2      LYS  23  11.969  -0.827   3.231
  181    HD3  LYS  23           HD3      LYS  23  10.752  -1.991   2.702
  182    HE2  LYS  23           HE2      LYS  23  12.633  -2.352   5.034
  183    HE3  LYS  23           HE3      LYS  23  10.938  -1.886   5.151
  184    HZ1  LYS  23           HZ1      LYS  23  11.938  -4.424   4.078
  185    HZ2  LYS  23           HZ2      LYS  23  10.374  -4.000   4.159
  186    HZ3  LYS  23           HZ3      LYS  23  11.222  -4.221   5.525
  187    HA   PRO  24           HA       PRO  24  11.881   0.635   1.361
  188    HB2  PRO  24           HB2      PRO  24  12.118   3.323   1.059
  189    HB3  PRO  24           HB3      PRO  24  13.509   2.236   1.100
  190    HG2  PRO  24           HG2      PRO  24  12.465   3.769  -1.126
  191    HG3  PRO  24           HG3      PRO  24  13.973   2.850  -1.026
  192    HD2  PRO  24           HD2      PRO  24  11.378   2.077  -2.184
  193    HD3  PRO  24           HD3      PRO  24  12.976   1.375  -2.472
  194    H    PHE  25           H        PHE  25   9.793   0.306   1.865
  195    HA   PHE  25           HA       PHE  25   7.866   2.400   1.418
  196    HB2  PHE  25           HB2      PHE  25   7.551  -0.342   0.193
  197    HB3  PHE  25           HB3      PHE  25   6.163   0.663   0.579
  198    HD1  PHE  25           HD1      PHE  25   9.090   0.300  -1.649
  199    HD2  PHE  25           HD2      PHE  25   5.641   2.609  -0.683
  200    HE1  PHE  25           HE1      PHE  25   9.274   1.474  -3.800
  201    HE2  PHE  25           HE2      PHE  25   5.812   3.790  -2.823
  202    HZ   PHE  25           HZ       PHE  25   7.638   3.223  -4.394
  203    H    ALA  26           H        ALA  26   5.967   2.121   2.711
  204    HA   ALA  26           HA       ALA  26   6.367   0.235   4.943
  205    HB1  ALA  26           HB1      ALA  26   4.975   2.919   4.946
  206    HB2  ALA  26           HB2      ALA  26   6.568   2.577   5.625
  207    HB3  ALA  26           HB3      ALA  26   5.130   1.839   6.332
  208    H    ALA  27           H        ALA  27   4.669  -1.042   5.571
  209    HA   ALA  27           HA       ALA  27   2.523  -1.457   3.750
  210    HB1  ALA  27           HB1      ALA  27   1.719  -3.096   5.380
  211    HB2  ALA  27           HB2      ALA  27   2.885  -2.502   6.560
  212    HB3  ALA  27           HB3      ALA  27   3.446  -3.287   5.085
  213    H    PHE  28           H        PHE  28   1.429   0.434   3.557
  214    HA   PHE  28           HA       PHE  28   0.410   1.848   5.857
  215    HB2  PHE  28           HB2      PHE  28   1.224   3.037   3.841
  216    HB3  PHE  28           HB3      PHE  28  -0.046   2.288   2.890
  217    HD1  PHE  28           HD1      PHE  28   0.891   5.086   4.824
  218    HD2  PHE  28           HD2      PHE  28  -2.486   2.793   3.622
  219    HE1  PHE  28           HE1      PHE  28  -0.580   6.978   5.347
  220    HE2  PHE  28           HE2      PHE  28  -3.962   4.686   4.140
  221    HZ   PHE  28           HZ       PHE  28  -3.011   6.783   5.000
  222    H    GLY  29           H        GLY  29  -0.985   0.385   6.828
  223    HA2  GLY  29           HA2      GLY  29  -2.975  -0.650   7.246
  224    HA3  GLY  29           HA3      GLY  29  -3.640   0.702   6.349
  225    H    THR  30           H        THR  30  -4.562   0.358   4.447
  226    HA   THR  30           HA       THR  30  -4.197  -2.180   3.061
  227    HB   THR  30           HB       THR  30  -6.767  -2.342   2.936
  228    HG1  THR  30           HG1      THR  30  -6.359  -0.658   5.201
  229   HG21  THR  30          HG21      THR  30  -5.272  -2.975   5.485
  230   HG22  THR  30          HG22      THR  30  -5.343  -3.984   4.037
  231   HG23  THR  30          HG23      THR  30  -6.804  -3.702   4.990
  232    H    CYS  31           H        CYS  31  -4.921  -2.201   1.004
  233    HA   CYS  31           HA       CYS  31  -5.790   0.335  -0.187
  234    HB2  CYS  31           HB2      CYS  31  -4.027  -1.862  -1.141
  235    HB3  CYS  31           HB3      CYS  31  -5.060  -1.079  -2.333
  236    H    SER  32           H        SER  32  -6.694  -0.932  -2.589
  237    HA   SER  32           HA       SER  32  -9.239  -1.016  -2.573
  238    HB2  SER  32           HB2      SER  32  -7.930  -3.482  -3.646
  239    HB3  SER  32           HB3      SER  32  -9.240  -2.537  -4.344
  240    HG   SER  32           HG       SER  32  -7.281  -2.118  -5.417
  241    H    TRP  33           H        TRP  33 -10.607  -1.498  -1.036
  242    HA   TRP  33           HA       TRP  33 -11.887  -2.602   0.449
  243    HB2  TRP  33           HB2      TRP  33 -10.876  -5.159  -0.796
  244    HB3  TRP  33           HB3      TRP  33 -12.419  -4.884   0.012
  245    HD1  TRP  33           HD1      TRP  33 -10.978  -5.077  -3.361
  246    HE1  TRP  33           HE1      TRP  33 -12.588  -4.073  -5.109
  247    HE3  TRP  33           HE3      TRP  33 -14.175  -2.626  -0.210
  248    HZ2  TRP  33           HZ2      TRP  33 -14.896  -2.435  -5.137
  249    HZ3  TRP  33           HZ3      TRP  33 -16.036  -1.349  -1.175
  250    HH2  TRP  33           HH2      TRP  33 -16.390  -1.262  -3.593
  251    H    ARG  34           H        ARG  34 -10.484  -5.554   0.935
  252    HA   ARG  34           HA       ARG  34  -8.337  -4.524   2.655
  253    HB2  ARG  34           HB2      ARG  34  -8.806  -6.294   4.313
  254    HB3  ARG  34           HB3      ARG  34 -10.133  -5.154   4.163
  255    HG2  ARG  34           HG2      ARG  34 -11.386  -6.736   2.837
  256    HG3  ARG  34           HG3      ARG  34 -10.032  -7.867   2.867
  257    HD2  ARG  34           HD2      ARG  34 -11.553  -6.887   5.280
  258    HD3  ARG  34           HD3      ARG  34 -11.780  -8.450   4.498
  259    HE   ARG  34           HE       ARG  34  -9.070  -8.122   5.214
  260   HH11  ARG  34          HH11      ARG  34 -12.205  -8.701   6.647
  261   HH12  ARG  34          HH12      ARG  34 -11.566  -9.561   8.011
  262   HH21  ARG  34          HH21      ARG  34  -8.216  -9.256   7.008
  263   HH22  ARG  34          HH22      ARG  34  -9.297  -9.881   8.216
  264    H    GLN  35           H        GLN  35  -8.417  -5.500  -0.045
  265    HA   GLN  35           HA       GLN  35  -7.410  -8.239   0.062
  266    HB2  GLN  35           HB2      GLN  35  -8.082  -6.444  -2.276
  267    HB3  GLN  35           HB3      GLN  35  -7.600  -8.132  -2.396
  268    HG2  GLN  35           HG2      GLN  35  -9.997  -7.270  -0.825
  269    HG3  GLN  35           HG3      GLN  35 -10.073  -7.600  -2.550
  270   HE21  GLN  35          HE21      GLN  35  -9.699  -8.954   0.612
  271   HE22  GLN  35          HE22      GLN  35  -9.846 -10.614   0.148
  272    H    LYS  36           H        LYS  36  -6.452  -5.009  -0.966
  273    HA   LYS  36           HA       LYS  36  -3.748  -6.035  -1.495
  274    HB2  LYS  36           HB2      LYS  36  -4.858  -3.367  -2.371
  275    HB3  LYS  36           HB3      LYS  36  -3.405  -4.164  -2.944
  276    HG2  LYS  36           HG2      LYS  36  -4.824  -5.929  -3.952
  277    HG3  LYS  36           HG3      LYS  36  -6.258  -5.016  -3.461
  278    HD2  LYS  36           HD2      LYS  36  -5.778  -4.531  -5.771
  279    HD3  LYS  36           HD3      LYS  36  -5.426  -3.098  -4.807
  280    HE2  LYS  36           HE2      LYS  36  -3.042  -3.657  -4.851
  281    HE3  LYS  36           HE3      LYS  36  -3.395  -5.095  -5.805
  282    HZ1  LYS  36           HZ1      LYS  36  -3.896  -2.333  -6.662
  283    HZ2  LYS  36           HZ2      LYS  36  -4.203  -3.658  -7.545
  284    HZ3  LYS  36           HZ3      LYS  36  -2.669  -3.268  -7.179
  285    H    THR  37           H        THR  37  -1.962  -4.917  -0.616
  286    HA   THR  37           HA       THR  37  -2.603  -3.242   1.712
  287    HB   THR  37           HB       THR  37   0.055  -4.508   0.986
  288    HG1  THR  37           HG1      THR  37  -0.743  -6.295   1.752
  289   HG21  THR  37          HG21      THR  37  -0.966  -3.328   3.578
  290   HG22  THR  37          HG22      THR  37   0.243  -2.608   2.516
  291   HG23  THR  37          HG23      THR  37   0.594  -4.118   3.356
  292    H    CYS  38           H        CYS  38  -1.708  -1.155   1.893
  293    HA   CYS  38           HA       CYS  38  -0.878   0.023  -0.624
  294    HB2  CYS  38           HB2      CYS  38  -2.492   1.275   0.657
  295    HB3  CYS  38           HB3      CYS  38  -1.461   1.229   2.084
  296    H    CYS  39           H        CYS  39   1.141   0.586  -1.133
  297    HA   CYS  39           HA       CYS  39   3.163   0.432   0.998
  298    HB2  CYS  39           HB2      CYS  39   3.501  -0.225  -1.937
  299    HB3  CYS  39           HB3      CYS  39   4.779  -0.270  -0.721
  300    H    VAL  40           H        VAL  40   3.697   2.405   1.535
  301    HA   VAL  40           HA       VAL  40   4.389   4.306  -0.582
  302    HB   VAL  40           HB       VAL  40   3.484   6.149   0.937
  303   HG11  VAL  40          HG11      VAL  40   1.275   6.017   0.011
  304   HG12  VAL  40          HG12      VAL  40   1.431   4.274  -0.222
  305   HG13  VAL  40          HG13      VAL  40   2.420   5.382  -1.178
  306   HG21  VAL  40          HG21      VAL  40   1.952   3.839   2.096
  307   HG22  VAL  40          HG22      VAL  40   1.703   5.550   2.458
  308   HG23  VAL  40          HG23      VAL  40   3.205   4.756   2.934
  Start of MODEL    8
    1    H1   LEU   1           H1       LEU   1 -12.907   4.884  -7.629
    2    H2   LEU   1           H2       LEU   1 -13.257   4.951  -6.045
    3    H3   LEU   1           H3       LEU   1 -14.073   3.931  -7.010
    4    HA   LEU   1           HA       LEU   1 -12.141   2.626  -7.415
    5    HB2  LEU   1           HB2      LEU   1 -10.874   4.663  -5.576
    6    HB3  LEU   1           HB3      LEU   1 -10.118   3.148  -6.018
    7    HG   LEU   1           HG       LEU   1 -10.858   5.344  -7.953
    8   HD11  LEU   1          HD11      LEU   1  -8.163   4.507  -6.895
    9   HD12  LEU   1          HD12      LEU   1  -9.022   5.987  -6.473
   10   HD13  LEU   1          HD13      LEU   1  -8.462   5.733  -8.125
   11   HD21  LEU   1          HD21      LEU   1  -9.502   4.039  -9.545
   12   HD22  LEU   1          HD22      LEU   1 -10.943   3.175  -9.012
   13   HD23  LEU   1          HD23      LEU   1  -9.366   2.754  -8.343
   14    HA   PRO   2           HA       PRO   2 -13.194  -0.428  -4.480
   15    HB2  PRO   2           HB2      PRO   2 -10.459   0.077  -3.377
   16    HB3  PRO   2           HB3      PRO   2 -11.293  -1.458  -3.614
   17    HG2  PRO   2           HG2      PRO   2  -9.497  -0.464  -5.386
   18    HG3  PRO   2           HG3      PRO   2 -10.861  -1.495  -5.865
   19    HD2  PRO   2           HD2      PRO   2 -10.404   1.293  -6.485
   20    HD3  PRO   2           HD3      PRO   2 -11.704   0.234  -7.057
   21    H    ARG   3           H        ARG   3 -10.934   1.225  -2.314
   22    HA   ARG   3           HA       ARG   3 -12.987   2.465  -0.767
   23    HB2  ARG   3           HB2      ARG   3 -12.789   1.071   1.243
   24    HB3  ARG   3           HB3      ARG   3 -13.420   0.171  -0.118
   25    HG2  ARG   3           HG2      ARG   3 -11.458  -1.053  -0.388
   26    HG3  ARG   3           HG3      ARG   3 -10.516   0.075   0.590
   27    HD2  ARG   3           HD2      ARG   3 -12.781  -1.582   1.682
   28    HD3  ARG   3           HD3      ARG   3 -11.097  -2.102   1.713
   29    HE   ARG   3           HE       ARG   3 -10.681   0.004   3.021
   30   HH11  ARG   3          HH11      ARG   3 -13.825  -1.566   3.071
   31   HH12  ARG   3          HH12      ARG   3 -14.235  -0.965   4.643
   32   HH21  ARG   3          HH21      ARG   3 -11.231   0.785   5.091
   33   HH22  ARG   3          HH22      ARG   3 -12.770   0.383   5.784
   34    H    ASP   4           H        ASP   4  -9.678   1.244  -0.847
   35    HA   ASP   4           HA       ASP   4  -8.880   3.588   0.751
   36    HB2  ASP   4           HB2      ASP   4  -7.906   0.767   0.799
   37    HB3  ASP   4           HB3      ASP   4  -6.791   2.064   1.213
   38    H    THR   5           H        THR   5  -8.676   2.198  -2.277
   39    HA   THR   5           HA       THR   5  -6.117   2.629  -3.172
   40    HB   THR   5           HB       THR   5  -8.505   3.392  -4.826
   41    HG1  THR   5           HG1      THR   5  -7.717   0.714  -4.745
   42   HG21  THR   5          HG21      THR   5  -5.939   1.929  -5.468
   43   HG22  THR   5          HG22      THR   5  -6.265   3.630  -5.818
   44   HG23  THR   5          HG23      THR   5  -7.202   2.365  -6.620
   45    H    SER   6           H        SER   6  -8.804   4.989  -3.398
   46    HA   SER   6           HA       SER   6  -7.278   7.105  -4.404
   47    HB2  SER   6           HB2      SER   6  -9.755   7.319  -2.672
   48    HB3  SER   6           HB3      SER   6  -9.156   8.528  -3.807
   49    HG   SER   6           HG       SER   6  -9.981   7.440  -5.419
   50    H    ARG   7           H        ARG   7  -7.971   6.102  -1.114
   51    HA   ARG   7           HA       ARG   7  -6.871   8.292   0.245
   52    HB2  ARG   7           HB2      ARG   7  -8.198   6.779   1.492
   53    HB3  ARG   7           HB3      ARG   7  -7.251   5.395   0.968
   54    HG2  ARG   7           HG2      ARG   7  -5.383   6.118   2.327
   55    HG3  ARG   7           HG3      ARG   7  -6.263   7.573   2.798
   56    HD2  ARG   7           HD2      ARG   7  -7.269   4.786   3.331
   57    HD3  ARG   7           HD3      ARG   7  -6.283   5.693   4.477
   58    HE   ARG   7           HE       ARG   7  -8.164   7.434   4.221
   59   HH11  ARG   7          HH11      ARG   7  -8.636   3.960   4.122
   60   HH12  ARG   7          HH12      ARG   7 -10.236   4.047   4.794
   61   HH21  ARG   7          HH21      ARG   7 -10.259   7.536   5.090
   62   HH22  ARG   7          HH22      ARG   7 -11.161   6.076   5.343
   63    H    CYS   8           H        CYS   8  -5.421   5.198  -0.723
   64    HA   CYS   8           HA       CYS   8  -2.872   5.701   0.360
   65    HB2  CYS   8           HB2      CYS   8  -3.564   3.460  -0.120
   66    HB3  CYS   8           HB3      CYS   8  -3.812   3.842  -1.821
   67    H    VAL   9           H        VAL   9  -4.187   6.207  -2.894
   68    HA   VAL   9           HA       VAL   9  -1.613   6.919  -3.965
   69    HB   VAL   9           HB       VAL   9  -3.421   5.845  -5.323
   70   HG11  VAL   9          HG11      VAL   9  -4.748   8.542  -5.231
   71   HG12  VAL   9          HG12      VAL   9  -5.318   7.080  -4.426
   72   HG13  VAL   9          HG13      VAL   9  -5.259   7.148  -6.186
   73   HG21  VAL   9          HG21      VAL   9  -2.431   8.501  -6.341
   74   HG22  VAL   9          HG22      VAL   9  -3.075   7.200  -7.344
   75   HG23  VAL   9          HG23      VAL   9  -1.581   6.958  -6.435
   76    H    GLY  10           H        GLY  10  -4.027   8.567  -2.233
   77    HA2  GLY  10           HA2      GLY  10  -3.467  11.220  -3.058
   78    HA3  GLY  10           HA3      GLY  10  -4.118  10.745  -1.494
   79    H    TYR  11           H        TYR  11  -1.750   8.908  -1.188
   80    HA   TYR  11           HA       TYR  11   0.148  10.867  -0.178
   81    HB2  TYR  11           HB2      TYR  11   0.033   7.847   0.062
   82    HB3  TYR  11           HB3      TYR  11   1.296   8.841   0.774
   83    HD1  TYR  11           HD1      TYR  11  -2.292   8.014   0.908
   84    HD2  TYR  11           HD2      TYR  11   0.928  10.050   2.796
   85    HE1  TYR  11           HE1      TYR  11  -3.672   8.321   2.918
   86    HE2  TYR  11           HE2      TYR  11  -0.446  10.367   4.810
   87    HH   TYR  11           HH       TYR  11  -3.457   8.750   5.254
   88    H    HIS  12           H        HIS  12   1.796   8.084  -0.945
   89    HA   HIS  12           HA       HIS  12   2.505   8.743  -3.664
   90    HB2  HIS  12           HB2      HIS  12   4.593   9.042  -1.479
   91    HB3  HIS  12           HB3      HIS  12   4.902   9.118  -3.204
   92    HD1  HIS  12           HD1      HIS  12   4.394  11.329  -4.398
   93    HD2  HIS  12           HD2      HIS  12   3.438  11.338  -0.354
   94    HE1  HIS  12           HE1      HIS  12   3.966  13.736  -3.812
   95    HE2  HIS  12           HE2      HIS  12   3.248  13.696  -1.397
   96    H    GLY  13           H        GLY  13   2.314   6.662  -4.363
   97    HA2  GLY  13           HA2      GLY  13   4.227   4.761  -4.092
   98    HA3  GLY  13           HA3      GLY  13   3.183   4.462  -2.708
   99    H    TYR  14           H        TYR  14   2.183   2.586  -3.258
  100    HA   TYR  14           HA       TYR  14   0.215   2.633  -5.301
  101    HB2  TYR  14           HB2      TYR  14   1.116   0.943  -6.801
  102    HB3  TYR  14           HB3      TYR  14   2.143   2.361  -6.777
  103    HD1  TYR  14           HD1      TYR  14   4.273   2.236  -5.316
  104    HD2  TYR  14           HD2      TYR  14   1.998  -1.180  -6.447
  105    HE1  TYR  14           HE1      TYR  14   6.222   0.799  -4.887
  106    HE2  TYR  14           HE2      TYR  14   3.939  -2.622  -6.019
  107    HH   TYR  14           HH       TYR  14   6.285  -2.532  -5.826
  108    H    CYS  15           H        CYS  15  -0.603   0.339  -5.741
  109    HA   CYS  15           HA       CYS  15  -1.002  -0.888  -3.109
  110    HB2  CYS  15           HB2      CYS  15  -2.623  -1.149  -5.653
  111    HB3  CYS  15           HB3      CYS  15  -3.067  -1.782  -4.071
  112    H    ILE  16           H        ILE  16  -0.506  -3.011  -2.709
  113    HA   ILE  16           HA       ILE  16   0.273  -4.670  -5.014
  114    HB   ILE  16           HB       ILE  16   2.142  -5.570  -3.926
  115   HG12  ILE  16          HG12      ILE  16   1.331  -4.144  -1.391
  116   HG13  ILE  16          HG13      ILE  16   1.057  -5.852  -1.708
  117   HG21  ILE  16          HG21      ILE  16   2.562  -3.341  -4.787
  118   HG22  ILE  16          HG22      ILE  16   3.561  -3.674  -3.372
  119   HG23  ILE  16          HG23      ILE  16   2.132  -2.650  -3.222
  120   HD11  ILE  16          HD11      ILE  16   3.488  -6.179  -1.879
  121   HD12  ILE  16          HD12      ILE  16   2.979  -5.582  -0.301
  122   HD13  ILE  16          HD13      ILE  16   3.720  -4.480  -1.462
  123    H    ARG  17           H        ARG  17  -0.271  -6.846  -4.867
  124    HA   ARG  17           HA       ARG  17  -2.076  -7.570  -2.711
  125    HB2  ARG  17           HB2      ARG  17  -2.503  -9.633  -3.980
  126    HB3  ARG  17           HB3      ARG  17  -2.787  -8.203  -4.946
  127    HG2  ARG  17           HG2      ARG  17  -0.217  -9.741  -5.120
  128    HG3  ARG  17           HG3      ARG  17  -1.645 -10.202  -6.044
  129    HD2  ARG  17           HD2      ARG  17  -0.742  -8.847  -7.599
  130    HD3  ARG  17           HD3      ARG  17  -1.519  -7.584  -6.649
  131    HE   ARG  17           HE       ARG  17   1.004  -7.950  -5.557
  132   HH11  ARG  17          HH11      ARG  17  -0.340  -6.992  -8.642
  133   HH12  ARG  17          HH12      ARG  17   1.021  -6.010  -9.074
  134   HH21  ARG  17          HH21      ARG  17   2.794  -6.651  -6.113
  135   HH22  ARG  17          HH22      ARG  17   2.807  -5.808  -7.629
  136    H    SER  18           H        SER  18  -0.653  -7.595  -1.028
  137    HA   SER  18           HA       SER  18   0.593 -10.046  -0.385
  138    HB2  SER  18           HB2      SER  18   2.421  -7.701  -1.009
  139    HB3  SER  18           HB3      SER  18   2.922  -9.103  -0.075
  140    HG   SER  18           HG       SER  18   1.787  -9.908  -2.374
  141    H    LYS  19           H        LYS  19   1.655  -9.825   1.830
  142    HA   LYS  19           HA       LYS  19   0.332  -7.666   3.326
  143    HB2  LYS  19           HB2      LYS  19   1.514 -10.231   4.406
  144    HB3  LYS  19           HB3      LYS  19   0.544  -9.067   5.292
  145    HG2  LYS  19           HG2      LYS  19  -0.642 -10.341   2.884
  146    HG3  LYS  19           HG3      LYS  19  -0.486 -11.299   4.353
  147    HD2  LYS  19           HD2      LYS  19  -2.668 -10.317   4.324
  148    HD3  LYS  19           HD3      LYS  19  -1.722  -9.514   5.571
  149    HE2  LYS  19           HE2      LYS  19  -1.363  -7.611   4.141
  150    HE3  LYS  19           HE3      LYS  19  -2.156  -8.427   2.794
  151    HZ1  LYS  19           HZ1      LYS  19  -3.602  -6.861   3.917
  152    HZ2  LYS  19           HZ2      LYS  19  -3.466  -7.682   5.311
  153    HZ3  LYS  19           HZ3      LYS  19  -4.191  -8.373   4.031
  154    H    VAL  20           H        VAL  20   3.255  -8.572   2.071
  155    HA   VAL  20           HA       VAL  20   4.724  -6.877   3.978
  156    HB   VAL  20           HB       VAL  20   5.779  -9.180   2.323
  157   HG11  VAL  20          HG11      VAL  20   7.252  -7.415   4.268
  158   HG12  VAL  20          HG12      VAL  20   7.402  -7.343   2.512
  159   HG13  VAL  20          HG13      VAL  20   7.921  -8.787   3.384
  160   HG21  VAL  20          HG21      VAL  20   4.497  -9.900   4.270
  161   HG22  VAL  20          HG22      VAL  20   5.482  -8.871   5.309
  162   HG23  VAL  20          HG23      VAL  20   6.213 -10.245   4.482
  163    H    CYS  21           H        CYS  21   5.337  -5.007   3.142
  164    HA   CYS  21           HA       CYS  21   5.146  -4.546   0.292
  165    HB2  CYS  21           HB2      CYS  21   5.614  -2.758   2.669
  166    HB3  CYS  21           HB3      CYS  21   5.738  -2.163   1.016
  167    HA   PRO  22           HA       PRO  22   9.507  -4.908  -0.518
  168    HB2  PRO  22           HB2      PRO  22   9.546  -3.508  -2.848
  169    HB3  PRO  22           HB3      PRO  22   9.000  -5.185  -2.728
  170    HG2  PRO  22           HG2      PRO  22   7.404  -2.673  -2.897
  171    HG3  PRO  22           HG3      PRO  22   7.091  -4.258  -3.620
  172    HD2  PRO  22           HD2      PRO  22   5.828  -3.347  -1.383
  173    HD3  PRO  22           HD3      PRO  22   6.099  -5.067  -1.723
  174    H    LYS  23           H        LYS  23  11.349  -3.633  -0.310
  175    HA   LYS  23           HA       LYS  23  10.881  -1.014   0.793
  176    HB2  LYS  23           HB2      LYS  23  13.408  -2.613   0.409
  177    HB3  LYS  23           HB3      LYS  23  13.321  -1.064   1.245
  178    HG2  LYS  23           HG2      LYS  23  12.097  -1.951   3.011
  179    HG3  LYS  23           HG3      LYS  23  11.628  -3.383   2.092
  180    HD2  LYS  23           HD2      LYS  23  13.906  -4.181   2.125
  181    HD3  LYS  23           HD3      LYS  23  14.431  -2.725   2.976
  182    HE2  LYS  23           HE2      LYS  23  12.993  -3.320   4.867
  183    HE3  LYS  23           HE3      LYS  23  12.478  -4.774   4.015
  184    HZ1  LYS  23           HZ1      LYS  23  15.217  -4.192   4.893
  185    HZ2  LYS  23           HZ2      LYS  23  14.762  -5.527   4.085
  186    HZ3  LYS  23           HZ3      LYS  23  14.204  -5.260   5.588
  187    HA   PRO  24           HA       PRO  24  11.772   0.543   1.277
  188    HB2  PRO  24           HB2      PRO  24  12.037   3.180   1.085
  189    HB3  PRO  24           HB3      PRO  24  13.446   2.119   0.985
  190    HG2  PRO  24           HG2      PRO  24  11.996   3.560  -1.183
  191    HG3  PRO  24           HG3      PRO  24  13.726   3.212  -1.029
  192    HD2  PRO  24           HD2      PRO  24  11.843   1.761  -2.548
  193    HD3  PRO  24           HD3      PRO  24  13.499   1.266  -2.163
  194    H    PHE  25           H        PHE  25   9.660   0.187   1.698
  195    HA   PHE  25           HA       PHE  25   7.796   2.351   1.292
  196    HB2  PHE  25           HB2      PHE  25   7.393  -0.351   0.028
  197    HB3  PHE  25           HB3      PHE  25   6.021   0.633   0.509
  198    HD1  PHE  25           HD1      PHE  25   8.565   0.084  -1.992
  199    HD2  PHE  25           HD2      PHE  25   5.698   2.858  -0.527
  200    HE1  PHE  25           HE1      PHE  25   8.645   1.294  -4.134
  201    HE2  PHE  25           HE2      PHE  25   5.763   4.077  -2.655
  202    HZ   PHE  25           HZ       PHE  25   7.246   3.297  -4.468
  203    H    ALA  26           H        ALA  26   5.913   2.119   2.633
  204    HA   ALA  26           HA       ALA  26   6.363   0.256   4.872
  205    HB1  ALA  26           HB1      ALA  26   6.575   2.604   5.506
  206    HB2  ALA  26           HB2      ALA  26   5.163   1.874   6.271
  207    HB3  ALA  26           HB3      ALA  26   4.962   2.930   4.871
  208    H    ALA  27           H        ALA  27   4.626  -0.873   5.715
  209    HA   ALA  27           HA       ALA  27   2.487  -1.451   3.905
  210    HB1  ALA  27           HB1      ALA  27   1.739  -3.026   5.620
  211    HB2  ALA  27           HB2      ALA  27   2.900  -2.345   6.760
  212    HB3  ALA  27           HB3      ALA  27   3.469  -3.191   5.321
  213    H    PHE  28           H        PHE  28   1.309   0.403   3.635
  214    HA   PHE  28           HA       PHE  28   0.258   1.820   5.945
  215    HB2  PHE  28           HB2      PHE  28   1.126   3.019   3.926
  216    HB3  PHE  28           HB3      PHE  28  -0.181   2.317   2.984
  217    HD1  PHE  28           HD1      PHE  28   0.854   5.062   4.947
  218    HD2  PHE  28           HD2      PHE  28  -2.592   2.857   3.781
  219    HE1  PHE  28           HE1      PHE  28  -0.566   6.975   5.531
  220    HE2  PHE  28           HE2      PHE  28  -4.021   4.770   4.360
  221    HZ   PHE  28           HZ       PHE  28  -3.009   6.834   5.233
  222    H    GLY  29           H        GLY  29  -1.113   0.200   6.810
  223    HA2  GLY  29           HA2      GLY  29  -3.131  -0.812   7.155
  224    HA3  GLY  29           HA3      GLY  29  -3.775   0.582   6.305
  225    H    THR  30           H        THR  30  -4.595   0.345   4.320
  226    HA   THR  30           HA       THR  30  -4.279  -2.183   2.896
  227    HB   THR  30           HB       THR  30  -6.812  -2.256   2.606
  228    HG1  THR  30           HG1      THR  30  -7.851  -0.692   3.584
  229   HG21  THR  30          HG21      THR  30  -5.570  -3.895   3.911
  230   HG22  THR  30          HG22      THR  30  -7.110  -3.526   4.693
  231   HG23  THR  30          HG23      THR  30  -5.610  -2.828   5.315
  232    H    CYS  31           H        CYS  31  -5.082  -2.132   0.794
  233    HA   CYS  31           HA       CYS  31  -5.574   0.522  -0.377
  234    HB2  CYS  31           HB2      CYS  31  -3.664  -1.515  -1.082
  235    HB3  CYS  31           HB3      CYS  31  -4.789  -1.257  -2.408
  236    H    SER  32           H        SER  32  -6.420  -0.544  -2.896
  237    HA   SER  32           HA       SER  32  -9.010  -0.971  -2.895
  238    HB2  SER  32           HB2      SER  32  -7.239  -2.890  -4.371
  239    HB3  SER  32           HB3      SER  32  -8.780  -2.218  -4.890
  240    HG   SER  32           HG       SER  32  -7.002  -1.190  -5.908
  241    H    TRP  33           H        TRP  33 -10.142  -1.961  -1.353
  242    HA   TRP  33           HA       TRP  33 -11.016  -3.499   0.041
  243    HB2  TRP  33           HB2      TRP  33  -9.958  -5.506  -1.952
  244    HB3  TRP  33           HB3      TRP  33 -11.298  -5.733  -0.828
  245    HD1  TRP  33           HD1      TRP  33 -10.850  -5.166  -4.317
  246    HE1  TRP  33           HE1      TRP  33 -12.837  -3.941  -5.396
  247    HE3  TRP  33           HE3      TRP  33 -13.096  -3.379  -0.087
  248    HZ2  TRP  33           HZ2      TRP  33 -15.058  -2.409  -4.562
  249    HZ3  TRP  33           HZ3      TRP  33 -15.134  -2.026  -0.318
  250    HH2  TRP  33           HH2      TRP  33 -16.094  -1.556  -2.517
  251    H    ARG  34           H        ARG  34 -10.499  -5.618   1.322
  252    HA   ARG  34           HA       ARG  34  -7.997  -5.093   2.651
  253    HB2  ARG  34           HB2      ARG  34  -8.701  -6.789   4.260
  254    HB3  ARG  34           HB3      ARG  34  -9.990  -5.636   3.957
  255    HG2  ARG  34           HG2      ARG  34 -11.065  -7.256   2.452
  256    HG3  ARG  34           HG3      ARG  34  -9.787  -8.416   2.816
  257    HD2  ARG  34           HD2      ARG  34 -11.697  -7.204   4.811
  258    HD3  ARG  34           HD3      ARG  34 -11.792  -8.836   4.156
  259    HE   ARG  34           HE       ARG  34  -9.416  -8.992   5.211
  260   HH11  ARG  34          HH11      ARG  34 -12.220  -7.370   6.530
  261   HH12  ARG  34          HH12      ARG  34 -11.727  -7.573   8.179
  262   HH21  ARG  34          HH21      ARG  34  -8.756  -9.267   7.391
  263   HH22  ARG  34          HH22      ARG  34  -9.751  -8.647   8.669
  264    H    GLN  35           H        GLN  35  -7.946  -6.124  -0.078
  265    HA   GLN  35           HA       GLN  35  -6.679  -8.751   0.255
  266    HB2  GLN  35           HB2      GLN  35  -7.492  -7.349  -2.295
  267    HB3  GLN  35           HB3      GLN  35  -7.033  -9.036  -2.110
  268    HG2  GLN  35           HG2      GLN  35  -9.438  -7.809  -0.803
  269    HG3  GLN  35           HG3      GLN  35  -9.471  -8.618  -2.362
  270   HE21  GLN  35          HE21      GLN  35 -10.831  -9.289   0.113
  271   HE22  GLN  35          HE22      GLN  35 -10.338 -10.898   0.515
  272    H    LYS  36           H        LYS  36  -6.207  -5.458  -0.784
  273    HA   LYS  36           HA       LYS  36  -3.410  -6.074  -1.460
  274    HB2  LYS  36           HB2      LYS  36  -4.761  -3.548  -2.336
  275    HB3  LYS  36           HB3      LYS  36  -3.423  -4.394  -3.069
  276    HG2  LYS  36           HG2      LYS  36  -6.157  -5.605  -3.034
  277    HG3  LYS  36           HG3      LYS  36  -5.701  -4.410  -4.249
  278    HD2  LYS  36           HD2      LYS  36  -4.046  -6.851  -3.703
  279    HD3  LYS  36           HD3      LYS  36  -5.380  -6.853  -4.860
  280    HE2  LYS  36           HE2      LYS  36  -3.303  -4.723  -5.025
  281    HE3  LYS  36           HE3      LYS  36  -2.936  -6.325  -5.635
  282    HZ1  LYS  36           HZ1      LYS  36  -3.827  -4.887  -7.341
  283    HZ2  LYS  36           HZ2      LYS  36  -5.201  -4.676  -6.497
  284    HZ3  LYS  36           HZ3      LYS  36  -4.831  -6.145  -7.083
  285    H    THR  37           H        THR  37  -1.819  -4.935  -0.452
  286    HA   THR  37           HA       THR  37  -2.660  -3.182   1.749
  287    HB   THR  37           HB       THR  37   0.051  -4.439   1.220
  288    HG1  THR  37           HG1      THR  37  -0.894  -6.168   1.972
  289   HG21  THR  37          HG21      THR  37  -1.050  -3.048   3.668
  290   HG22  THR  37          HG22      THR  37   0.217  -2.436   2.605
  291   HG23  THR  37          HG23      THR  37   0.503  -3.878   3.581
  292    H    CYS  38           H        CYS  38  -1.935  -1.055   1.869
  293    HA   CYS  38           HA       CYS  38  -1.030   0.117  -0.600
  294    HB2  CYS  38           HB2      CYS  38  -2.629   1.402   0.615
  295    HB3  CYS  38           HB3      CYS  38  -1.702   1.267   2.107
  296    H    CYS  39           H        CYS  39   0.991   0.673  -1.109
  297    HA   CYS  39           HA       CYS  39   3.021   0.475   1.010
  298    HB2  CYS  39           HB2      CYS  39   3.294  -0.172  -1.931
  299    HB3  CYS  39           HB3      CYS  39   4.604  -0.223  -0.751
  300    H    VAL  40           H        VAL  40   3.666   2.411   1.557
  301    HA   VAL  40           HA       VAL  40   4.280   4.365  -0.535
  302    HB   VAL  40           HB       VAL  40   3.356   6.165   1.029
  303   HG11  VAL  40          HG11      VAL  40   1.336   4.262  -0.153
  304   HG12  VAL  40          HG12      VAL  40   2.294   5.407  -1.096
  305   HG13  VAL  40          HG13      VAL  40   1.143   5.999   0.106
  306   HG21  VAL  40          HG21      VAL  40   1.582   5.475   2.541
  307   HG22  VAL  40          HG22      VAL  40   3.120   4.745   3.006
  308   HG23  VAL  40          HG23      VAL  40   1.905   3.786   2.156
  Start of MODEL    9
    1    H1   LEU   1           H1       LEU   1 -13.849   3.659  -7.816
    2    H2   LEU   1           H2       LEU   1 -12.911   4.949  -8.102
    3    H3   LEU   1           H3       LEU   1 -13.652   4.790  -6.666
    4    HA   LEU   1           HA       LEU   1 -11.559   3.038  -7.703
    5    HB2  LEU   1           HB2      LEU   1 -11.525   5.103  -5.497
    6    HB3  LEU   1           HB3      LEU   1 -10.268   3.906  -5.723
    7    HG   LEU   1           HG       LEU   1 -10.093   4.931  -8.122
    8   HD11  LEU   1          HD11      LEU   1 -11.361   7.193  -6.588
    9   HD12  LEU   1          HD12      LEU   1 -12.036   6.368  -7.992
   10   HD13  LEU   1          HD13      LEU   1 -10.572   7.334  -8.157
   11   HD21  LEU   1          HD21      LEU   1  -9.087   6.373  -5.674
   12   HD22  LEU   1          HD22      LEU   1  -8.430   6.523  -7.304
   13   HD23  LEU   1          HD23      LEU   1  -8.327   4.984  -6.448
   14    HA   PRO   2           HA       PRO   2 -12.795  -0.415  -5.331
   15    HB2  PRO   2           HB2      PRO   2 -10.184   0.039  -3.948
   16    HB3  PRO   2           HB3      PRO   2 -10.886  -1.468  -4.512
   17    HG2  PRO   2           HG2      PRO   2  -8.997  -0.217  -5.907
   18    HG3  PRO   2           HG3      PRO   2 -10.347  -1.039  -6.727
   19    HD2  PRO   2           HD2      PRO   2  -9.805   1.847  -6.444
   20    HD3  PRO   2           HD3      PRO   2 -10.811   1.001  -7.634
   21    H    ARG   3           H        ARG   3 -10.741   1.249  -2.981
   22    HA   ARG   3           HA       ARG   3 -12.914   1.959  -1.262
   23    HB2  ARG   3           HB2      ARG   3 -12.870  -0.463  -0.903
   24    HB3  ARG   3           HB3      ARG   3 -11.166  -0.390  -0.506
   25    HG2  ARG   3           HG2      ARG   3 -11.878   1.193   1.368
   26    HG3  ARG   3           HG3      ARG   3 -13.502   0.552   1.073
   27    HD2  ARG   3           HD2      ARG   3 -12.312  -1.751   1.158
   28    HD3  ARG   3           HD3      ARG   3 -11.048  -0.868   2.012
   29    HE   ARG   3           HE       ARG   3 -13.839  -1.047   2.880
   30   HH11  ARG   3          HH11      ARG   3 -10.439  -0.656   3.598
   31   HH12  ARG   3          HH12      ARG   3 -10.656  -0.851   5.313
   32   HH21  ARG   3          HH21      ARG   3 -14.124  -1.303   5.143
   33   HH22  ARG   3          HH22      ARG   3 -12.744  -1.218   6.190
   34    H    ASP   4           H        ASP   4  -9.685   0.775  -0.399
   35    HA   ASP   4           HA       ASP   4  -9.150   3.305   0.917
   36    HB2  ASP   4           HB2      ASP   4  -7.631   0.697   0.866
   37    HB3  ASP   4           HB3      ASP   4  -7.093   2.125   1.739
   38    H    THR   5           H        THR   5  -8.644   2.025  -2.104
   39    HA   THR   5           HA       THR   5  -6.108   2.638  -2.906
   40    HB   THR   5           HB       THR   5  -8.487   3.429  -4.560
   41    HG1  THR   5           HG1      THR   5  -7.656   0.775  -4.643
   42   HG21  THR   5          HG21      THR   5  -7.127   2.499  -6.383
   43   HG22  THR   5          HG22      THR   5  -5.856   2.093  -5.225
   44   HG23  THR   5          HG23      THR   5  -6.267   3.785  -5.528
   45    H    SER   6           H        SER   6  -8.854   4.893  -2.692
   46    HA   SER   6           HA       SER   6  -7.564   7.114  -3.818
   47    HB2  SER   6           HB2      SER   6  -9.766   7.256  -1.754
   48    HB3  SER   6           HB3      SER   6  -9.454   8.364  -3.092
   49    HG   SER   6           HG       SER   6 -11.173   6.948  -3.573
   50    H    ARG   7           H        ARG   7  -7.978   6.114  -0.447
   51    HA   ARG   7           HA       ARG   7  -6.683   8.248   0.800
   52    HB2  ARG   7           HB2      ARG   7  -7.961   6.621   2.058
   53    HB3  ARG   7           HB3      ARG   7  -6.874   5.330   1.571
   54    HG2  ARG   7           HG2      ARG   7  -5.076   6.330   2.865
   55    HG3  ARG   7           HG3      ARG   7  -6.133   7.670   3.317
   56    HD2  ARG   7           HD2      ARG   7  -6.614   4.764   3.973
   57    HD3  ARG   7           HD3      ARG   7  -5.972   5.968   5.092
   58    HE   ARG   7           HE       ARG   7  -8.275   7.103   4.339
   59   HH11  ARG   7          HH11      ARG   7  -7.563   3.852   5.413
   60   HH12  ARG   7          HH12      ARG   7  -9.129   3.593   6.106
   61   HH21  ARG   7          HH21      ARG   7 -10.338   6.784   5.260
   62   HH22  ARG   7          HH22      ARG   7 -10.716   5.274   6.021
   63    H    CYS   8           H        CYS   8  -5.409   5.209  -0.482
   64    HA   CYS   8           HA       CYS   8  -2.754   5.574   0.398
   65    HB2  CYS   8           HB2      CYS   8  -3.593   3.391  -0.209
   66    HB3  CYS   8           HB3      CYS   8  -3.884   3.920  -1.864
   67    H    VAL   9           H        VAL   9  -4.366   6.370  -2.654
   68    HA   VAL   9           HA       VAL   9  -1.883   7.179  -3.885
   69    HB   VAL   9           HB       VAL   9  -3.757   6.144  -5.175
   70   HG11  VAL   9          HG11      VAL   9  -5.620   7.242  -4.062
   71   HG12  VAL   9          HG12      VAL   9  -5.692   7.447  -5.811
   72   HG13  VAL   9          HG13      VAL   9  -5.151   8.781  -4.787
   73   HG21  VAL   9          HG21      VAL   9  -2.057   7.365  -6.367
   74   HG22  VAL   9          HG22      VAL   9  -2.896   8.885  -6.070
   75   HG23  VAL   9          HG23      VAL   9  -3.625   7.666  -7.116
   76    H    GLY  10           H        GLY  10  -4.125   8.626  -1.827
   77    HA2  GLY  10           HA2      GLY  10  -3.738  11.352  -2.524
   78    HA3  GLY  10           HA3      GLY  10  -4.220  10.749  -0.941
   79    H    TYR  11           H        TYR  11  -1.746   8.977  -1.080
   80    HA   TYR  11           HA       TYR  11   0.175  10.993  -0.187
   81    HB2  TYR  11           HB2      TYR  11   0.072   7.994   0.212
   82    HB3  TYR  11           HB3      TYR  11   1.407   9.003   0.758
   83    HD1  TYR  11           HD1      TYR  11  -2.099   8.096   1.310
   84    HD2  TYR  11           HD2      TYR  11   1.148  10.489   2.653
   85    HE1  TYR  11           HE1      TYR  11  -3.309   8.555   3.397
   86    HE2  TYR  11           HE2      TYR  11  -0.052  10.953   4.748
   87    HH   TYR  11           HH       TYR  11  -2.404  10.987   5.556
   88    H    HIS  12           H        HIS  12   1.698   8.121  -1.014
   89    HA   HIS  12           HA       HIS  12   2.194   8.682  -3.791
   90    HB2  HIS  12           HB2      HIS  12   4.532   8.987  -1.881
   91    HB3  HIS  12           HB3      HIS  12   4.581   9.121  -3.629
   92    HD1  HIS  12           HD1      HIS  12   3.601  11.340  -4.663
   93    HD2  HIS  12           HD2      HIS  12   3.843  11.261  -0.513
   94    HE1  HIS  12           HE1      HIS  12   3.361  13.734  -3.928
   95    HE2  HIS  12           HE2      HIS  12   3.597  13.676  -1.420
   96    H    GLY  13           H        GLY  13   1.965   6.588  -4.393
   97    HA2  GLY  13           HA2      GLY  13   3.910   4.688  -4.096
   98    HA3  GLY  13           HA3      GLY  13   2.844   4.432  -2.723
   99    H    TYR  14           H        TYR  14   1.965   2.490  -3.324
  100    HA   TYR  14           HA       TYR  14   0.018   2.517  -5.409
  101    HB2  TYR  14           HB2      TYR  14   1.005   0.812  -6.859
  102    HB3  TYR  14           HB3      TYR  14   1.981   2.269  -6.828
  103    HD1  TYR  14           HD1      TYR  14   1.989  -1.261  -6.526
  104    HD2  TYR  14           HD2      TYR  14   4.033   2.236  -5.217
  105    HE1  TYR  14           HE1      TYR  14   3.972  -2.614  -6.012
  106    HE2  TYR  14           HE2      TYR  14   6.016   0.883  -4.689
  107    HH   TYR  14           HH       TYR  14   6.254  -2.461  -5.635
  108    H    CYS  15           H        CYS  15  -0.670   0.135  -5.880
  109    HA   CYS  15           HA       CYS  15  -1.213  -0.993  -3.221
  110    HB2  CYS  15           HB2      CYS  15  -2.851  -1.123  -5.764
  111    HB3  CYS  15           HB3      CYS  15  -3.326  -1.781  -4.201
  112    H    ILE  16           H        ILE  16  -0.378  -2.946  -2.800
  113    HA   ILE  16           HA       ILE  16   0.360  -4.641  -5.103
  114    HB   ILE  16           HB       ILE  16   2.147  -5.566  -3.887
  115   HG12  ILE  16          HG12      ILE  16   1.142  -4.150  -1.413
  116   HG13  ILE  16          HG13      ILE  16   0.888  -5.854  -1.756
  117   HG21  ILE  16          HG21      ILE  16   2.068  -2.645  -3.160
  118   HG22  ILE  16          HG22      ILE  16   2.599  -3.313  -4.702
  119   HG23  ILE  16          HG23      ILE  16   3.511  -3.658  -3.231
  120   HD11  ILE  16          HD11      ILE  16   2.697  -5.566  -0.193
  121   HD12  ILE  16          HD12      ILE  16   3.537  -4.503  -1.322
  122   HD13  ILE  16          HD13      ILE  16   3.309  -6.206  -1.719
  123    H    ARG  17           H        ARG  17  -0.195  -6.798  -5.075
  124    HA   ARG  17           HA       ARG  17  -2.167  -7.614  -3.130
  125    HB2  ARG  17           HB2      ARG  17  -2.388  -9.668  -4.454
  126    HB3  ARG  17           HB3      ARG  17  -2.566  -8.242  -5.452
  127    HG2  ARG  17           HG2      ARG  17   0.026  -9.751  -5.279
  128    HG3  ARG  17           HG3      ARG  17  -1.256 -10.211  -6.397
  129    HD2  ARG  17           HD2      ARG  17  -0.104  -8.839  -7.781
  130    HD3  ARG  17           HD3      ARG  17  -1.089  -7.613  -6.990
  131    HE   ARG  17           HE       ARG  17   1.352  -8.045  -5.588
  132   HH11  ARG  17          HH11      ARG  17   0.014  -6.488  -8.420
  133   HH12  ARG  17          HH12      ARG  17   1.270  -5.297  -8.521
  134   HH21  ARG  17          HH21      ARG  17   3.014  -6.483  -5.711
  135   HH22  ARG  17          HH22      ARG  17   2.983  -5.294  -6.975
  136    H    SER  18           H        SER  18  -0.920  -7.540  -1.309
  137    HA   SER  18           HA       SER  18   0.117  -9.939  -0.377
  138    HB2  SER  18           HB2      SER  18   2.054  -9.440  -1.852
  139    HB3  SER  18           HB3      SER  18   2.261  -7.890  -1.040
  140    HG   SER  18           HG       SER  18   3.332 -10.164  -0.361
  141    H    LYS  19           H        LYS  19   1.017  -9.623   1.852
  142    HA   LYS  19           HA       LYS  19   0.095  -7.080   2.998
  143    HB2  LYS  19           HB2      LYS  19   0.535  -9.741   4.368
  144    HB3  LYS  19           HB3      LYS  19  -0.125  -8.290   5.111
  145    HG2  LYS  19           HG2      LYS  19  -1.399  -9.728   2.796
  146    HG3  LYS  19           HG3      LYS  19  -1.828  -9.984   4.485
  147    HD2  LYS  19           HD2      LYS  19  -2.559  -7.710   4.709
  148    HD3  LYS  19           HD3      LYS  19  -1.938  -7.306   3.109
  149    HE2  LYS  19           HE2      LYS  19  -4.350  -7.566   3.040
  150    HE3  LYS  19           HE3      LYS  19  -3.567  -8.829   2.097
  151    HZ1  LYS  19           HZ1      LYS  19  -4.574  -9.171   4.827
  152    HZ2  LYS  19           HZ2      LYS  19  -3.930 -10.337   3.896
  153    HZ3  LYS  19           HZ3      LYS  19  -5.349  -9.663   3.484
  154    H    VAL  20           H        VAL  20   2.766  -8.294   1.812
  155    HA   VAL  20           HA       VAL  20   4.494  -7.071   3.867
  156    HB   VAL  20           HB       VAL  20   5.204  -9.320   1.966
  157   HG11  VAL  20          HG11      VAL  20   7.357  -9.369   3.143
  158   HG12  VAL  20          HG12      VAL  20   6.879  -7.938   4.057
  159   HG13  VAL  20          HG13      VAL  20   7.096  -7.837   2.309
  160   HG21  VAL  20          HG21      VAL  20   3.817 -10.088   3.804
  161   HG22  VAL  20          HG22      VAL  20   4.884  -9.299   4.966
  162   HG23  VAL  20          HG23      VAL  20   5.472 -10.659   4.010
  163    H    CYS  21           H        CYS  21   5.282  -5.185   3.179
  164    HA   CYS  21           HA       CYS  21   5.176  -4.556   0.348
  165    HB2  CYS  21           HB2      CYS  21   5.597  -2.917   2.833
  166    HB3  CYS  21           HB3      CYS  21   5.889  -2.245   1.231
  167    HA   PRO  22           HA       PRO  22   9.574  -5.036  -0.256
  168    HB2  PRO  22           HB2      PRO  22   9.686  -3.789  -2.662
  169    HB3  PRO  22           HB3      PRO  22   9.147  -5.463  -2.465
  170    HG2  PRO  22           HG2      PRO  22   7.555  -2.984  -2.884
  171    HG3  PRO  22           HG3      PRO  22   7.256  -4.629  -3.467
  172    HD2  PRO  22           HD2      PRO  22   5.955  -3.482  -1.339
  173    HD3  PRO  22           HD3      PRO  22   6.149  -5.229  -1.567
  174    H    LYS  23           H        LYS  23  11.389  -3.708  -0.071
  175    HA   LYS  23           HA       LYS  23  10.839  -1.041   0.836
  176    HB2  LYS  23           HB2      LYS  23  13.231  -0.988   1.384
  177    HB3  LYS  23           HB3      LYS  23  12.418  -2.403   2.042
  178    HG2  LYS  23           HG2      LYS  23  13.266  -3.632  -0.029
  179    HG3  LYS  23           HG3      LYS  23  14.344  -2.248  -0.243
  180    HD2  LYS  23           HD2      LYS  23  15.188  -2.583   2.031
  181    HD3  LYS  23           HD3      LYS  23  14.132  -3.984   2.199
  182    HE2  LYS  23           HE2      LYS  23  16.370  -4.722   1.674
  183    HE3  LYS  23           HE3      LYS  23  15.299  -5.061   0.317
  184    HZ1  LYS  23           HZ1      LYS  23  16.165  -3.109  -0.768
  185    HZ2  LYS  23           HZ2      LYS  23  17.374  -4.129  -0.408
  186    HZ3  LYS  23           HZ3      LYS  23  17.152  -2.792   0.490
  187    HA   PRO  24           HA       PRO  24  11.804   0.549   1.253
  188    HB2  PRO  24           HB2      PRO  24  12.022   3.179   0.915
  189    HB3  PRO  24           HB3      PRO  24  13.443   2.136   0.809
  190    HG2  PRO  24           HG2      PRO  24  11.879   3.441  -1.365
  191    HG3  PRO  24           HG3      PRO  24  13.620   3.136  -1.264
  192    HD2  PRO  24           HD2      PRO  24  11.714   1.574  -2.637
  193    HD3  PRO  24           HD3      PRO  24  13.393   1.129  -2.287
  194    H    PHE  25           H        PHE  25   9.694   0.162   1.731
  195    HA   PHE  25           HA       PHE  25   7.808   2.309   1.315
  196    HB2  PHE  25           HB2      PHE  25   7.383  -0.427   0.132
  197    HB3  PHE  25           HB3      PHE  25   6.022   0.571   0.618
  198    HD1  PHE  25           HD1      PHE  25   5.749   2.828  -0.428
  199    HD2  PHE  25           HD2      PHE  25   8.451  -0.084  -1.949
  200    HE1  PHE  25           HE1      PHE  25   5.777   4.005  -2.579
  201    HE2  PHE  25           HE2      PHE  25   8.498   1.091  -4.111
  202    HZ   PHE  25           HZ       PHE  25   7.160   3.137  -4.428
  203    H    ALA  26           H        ALA  26   5.924   2.090   2.665
  204    HA   ALA  26           HA       ALA  26   6.344   0.243   4.924
  205    HB1  ALA  26           HB1      ALA  26   4.968   2.935   4.917
  206    HB2  ALA  26           HB2      ALA  26   6.585   2.605   5.543
  207    HB3  ALA  26           HB3      ALA  26   5.176   1.881   6.318
  208    H    ALA  27           H        ALA  27   4.562  -0.876   5.735
  209    HA   ALA  27           HA       ALA  27   2.462  -1.401   3.858
  210    HB1  ALA  27           HB1      ALA  27   2.769  -2.353   6.705
  211    HB2  ALA  27           HB2      ALA  27   3.403  -3.171   5.277
  212    HB3  ALA  27           HB3      ALA  27   1.661  -3.008   5.500
  213    H    PHE  28           H        PHE  28   1.340   0.486   3.600
  214    HA   PHE  28           HA       PHE  28   0.279   1.917   5.884
  215    HB2  PHE  28           HB2      PHE  28   1.166   3.084   3.867
  216    HB3  PHE  28           HB3      PHE  28  -0.130   2.379   2.915
  217    HD1  PHE  28           HD1      PHE  28   0.890   5.132   4.894
  218    HD2  PHE  28           HD2      PHE  28  -2.542   2.955   3.635
  219    HE1  PHE  28           HE1      PHE  28  -0.528   7.059   5.435
  220    HE2  PHE  28           HE2      PHE  28  -3.967   4.881   4.170
  221    HZ   PHE  28           HZ       PHE  28  -2.963   6.938   5.067
  222    H    GLY  29           H        GLY  29  -1.183   0.466   6.814
  223    HA2  GLY  29           HA2      GLY  29  -3.240  -0.464   7.167
  224    HA3  GLY  29           HA3      GLY  29  -3.822   0.862   6.178
  225    H    THR  30           H        THR  30  -4.752   0.408   4.323
  226    HA   THR  30           HA       THR  30  -4.173  -2.099   2.945
  227    HB   THR  30           HB       THR  30  -6.657  -2.427   2.577
  228    HG1  THR  30           HG1      THR  30  -7.858  -0.860   3.359
  229   HG21  THR  30          HG21      THR  30  -5.366  -3.875   4.043
  230   HG22  THR  30          HG22      THR  30  -6.970  -3.592   4.726
  231   HG23  THR  30          HG23      THR  30  -5.567  -2.735   5.375
  232    H    CYS  31           H        CYS  31  -4.896  -2.106   0.793
  233    HA   CYS  31           HA       CYS  31  -5.443   0.536  -0.374
  234    HB2  CYS  31           HB2      CYS  31  -3.552  -1.509  -1.079
  235    HB3  CYS  31           HB3      CYS  31  -4.705  -1.290  -2.393
  236    H    SER  32           H        SER  32  -6.347  -0.499  -2.882
  237    HA   SER  32           HA       SER  32  -8.938  -0.911  -2.831
  238    HB2  SER  32           HB2      SER  32  -7.243  -2.827  -4.385
  239    HB3  SER  32           HB3      SER  32  -8.732  -2.030  -4.881
  240    HG   SER  32           HG       SER  32  -6.413  -1.228  -5.525
  241    H    TRP  33           H        TRP  33 -10.051  -1.936  -1.288
  242    HA   TRP  33           HA       TRP  33 -10.927  -3.517   0.056
  243    HB2  TRP  33           HB2      TRP  33  -9.788  -5.480  -1.945
  244    HB3  TRP  33           HB3      TRP  33 -11.127  -5.762  -0.835
  245    HD1  TRP  33           HD1      TRP  33 -10.624  -5.081  -4.324
  246    HE1  TRP  33           HE1      TRP  33 -12.666  -3.949  -5.414
  247    HE3  TRP  33           HE3      TRP  33 -13.093  -3.611  -0.093
  248    HZ2  TRP  33           HZ2      TRP  33 -15.004  -2.605  -4.582
  249    HZ3  TRP  33           HZ3      TRP  33 -15.220  -2.404  -0.333
  250    HH2  TRP  33           HH2      TRP  33 -16.150  -1.914  -2.538
  251    H    ARG  34           H        ARG  34 -10.400  -5.507   1.436
  252    HA   ARG  34           HA       ARG  34  -7.895  -4.973   2.734
  253    HB2  ARG  34           HB2      ARG  34  -8.603  -6.622   4.391
  254    HB3  ARG  34           HB3      ARG  34  -9.893  -5.480   4.050
  255    HG2  ARG  34           HG2      ARG  34 -11.006  -7.119   2.648
  256    HG3  ARG  34           HG3      ARG  34  -9.688  -8.261   2.915
  257    HD2  ARG  34           HD2      ARG  34 -11.518  -7.135   5.033
  258    HD3  ARG  34           HD3      ARG  34 -11.604  -8.757   4.349
  259    HE   ARG  34           HE       ARG  34  -9.034  -8.227   5.445
  260   HH11  ARG  34          HH11      ARG  34 -12.307  -9.089   6.323
  261   HH12  ARG  34          HH12      ARG  34 -11.840  -9.876   7.798
  262   HH21  ARG  34          HH21      ARG  34  -8.414  -9.251   7.396
  263   HH22  ARG  34          HH22      ARG  34  -9.629  -9.966   8.407
  264    H    GLN  35           H        GLN  35  -7.832  -6.091   0.034
  265    HA   GLN  35           HA       GLN  35  -6.553  -8.699   0.463
  266    HB2  GLN  35           HB2      GLN  35  -7.367  -7.400  -2.139
  267    HB3  GLN  35           HB3      GLN  35  -6.903  -9.078  -1.888
  268    HG2  GLN  35           HG2      GLN  35  -9.315  -7.810  -0.626
  269    HG3  GLN  35           HG3      GLN  35  -9.349  -8.667  -2.158
  270   HE21  GLN  35          HE21      GLN  35 -10.711  -9.267   0.340
  271   HE22  GLN  35          HE22      GLN  35 -10.213 -10.863   0.788
  272    H    LYS  36           H        LYS  36  -6.139  -5.496  -0.935
  273    HA   LYS  36           HA       LYS  36  -3.308  -6.087  -1.456
  274    HB2  LYS  36           HB2      LYS  36  -4.689  -3.581  -2.365
  275    HB3  LYS  36           HB3      LYS  36  -3.299  -4.379  -3.050
  276    HG2  LYS  36           HG2      LYS  36  -5.925  -5.770  -3.105
  277    HG3  LYS  36           HG3      LYS  36  -5.611  -4.457  -4.242
  278    HD2  LYS  36           HD2      LYS  36  -3.704  -6.740  -3.873
  279    HD3  LYS  36           HD3      LYS  36  -5.050  -6.817  -5.009
  280    HE2  LYS  36           HE2      LYS  36  -3.127  -4.522  -5.042
  281    HE3  LYS  36           HE3      LYS  36  -2.755  -6.027  -5.865
  282    HZ1  LYS  36           HZ1      LYS  36  -3.806  -4.485  -7.347
  283    HZ2  LYS  36           HZ2      LYS  36  -5.094  -4.338  -6.369
  284    HZ3  LYS  36           HZ3      LYS  36  -4.802  -5.751  -7.111
  285    H    THR  37           H        THR  37  -1.736  -4.980  -0.375
  286    HA   THR  37           HA       THR  37  -2.615  -3.149   1.736
  287    HB   THR  37           HB       THR  37   0.118  -4.385   1.280
  288    HG1  THR  37           HG1      THR  37  -1.056  -6.062   1.952
  289   HG21  THR  37          HG21      THR  37  -1.004  -2.901   3.662
  290   HG22  THR  37          HG22      THR  37   0.231  -2.301   2.553
  291   HG23  THR  37          HG23      THR  37   0.576  -3.687   3.589
  292    H    CYS  38           H        CYS  38  -1.855  -1.028   1.840
  293    HA   CYS  38           HA       CYS  38  -0.968   0.094  -0.664
  294    HB2  CYS  38           HB2      CYS  38  -2.580   1.382   0.539
  295    HB3  CYS  38           HB3      CYS  38  -1.626   1.315   2.017
  296    H    CYS  39           H        CYS  39   1.051   0.614  -1.187
  297    HA   CYS  39           HA       CYS  39   3.070   0.513   0.947
  298    HB2  CYS  39           HB2      CYS  39   3.344  -0.177  -1.983
  299    HB3  CYS  39           HB3      CYS  39   4.684  -0.119  -0.840
  300    H    VAL  40           H        VAL  40   3.623   2.474   1.497
  301    HA   VAL  40           HA       VAL  40   4.261   4.420  -0.598
  302    HB   VAL  40           HB       VAL  40   3.323   6.217   0.962
  303   HG11  VAL  40          HG11      VAL  40   1.330   4.310  -0.257
  304   HG12  VAL  40          HG12      VAL  40   2.271   5.501  -1.162
  305   HG13  VAL  40          HG13      VAL  40   1.099   6.035   0.049
  306   HG21  VAL  40          HG21      VAL  40   3.074   4.745   2.923
  307   HG22  VAL  40          HG22      VAL  40   1.821   3.853   2.056
  308   HG23  VAL  40          HG23      VAL  40   1.566   5.548   2.478
  Start of MODEL   10
    1    H1   LEU   1           H1       LEU   1 -13.282   4.874  -6.397
    2    H2   LEU   1           H2       LEU   1 -13.799   3.764  -7.465
    3    H3   LEU   1           H3       LEU   1 -12.631   4.809  -7.890
    4    HA   LEU   1           HA       LEU   1 -11.713   2.652  -7.461
    5    HB2  LEU   1           HB2      LEU   1 -11.024   4.884  -5.560
    6    HB3  LEU   1           HB3      LEU   1 -10.119   3.386  -5.600
    7    HG   LEU   1           HG       LEU   1 -10.433   5.265  -7.945
    8   HD11  LEU   1          HD11      LEU   1  -9.108   6.249  -6.131
    9   HD12  LEU   1          HD12      LEU   1  -8.116   5.872  -7.539
   10   HD13  LEU   1          HD13      LEU   1  -8.072   4.822  -6.122
   11   HD21  LEU   1          HD21      LEU   1  -8.644   3.908  -8.938
   12   HD22  LEU   1          HD22      LEU   1 -10.092   2.952  -8.626
   13   HD23  LEU   1          HD23      LEU   1  -8.702   2.825  -7.549
   14    HA   PRO   2           HA       PRO   2 -13.127  -0.438  -4.690
   15    HB2  PRO   2           HB2      PRO   2 -10.457   0.103  -3.445
   16    HB3  PRO   2           HB3      PRO   2 -11.261  -1.444  -3.707
   17    HG2  PRO   2           HG2      PRO   2  -9.397  -0.488  -5.403
   18    HG3  PRO   2           HG3      PRO   2 -10.765  -1.470  -5.957
   19    HD2  PRO   2           HD2      PRO   2 -10.205   1.341  -6.457
   20    HD3  PRO   2           HD3      PRO   2 -11.451   0.309  -7.184
   21    H    ARG   3           H        ARG   3 -11.002   1.259  -2.414
   22    HA   ARG   3           HA       ARG   3 -13.135   2.478  -0.993
   23    HB2  ARG   3           HB2      ARG   3 -12.907   1.070   1.089
   24    HB3  ARG   3           HB3      ARG   3 -13.730   0.327  -0.260
   25    HG2  ARG   3           HG2      ARG   3 -12.364  -1.394  -0.200
   26    HG3  ARG   3           HG3      ARG   3 -10.968  -0.344  -0.407
   27    HD2  ARG   3           HD2      ARG   3 -10.798  -1.680   1.635
   28    HD3  ARG   3           HD3      ARG   3 -10.880   0.045   1.991
   29    HE   ARG   3           HE       ARG   3 -13.372  -1.479   2.098
   30   HH11  ARG   3          HH11      ARG   3 -10.748   0.098   3.799
   31   HH12  ARG   3          HH12      ARG   3 -11.604   0.157   5.313
   32   HH21  ARG   3          HH21      ARG   3 -14.495  -1.409   4.089
   33   HH22  ARG   3          HH22      ARG   3 -13.737  -0.702   5.478
   34    H    ASP   4           H        ASP   4  -9.859   1.131  -0.428
   35    HA   ASP   4           HA       ASP   4  -9.233   3.595   1.038
   36    HB2  ASP   4           HB2      ASP   4  -7.960   0.861   1.137
   37    HB3  ASP   4           HB3      ASP   4  -7.257   2.277   1.906
   38    H    THR   5           H        THR   5  -8.774   2.167  -1.929
   39    HA   THR   5           HA       THR   5  -6.163   2.620  -2.653
   40    HB   THR   5           HB       THR   5  -8.480   3.269  -4.457
   41    HG1  THR   5           HG1      THR   5  -7.666   0.674  -4.547
   42   HG21  THR   5          HG21      THR   5  -6.217   3.644  -5.340
   43   HG22  THR   5          HG22      THR   5  -7.032   2.324  -6.179
   44   HG23  THR   5          HG23      THR   5  -5.801   1.970  -4.968
   45    H    SER   6           H        SER   6  -8.849   4.971  -2.759
   46    HA   SER   6           HA       SER   6  -7.400   7.047  -3.979
   47    HB2  SER   6           HB2      SER   6  -9.762   7.329  -2.106
   48    HB3  SER   6           HB3      SER   6  -9.242   8.483  -3.334
   49    HG   SER   6           HG       SER   6 -10.042   7.245  -4.881
   50    H    ARG   7           H        ARG   7  -7.758   6.089  -0.635
   51    HA   ARG   7           HA       ARG   7  -6.519   8.340   0.544
   52    HB2  ARG   7           HB2      ARG   7  -7.817   6.769   1.870
   53    HB3  ARG   7           HB3      ARG   7  -6.712   5.464   1.463
   54    HG2  ARG   7           HG2      ARG   7  -4.912   6.696   2.654
   55    HG3  ARG   7           HG3      ARG   7  -6.123   7.877   3.161
   56    HD2  ARG   7           HD2      ARG   7  -6.210   4.920   3.752
   57    HD3  ARG   7           HD3      ARG   7  -5.688   6.170   4.885
   58    HE   ARG   7           HE       ARG   7  -8.188   6.944   4.112
   59   HH11  ARG   7          HH11      ARG   7  -6.812   4.086   5.576
   60   HH12  ARG   7          HH12      ARG   7  -8.280   3.628   6.374
   61   HH21  ARG   7          HH21      ARG   7 -10.126   6.355   5.178
   62   HH22  ARG   7          HH22      ARG   7 -10.167   4.913   6.139
   63    H    CYS   8           H        CYS   8  -5.299   5.204  -0.546
   64    HA   CYS   8           HA       CYS   8  -2.635   5.546   0.266
   65    HB2  CYS   8           HB2      CYS   8  -3.547   3.371  -0.291
   66    HB3  CYS   8           HB3      CYS   8  -3.811   3.874  -1.959
   67    H    VAL   9           H        VAL   9  -4.257   6.291  -2.795
   68    HA   VAL   9           HA       VAL   9  -1.779   7.143  -4.019
   69    HB   VAL   9           HB       VAL   9  -3.600   6.066  -5.338
   70   HG11  VAL   9          HG11      VAL   9  -5.528   6.999  -4.262
   71   HG12  VAL   9          HG12      VAL   9  -5.569   7.377  -5.983
   72   HG13  VAL   9          HG13      VAL   9  -5.101   8.617  -4.818
   73   HG21  VAL   9          HG21      VAL   9  -1.953   7.390  -6.506
   74   HG22  VAL   9          HG22      VAL   9  -2.875   8.860  -6.195
   75   HG23  VAL   9          HG23      VAL   9  -3.533   7.614  -7.258
   76    H    GLY  10           H        GLY  10  -4.070   8.540  -1.969
   77    HA2  GLY  10           HA2      GLY  10  -3.737  11.271  -2.636
   78    HA3  GLY  10           HA3      GLY  10  -4.136  10.646  -1.038
   79    H    TYR  11           H        TYR  11  -1.772   8.920  -1.025
   80    HA   TYR  11           HA       TYR  11   0.235  10.892  -0.290
   81    HB2  TYR  11           HB2      TYR  11   0.104   7.889   0.087
   82    HB3  TYR  11           HB3      TYR  11   1.454   8.884   0.619
   83    HD1  TYR  11           HD1      TYR  11  -2.060   8.028   1.203
   84    HD2  TYR  11           HD2      TYR  11   1.253  10.328   2.545
   85    HE1  TYR  11           HE1      TYR  11  -3.237   8.479   3.310
   86    HE2  TYR  11           HE2      TYR  11   0.088  10.785   4.661
   87    HH   TYR  11           HH       TYR  11  -2.635   9.086   5.664
   88    H    HIS  12           H        HIS  12   1.787   8.077  -1.126
   89    HA   HIS  12           HA       HIS  12   2.234   8.612  -3.916
   90    HB2  HIS  12           HB2      HIS  12   4.548   9.077  -2.006
   91    HB3  HIS  12           HB3      HIS  12   4.616   9.144  -3.757
   92    HD1  HIS  12           HD1      HIS  12   3.875  11.324  -4.886
   93    HD2  HIS  12           HD2      HIS  12   3.430  11.330  -0.750
   94    HE1  HIS  12           HE1      HIS  12   3.420  13.716  -4.260
   95    HE2  HIS  12           HE2      HIS  12   3.005  13.672  -1.773
   96    H    GLY  13           H        GLY  13   2.104   6.484  -4.489
   97    HA2  GLY  13           HA2      GLY  13   4.203   4.727  -4.078
   98    HA3  GLY  13           HA3      GLY  13   3.041   4.385  -2.808
   99    H    TYR  14           H        TYR  14   2.106   2.525  -3.362
  100    HA   TYR  14           HA       TYR  14   0.344   2.463  -5.579
  101    HB2  TYR  14           HB2      TYR  14   1.372   0.634  -6.856
  102    HB3  TYR  14           HB3      TYR  14   2.346   2.090  -6.891
  103    HD1  TYR  14           HD1      TYR  14   4.417   2.186  -5.417
  104    HD2  TYR  14           HD2      TYR  14   2.258  -1.412  -6.123
  105    HE1  TYR  14           HE1      TYR  14   6.381   0.878  -4.730
  106    HE2  TYR  14           HE2      TYR  14   4.213  -2.733  -5.434
  107    HH   TYR  14           HH       TYR  14   6.964  -1.292  -3.929
  108    H    CYS  15           H        CYS  15  -0.482   0.158  -5.926
  109    HA   CYS  15           HA       CYS  15  -0.998  -0.934  -3.243
  110    HB2  CYS  15           HB2      CYS  15  -2.689  -0.962  -5.750
  111    HB3  CYS  15           HB3      CYS  15  -3.130  -1.751  -4.240
  112    H    ILE  16           H        ILE  16  -0.551  -3.025  -2.809
  113    HA   ILE  16           HA       ILE  16   0.122  -4.764  -5.098
  114    HB   ILE  16           HB       ILE  16   1.816  -5.857  -3.834
  115   HG12  ILE  16          HG12      ILE  16   1.013  -4.104  -1.512
  116   HG13  ILE  16          HG13      ILE  16   0.684  -5.822  -1.656
  117   HG21  ILE  16          HG21      ILE  16   3.424  -4.072  -3.441
  118   HG22  ILE  16          HG22      ILE  16   2.116  -2.888  -3.450
  119   HG23  ILE  16          HG23      ILE  16   2.501  -3.788  -4.916
  120   HD11  ILE  16          HD11      ILE  16   2.535  -5.489  -0.181
  121   HD12  ILE  16          HD12      ILE  16   3.383  -4.529  -1.394
  122   HD13  ILE  16          HD13      ILE  16   3.108  -6.250  -1.663
  123    H    ARG  17           H        ARG  17  -0.643  -6.830  -5.044
  124    HA   ARG  17           HA       ARG  17  -2.421  -7.580  -2.882
  125    HB2  ARG  17           HB2      ARG  17  -2.355  -9.816  -4.383
  126    HB3  ARG  17           HB3      ARG  17  -3.441  -8.475  -4.685
  127    HG2  ARG  17           HG2      ARG  17  -2.509  -9.182  -6.757
  128    HG3  ARG  17           HG3      ARG  17  -1.834  -7.610  -6.362
  129    HD2  ARG  17           HD2      ARG  17  -0.291  -9.976  -5.485
  130    HD3  ARG  17           HD3      ARG  17  -0.369  -9.689  -7.218
  131    HE   ARG  17           HE       ARG  17   0.823  -7.882  -5.218
  132   HH11  ARG  17          HH11      ARG  17   0.302  -8.797  -8.560
  133   HH12  ARG  17          HH12      ARG  17   1.590  -7.804  -9.161
  134   HH21  ARG  17          HH21      ARG  17   2.538  -6.598  -6.011
  135   HH22  ARG  17          HH22      ARG  17   2.855  -6.550  -7.715
  136    H    SER  18           H        SER  18  -1.021  -7.700  -1.185
  137    HA   SER  18           HA       SER  18   0.181 -10.154  -0.589
  138    HB2  SER  18           HB2      SER  18   1.913  -9.418  -2.202
  139    HB3  SER  18           HB3      SER  18   2.128  -7.928  -1.289
  140    HG   SER  18           HG       SER  18   3.198 -10.375  -0.865
  141    H    LYS  19           H        LYS  19   1.605  -9.816   1.481
  142    HA   LYS  19           HA       LYS  19   0.335  -7.684   3.067
  143    HB2  LYS  19           HB2      LYS  19   1.374 -10.388   3.935
  144    HB3  LYS  19           HB3      LYS  19   0.777  -9.153   5.033
  145    HG2  LYS  19           HG2      LYS  19  -1.041  -9.942   2.848
  146    HG3  LYS  19           HG3      LYS  19  -0.730 -11.157   4.087
  147    HD2  LYS  19           HD2      LYS  19  -2.701  -9.843   4.648
  148    HD3  LYS  19           HD3      LYS  19  -1.413  -9.556   5.818
  149    HE2  LYS  19           HE2      LYS  19  -0.840  -7.475   4.636
  150    HE3  LYS  19           HE3      LYS  19  -2.168  -7.760   3.512
  151    HZ1  LYS  19           HZ1      LYS  19  -2.747  -6.248   5.305
  152    HZ2  LYS  19           HZ2      LYS  19  -2.484  -7.410   6.408
  153    HZ3  LYS  19           HZ3      LYS  19  -3.687  -7.576   5.326
  154    H    VAL  20           H        VAL  20   3.174  -8.542   1.629
  155    HA   VAL  20           HA       VAL  20   4.779  -7.108   3.645
  156    HB   VAL  20           HB       VAL  20   5.765  -9.214   1.712
  157   HG11  VAL  20          HG11      VAL  20   7.193  -7.772   3.945
  158   HG12  VAL  20          HG12      VAL  20   7.448  -7.522   2.218
  159   HG13  VAL  20          HG13      VAL  20   7.866  -9.068   2.957
  160   HG21  VAL  20          HG21      VAL  20   5.325  -9.369   4.692
  161   HG22  VAL  20          HG22      VAL  20   6.091 -10.611   3.705
  162   HG23  VAL  20          HG23      VAL  20   4.393 -10.210   3.453
  163    H    CYS  21           H        CYS  21   5.457  -5.193   2.989
  164    HA   CYS  21           HA       CYS  21   5.377  -4.537   0.153
  165    HB2  CYS  21           HB2      CYS  21   5.575  -2.872   2.658
  166    HB3  CYS  21           HB3      CYS  21   5.809  -2.183   1.055
  167    HA   PRO  22           HA       PRO  22   9.823  -4.788  -0.237
  168    HB2  PRO  22           HB2      PRO  22   9.987  -3.344  -2.551
  169    HB3  PRO  22           HB3      PRO  22   9.566  -5.059  -2.490
  170    HG2  PRO  22           HG2      PRO  22   7.791  -2.678  -2.775
  171    HG3  PRO  22           HG3      PRO  22   7.682  -4.265  -3.553
  172    HD2  PRO  22           HD2      PRO  22   6.121  -3.554  -1.460
  173    HD3  PRO  22           HD3      PRO  22   6.641  -5.227  -1.747
  174    H    LYS  23           H        LYS  23  11.618  -3.326  -0.187
  175    HA   LYS  23           HA       LYS  23  10.840  -0.791   1.032
  176    HB2  LYS  23           HB2      LYS  23  13.292  -2.506   1.279
  177    HB3  LYS  23           HB3      LYS  23  13.328  -0.812   1.760
  178    HG2  LYS  23           HG2      LYS  23  12.919  -2.214   3.679
  179    HG3  LYS  23           HG3      LYS  23  11.497  -1.233   3.338
  180    HD2  LYS  23           HD2      LYS  23  10.519  -3.199   2.150
  181    HD3  LYS  23           HD3      LYS  23  11.894  -4.154   2.708
  182    HE2  LYS  23           HE2      LYS  23  11.281  -3.775   5.007
  183    HE3  LYS  23           HE3      LYS  23   9.996  -2.671   4.520
  184    HZ1  LYS  23           HZ1      LYS  23   8.918  -4.534   3.442
  185    HZ2  LYS  23           HZ2      LYS  23   9.122  -4.825   5.029
  186    HZ3  LYS  23           HZ3      LYS  23  10.093  -5.544   3.945
  187    HA   PRO  24           HA       PRO  24  11.793   0.767   1.745
  188    HB2  PRO  24           HB2      PRO  24  11.996   3.411   1.608
  189    HB3  PRO  24           HB3      PRO  24  13.440   2.392   1.620
  190    HG2  PRO  24           HG2      PRO  24  12.118   3.782  -0.667
  191    HG3  PRO  24           HG3      PRO  24  13.844   3.564  -0.335
  192    HD2  PRO  24           HD2      PRO  24  12.289   2.005  -2.067
  193    HD3  PRO  24           HD3      PRO  24  13.887   1.576  -1.431
  194    H    PHE  25           H        PHE  25   9.696   0.325   1.951
  195    HA   PHE  25           HA       PHE  25   7.796   2.442   1.493
  196    HB2  PHE  25           HB2      PHE  25   7.520  -0.263   0.187
  197    HB3  PHE  25           HB3      PHE  25   6.116   0.707   0.588
  198    HD1  PHE  25           HD1      PHE  25   8.862   0.241  -1.738
  199    HD2  PHE  25           HD2      PHE  25   5.760   2.869  -0.501
  200    HE1  PHE  25           HE1      PHE  25   9.032   1.446  -3.877
  201    HE2  PHE  25           HE2      PHE  25   5.914   4.083  -2.628
  202    HZ   PHE  25           HZ       PHE  25   7.560   3.371  -4.326
  203    H    ALA  26           H        ALA  26   5.922   2.170   2.791
  204    HA   ALA  26           HA       ALA  26   6.279   0.166   4.924
  205    HB1  ALA  26           HB1      ALA  26   4.899   2.846   5.079
  206    HB2  ALA  26           HB2      ALA  26   6.510   2.479   5.697
  207    HB3  ALA  26           HB3      ALA  26   5.095   1.699   6.404
  208    H    ALA  27           H        ALA  27   4.503  -1.007   5.620
  209    HA   ALA  27           HA       ALA  27   2.462  -1.439   3.664
  210    HB1  ALA  27           HB1      ALA  27   1.617  -3.131   5.208
  211    HB2  ALA  27           HB2      ALA  27   2.704  -2.539   6.464
  212    HB3  ALA  27           HB3      ALA  27   3.362  -3.282   5.008
  213    H    PHE  28           H        PHE  28   1.351   0.451   3.467
  214    HA   PHE  28           HA       PHE  28   0.300   1.845   5.758
  215    HB2  PHE  28           HB2      PHE  28   1.164   3.017   3.741
  216    HB3  PHE  28           HB3      PHE  28  -0.143   2.325   2.797
  217    HD1  PHE  28           HD1      PHE  28  -2.540   2.929   3.502
  218    HD2  PHE  28           HD2      PHE  28   0.908   5.054   4.809
  219    HE1  PHE  28           HE1      PHE  28  -3.946   4.866   4.048
  220    HE2  PHE  28           HE2      PHE  28  -0.498   6.987   5.373
  221    HZ   PHE  28           HZ       PHE  28  -2.929   6.896   4.987
  222    H    GLY  29           H        GLY  29  -1.098   0.338   6.691
  223    HA2  GLY  29           HA2      GLY  29  -3.115  -0.657   7.095
  224    HA3  GLY  29           HA3      GLY  29  -3.761   0.717   6.214
  225    H    THR  30           H        THR  30  -4.769   0.363   4.377
  226    HA   THR  30           HA       THR  30  -4.325  -2.132   2.928
  227    HB   THR  30           HB       THR  30  -6.872  -2.293   2.682
  228    HG1  THR  30           HG1      THR  30  -7.810  -0.621   3.666
  229   HG21  THR  30          HG21      THR  30  -7.036  -3.609   4.766
  230   HG22  THR  30          HG22      THR  30  -5.525  -2.879   5.323
  231   HG23  THR  30          HG23      THR  30  -5.532  -3.915   3.893
  232    H    CYS  31           H        CYS  31  -5.088  -2.143   0.851
  233    HA   CYS  31           HA       CYS  31  -5.600   0.469  -0.395
  234    HB2  CYS  31           HB2      CYS  31  -3.868  -1.769  -1.118
  235    HB3  CYS  31           HB3      CYS  31  -4.933  -1.282  -2.428
  236    H    SER  32           H        SER  32  -6.499  -0.662  -2.847
  237    HA   SER  32           HA       SER  32  -9.099  -1.039  -2.836
  238    HB2  SER  32           HB2      SER  32  -7.369  -3.050  -4.240
  239    HB3  SER  32           HB3      SER  32  -8.876  -2.333  -4.800
  240    HG   SER  32           HG       SER  32  -7.322  -1.224  -5.862
  241    H    TRP  33           H        TRP  33 -10.262  -1.953  -1.287
  242    HA   TRP  33           HA       TRP  33 -11.161  -3.410   0.180
  243    HB2  TRP  33           HB2      TRP  33 -10.101  -5.514  -1.712
  244    HB3  TRP  33           HB3      TRP  33 -11.440  -5.690  -0.579
  245    HD1  TRP  33           HD1      TRP  33 -10.947  -5.213  -4.101
  246    HE1  TRP  33           HE1      TRP  33 -12.964  -4.070  -5.229
  247    HE3  TRP  33           HE3      TRP  33 -13.289  -3.406   0.067
  248    HZ2  TRP  33           HZ2      TRP  33 -15.237  -2.582  -4.442
  249    HZ3  TRP  33           HZ3      TRP  33 -15.360  -2.113  -0.206
  250    HH2  TRP  33           HH2      TRP  33 -16.315  -1.718  -2.422
  251    H    ARG  34           H        ARG  34 -10.645  -5.515   1.537
  252    HA   ARG  34           HA       ARG  34  -8.131  -4.994   2.841
  253    HB2  ARG  34           HB2      ARG  34  -8.824  -6.675   4.453
  254    HB3  ARG  34           HB3      ARG  34 -10.153  -5.574   4.124
  255    HG2  ARG  34           HG2      ARG  34 -11.031  -7.296   2.508
  256    HG3  ARG  34           HG3      ARG  34  -9.817  -8.400   3.161
  257    HD2  ARG  34           HD2      ARG  34 -11.926  -8.750   4.289
  258    HD3  ARG  34           HD3      ARG  34 -10.756  -8.060   5.412
  259    HE   ARG  34           HE       ARG  34 -12.288  -6.017   4.180
  260   HH11  ARG  34          HH11      ARG  34 -12.476  -8.494   6.641
  261   HH12  ARG  34          HH12      ARG  34 -13.707  -7.683   7.550
  262   HH21  ARG  34          HH21      ARG  34 -13.906  -4.938   5.372
  263   HH22  ARG  34          HH22      ARG  34 -14.535  -5.661   6.821
  264    H    GLN  35           H        GLN  35  -8.133  -5.999   0.096
  265    HA   GLN  35           HA       GLN  35  -6.904  -8.645   0.359
  266    HB2  GLN  35           HB2      GLN  35  -7.766  -7.149  -2.122
  267    HB3  GLN  35           HB3      GLN  35  -7.269  -8.834  -2.031
  268    HG2  GLN  35           HG2      GLN  35  -9.649  -7.736  -0.575
  269    HG3  GLN  35           HG3      GLN  35  -9.731  -8.431  -2.186
  270   HE21  GLN  35          HE21      GLN  35  -9.211  -9.060   1.184
  271   HE22  GLN  35          HE22      GLN  35  -9.355 -10.780   1.102
  272    H    LYS  36           H        LYS  36  -6.394  -5.376  -0.852
  273    HA   LYS  36           HA       LYS  36  -3.613  -6.084  -1.472
  274    HB2  LYS  36           HB2      LYS  36  -5.016  -3.568  -2.361
  275    HB3  LYS  36           HB3      LYS  36  -3.543  -4.271  -3.002
  276    HG2  LYS  36           HG2      LYS  36  -4.974  -6.233  -3.740
  277    HG3  LYS  36           HG3      LYS  36  -6.370  -5.214  -3.375
  278    HD2  LYS  36           HD2      LYS  36  -5.874  -5.029  -5.716
  279    HD3  LYS  36           HD3      LYS  36  -5.455  -3.507  -4.930
  280    HE2  LYS  36           HE2      LYS  36  -3.127  -4.039  -4.976
  281    HE3  LYS  36           HE3      LYS  36  -3.452  -5.687  -5.521
  282    HZ1  LYS  36           HZ1      LYS  36  -3.975  -3.239  -7.060
  283    HZ2  LYS  36           HZ2      LYS  36  -4.306  -4.746  -7.565
  284    HZ3  LYS  36           HZ3      LYS  36  -2.764  -4.291  -7.331
  285    H    THR  37           H        THR  37  -1.952  -4.952  -0.582
  286    HA   THR  37           HA       THR  37  -2.627  -3.203   1.677
  287    HB   THR  37           HB       THR  37   0.016  -4.526   0.982
  288    HG1  THR  37           HG1      THR  37  -0.944  -6.234   1.771
  289   HG21  THR  37          HG21      THR  37  -0.896  -3.141   3.509
  290   HG22  THR  37          HG22      THR  37   0.295  -2.526   2.362
  291   HG23  THR  37          HG23      THR  37   0.639  -3.984   3.295
  292    H    CYS  38           H        CYS  38  -1.752  -1.107   1.801
  293    HA   CYS  38           HA       CYS  38  -0.908   0.020  -0.733
  294    HB2  CYS  38           HB2      CYS  38  -2.516   1.317   0.475
  295    HB3  CYS  38           HB3      CYS  38  -1.553   1.246   1.949
  296    H    CYS  39           H        CYS  39   1.115   0.651  -1.227
  297    HA   CYS  39           HA       CYS  39   3.126   0.477   0.917
  298    HB2  CYS  39           HB2      CYS  39   3.497  -0.134  -2.023
  299    HB3  CYS  39           HB3      CYS  39   4.755  -0.206  -0.788
  300    H    VAL  40           H        VAL  40   3.669   2.441   1.479
  301    HA   VAL  40           HA       VAL  40   4.376   4.381  -0.594
  302    HB   VAL  40           HB       VAL  40   3.367   6.194   0.873
  303   HG11  VAL  40          HG11      VAL  40   2.362   5.426  -1.248
  304   HG12  VAL  40          HG12      VAL  40   1.155   5.958  -0.074
  305   HG13  VAL  40          HG13      VAL  40   1.425   4.235  -0.343
  306   HG21  VAL  40          HG21      VAL  40   3.087   4.819   2.880
  307   HG22  VAL  40          HG22      VAL  40   1.883   3.851   2.026
  308   HG23  VAL  40          HG23      VAL  40   1.570   5.555   2.364