*HEADER    TRANSCRIPTION                           24-OCT-12   2M0E              
*TITLE     SOLUTION STRUCTURE OF MIZ-1 ZINC FINGERS 5 TO 7                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER AND BTB DOMAIN-CONTAINING PROTEIN 17;          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: C2H2-TYPE 6 ZINC FINGER RESIDUES 444-472;                  
*COMPND   5 SYNONYM: MYC-INTERACTING ZINC FINGER PROTEIN 1, MIZ-1, ZINC FINGER   
*COMPND   6 PROTEIN 151, ZINC FINGER PROTEIN 60;                                 
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: MIZ1, ZBTB17, ZNF151, ZNF60;                                   
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21 STAR (DE3);                           
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET-3A                                     
*KEYWDS    C2H2 ZINC FINGERS, TRANSCRIPTION                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    D.BERNARD, M.BEDARD, J.BILODEAU, P.LAVIGNE                            
*REVDAT   1   14-NOV-12 2M0E    0                                                


assign ( resid 51 and name HB1
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 5.1 3.3 0.9 volume=0.173 peak=8 ppm1=1.798 ppm2=0.810

assign ( resid 47 and name HB1
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 5.3 3.5 0.7 volume=0.145 peak=10 ppm1=1.073 ppm2=0.840

assign ( resid 51 and name HD1#
  or resid 51 and name HD2#
  )
       ( resid 51 and name HB2
  ) 4.4 2.6 0.9 volume=0.426 peak=11 ppm1=0.889 ppm2=1.487

assign ( resid 51 and name HA
  )
       ( resid 51 and name HD1#
  or resid 51 and name HD2#
  ) 6.0 4.2 0.0 volume=0.063 peak=15 ppm1=3.679 ppm2=0.876

assign ( resid 51 and name HD1#
  or resid 51 and name HD2#
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 3.8 2.0 0.8 volume=3.179 peak=2 ppm1=0.889 ppm2=0.817

assign ( resid 51 and name HG
  )
       ( resid 51 and name HD1#
  or resid 51 and name HD2#
  ) 4.4 2.6 0.9 volume=0.421 peak=16 ppm1=1.136 ppm2=0.915

assign ( resid 48 and name HN
  )
       ( resid 44 and name HG2#
  or resid 44 and name HG1#
  ) 5.2 3.4 0.8 volume=0.158 peak=24 ppm1=8.173 ppm2=0.586

assign ( resid 51 and name HB1
  )
       ( resid 51 and name HD1#
  or resid 51 and name HD2#
  ) 5.1 3.3 0.9 volume=0.175 peak=1 ppm1=1.798 ppm2=0.876

assign ( resid 51 and name HD1#
  or resid 51 and name HD2#
  )
       ( resid 51 and name HB1
  ) 4.9 3.1 1.0 volume=0.247 peak=9 ppm1=0.889 ppm2=1.771

assign ( resid 51 and name HN
  )
       ( resid 51 and name HD1#
  or resid 51 and name HD2#
  ) 4.4 2.6 0.9 volume=0.445 peak=25 ppm1=8.088 ppm2=0.882

assign ( resid 45 and name HN
  )
       ( resid 44 and name HG2#
  or resid 44 and name HG1#
  ) 5.1 3.3 0.9 volume=0.176 peak=23 ppm1=8.873 ppm2=0.612

assign ( resid 48 and name HA
  )
       ( resid 51 and name HD1#
  or resid 51 and name HD2#
  ) 5.1 3.3 0.9 volume=0.181 peak=18 ppm1=3.670 ppm2=0.870

assign ( resid 50 and name HD2
  )
       ( resid 51 and name HD1#
  or resid 51 and name HD2#
  ) 5.5 3.7 0.5 volume=0.118 peak=21 ppm1=7.070 ppm2=0.885

assign ( resid 50 and name HD2
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 5.6 3.8 0.4 volume=0.105 peak=20 ppm1=7.068 ppm2=0.836

assign ( resid 41 and name HE#
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 6.0 4.2 0.0 volume=0.087 peak=19 ppm1=6.717 ppm2=0.836

assign ( resid 51 and name HD1#
  or resid 51 and name HD2#
  )
       ( resid 47 and name HA
  ) 5.8 4.0 0.2 volume=0.086 peak=3 ppm1=0.890 ppm2=2.976

assign ( resid 50 and name HB1
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 6.0 4.2 0.0 volume=0.070 peak=4 ppm1=2.812 ppm2=0.812

assign ( resid 47 and name HN
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 5.1 3.3 0.9 volume=0.192 peak=22 ppm1=6.871 ppm2=0.773

assign ( resid 51 and name HB2
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 5.2 3.4 0.8 volume=0.156 peak=17 ppm1=1.488 ppm2=0.817

assign ( resid 51 and name HD1#
  or resid 51 and name HD2#
  )
       ( resid 35 and name HG2
  or resid 35 and name HG1
  ) 5.8 4.0 0.2 volume=0.086 peak=12 ppm1=0.902 ppm2=2.008

assign ( resid 47 and name HB2
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 5.6 3.8 0.4 volume=0.107 peak=5 ppm1=1.875 ppm2=0.840

assign ( resid 51 and name HB2
  )
       ( resid 51 and name HD1#
  or resid 51 and name HD2#
  ) 5.6 3.8 0.4 volume=0.101 peak=14 ppm1=1.477 ppm2=0.891

assign ( resid 51 and name HG
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 5.2 3.4 0.8 volume=0.157 peak=7 ppm1=1.136 ppm2=0.823

assign ( resid 50 and name HB2
  )
       ( resid 51 and name HD1#
  or resid 51 and name HD2#
  ) 6.0 4.2 0.0 volume=0.051 peak=6 ppm1=3.047 ppm2=0.846

assign ( resid 47 and name HB1
  )
       ( resid 51 and name HD1#
  or resid 51 and name HD2#
  ) 6.0 4.2 0.0 volume=0.065 peak=13 ppm1=1.088 ppm2=0.884

assign ( resid 50 and name HN
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 4.7 2.9 0.9 volume=0.298 peak=26 ppm1=7.319 ppm2=0.831

assign ( resid 48 and name HN
  )
       ( resid 47 and name HD2#
  or resid 47 and name HD1#
  ) 4.7 2.9 0.9 volume=0.294 peak=27 ppm1=8.177 ppm2=0.807

ASSIGN  (segid "   A" and resid 51    and name N   ) (segid "   A" and resid 51    and name CA   )
         (segid "   A" and resid 51    and name CB  ) (segid "   A" and resid 51    and name CG   )  1.00 -60.00 40.00 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   )  1.00 148.03 58.03 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 -122.44 37.56 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   )  1.00 134.33 44.33 2

 ASSIGN  (segid "   A" and resid 32   and name C   ) (segid "   A" and resid 33   and name N   )
         (segid "   A" and resid 33   and name CA  ) (segid "   A" and resid 33   and name C   )  1.00 -113.10 36.90 2

 ASSIGN  (segid "   A" and resid 33   and name N   ) (segid "   A" and resid 33   and name CA  )
         (segid "   A" and resid 33   and name C   ) (segid "   A" and resid 34   and name N   )  1.00 127.32 37.32 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 -74.12 25.88 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   )  1.00 152.80 52.80 2

 ASSIGN  (segid "   A" and resid 34   and name C   ) (segid "   A" and resid 35   and name N   )
         (segid "   A" and resid 35   and name CA  ) (segid "   A" and resid 35   and name C   )  1.00 -64.78 25.22 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 -84.72 15.28 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 -24.50 15.50 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 -77.42 32.58 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 -15.51 34.49 2

 ASSIGN  (segid "   A" and resid 38   and name C   ) (segid "   A" and resid 39   and name N   )
         (segid "   A" and resid 39   and name CA  ) (segid "   A" and resid 39   and name C   )  1.00 -74.94 65.06 2

 ASSIGN  (segid "   A" and resid 39   and name N   ) (segid "   A" and resid 39   and name CA  )
         (segid "   A" and resid 39   and name C   ) (segid "   A" and resid 40   and name N   )  1.00 145.89 45.89 2

 ASSIGN  (segid "   A" and resid 39   and name C   ) (segid "   A" and resid 40   and name N   )
         (segid "   A" and resid 40   and name CA  ) (segid "   A" and resid 40   and name C   )  1.00 -132.02 47.98 2

 ASSIGN  (segid "   A" and resid 40   and name N   ) (segid "   A" and resid 40   and name CA  )
         (segid "   A" and resid 40   and name C   ) (segid "   A" and resid 41   and name N   )  1.00 153.18 43.18 2

 ASSIGN  (segid "   A" and resid 40   and name C   ) (segid "   A" and resid 41   and name N   )
         (segid "   A" and resid 41   and name CA  ) (segid "   A" and resid 41   and name C   )  1.00 -134.25 45.75 2

 ASSIGN  (segid "   A" and resid 41   and name N   ) (segid "   A" and resid 41   and name CA  )
         (segid "   A" and resid 41   and name C   ) (segid "   A" and resid 42   and name N   )  1.00 154.27 54.27 2

 ASSIGN  (segid "   A" and resid 41   and name C   ) (segid "   A" and resid 42   and name N   )
         (segid "   A" and resid 42   and name CA  ) (segid "   A" and resid 42   and name C   )  1.00 -61.64 48.36 2

 ASSIGN  (segid "   A" and resid 42   and name N   ) (segid "   A" and resid 42   and name CA  )
         (segid "   A" and resid 42   and name C   ) (segid "   A" and resid 43   and name N   )  1.00 144.54 34.54 2

 ASSIGN  (segid "   A" and resid 42   and name C   ) (segid "   A" and resid 43   and name N   )
         (segid "   A" and resid 43   and name CA  ) (segid "   A" and resid 43   and name C   )  1.00 -59.89 40.11 2

 ASSIGN  (segid "   A" and resid 43   and name N   ) (segid "   A" and resid 43   and name CA  )
         (segid "   A" and resid 43   and name C   ) (segid "   A" and resid 44   and name N   )  1.00 -29.82 40.18 2

 ASSIGN  (segid "   A" and resid 43   and name C   ) (segid "   A" and resid 44   and name N   )
         (segid "   A" and resid 44   and name CA  ) (segid "   A" and resid 44   and name C   )  1.00 -64.75 25.25 2

 ASSIGN  (segid "   A" and resid 44   and name N   ) (segid "   A" and resid 44   and name CA  )
         (segid "   A" and resid 44   and name C   ) (segid "   A" and resid 45   and name N   )  1.00 -44.92 25.08 2

 ASSIGN  (segid "   A" and resid 44   and name C   ) (segid "   A" and resid 45   and name N   )
         (segid "   A" and resid 45   and name CA  ) (segid "   A" and resid 45   and name C   )  1.00 -64.64 25.36 2

 ASSIGN  (segid "   A" and resid 45   and name N   ) (segid "   A" and resid 45   and name CA  )
         (segid "   A" and resid 45   and name C   ) (segid "   A" and resid 46   and name N   )  1.00 -39.87 20.13 2

 ASSIGN  (segid "   A" and resid 45   and name C   ) (segid "   A" and resid 46   and name N   )
         (segid "   A" and resid 46   and name CA  ) (segid "   A" and resid 46   and name C   )  1.00 -64.94 25.06 2

 ASSIGN  (segid "   A" and resid 46   and name N   ) (segid "   A" and resid 46   and name CA  )
         (segid "   A" and resid 46   and name C   ) (segid "   A" and resid 47   and name N   )  1.00 -39.15 30.85 2

 ASSIGN  (segid "   A" and resid 46   and name C   ) (segid "   A" and resid 47   and name N   )
         (segid "   A" and resid 47   and name CA  ) (segid "   A" and resid 47   and name C   )  1.00 -64.87 25.13 2

 ASSIGN  (segid "   A" and resid 47   and name N   ) (segid "   A" and resid 47   and name CA  )
         (segid "   A" and resid 47   and name C   ) (segid "   A" and resid 48   and name N   )  1.00 -44.74 25.26 2

 ASSIGN  (segid "   A" and resid 47   and name C   ) (segid "   A" and resid 48   and name N   )
         (segid "   A" and resid 48   and name CA  ) (segid "   A" and resid 48   and name C   )  1.00 -64.40 25.60 2

 ASSIGN  (segid "   A" and resid 48   and name N   ) (segid "   A" and resid 48   and name CA  )
         (segid "   A" and resid 48   and name C   ) (segid "   A" and resid 49   and name N   )  1.00 -42.34 27.66 2

 ASSIGN  (segid "   A" and resid 48   and name C   ) (segid "   A" and resid 49   and name N   )
         (segid "   A" and resid 49   and name CA  ) (segid "   A" and resid 49   and name C   )  1.00 -64.36 25.64 2

 ASSIGN  (segid "   A" and resid 49   and name N   ) (segid "   A" and resid 49   and name CA  )
         (segid "   A" and resid 49   and name C   ) (segid "   A" and resid 50   and name N   )  1.00 -41.55 28.45 2

 ASSIGN  (segid "   A" and resid 49   and name C   ) (segid "   A" and resid 50   and name N   )
         (segid "   A" and resid 50   and name CA  ) (segid "   A" and resid 50   and name C   )  1.00 -64.71 25.29 2

 ASSIGN  (segid "   A" and resid 50   and name N   ) (segid "   A" and resid 50   and name CA  )
         (segid "   A" and resid 50   and name C   ) (segid "   A" and resid 51   and name N   )  1.00 -44.40 25.60 2

 ASSIGN  (segid "   A" and resid 50   and name C   ) (segid "   A" and resid 51   and name N   )
         (segid "   A" and resid 51   and name CA  ) (segid "   A" and resid 51   and name C   )  1.00 -64.72 25.28 2

 ASSIGN  (segid "   A" and resid 51   and name N   ) (segid "   A" and resid 51   and name CA  )
         (segid "   A" and resid 51   and name C   ) (segid "   A" and resid 52   and name N   )  1.00 -44.04 25.96 2

 ASSIGN  (segid "   A" and resid 51   and name C   ) (segid "   A" and resid 52   and name N   )
         (segid "   A" and resid 52   and name CA  ) (segid "   A" and resid 52   and name C   )  1.00 -62.63 27.37 2

 ASSIGN  (segid "   A" and resid 52   and name N   ) (segid "   A" and resid 52   and name CA  )
         (segid "   A" and resid 52   and name C   ) (segid "   A" and resid 53   and name N   )  1.00 -37.81 32.19 2

 ASSIGN  (segid "   A" and resid 52   and name C   ) (segid "   A" and resid 53   and name N   )
         (segid "   A" and resid 53   and name CA  ) (segid "   A" and resid 53   and name C   )  1.00 -70.12 19.88 2

 ASSIGN  (segid "   A" and resid 53   and name N   ) (segid "   A" and resid 53   and name CA  )
         (segid "   A" and resid 53   and name C   ) (segid "   A" and resid 54   and name N   )  1.00 -36.31 23.69 2

 ASSIGN  (segid "   A" and resid 53   and name C   ) (segid "   A" and resid 54   and name N   )
         (segid "   A" and resid 54   and name CA  ) (segid "   A" and resid 54   and name C   )  1.00 -64.11 25.89 2

 ASSIGN  (segid "   A" and resid 54   and name N   ) (segid "   A" and resid 54   and name CA  )
         (segid "   A" and resid 54   and name C   ) (segid "   A" and resid 55   and name N   )  1.00 -26.01 33.99 2

 ASSIGN  (segid "   A" and resid 54   and name C   ) (segid "   A" and resid 55   and name N   )
         (segid "   A" and resid 55   and name CA  ) (segid "   A" and resid 55   and name C   )  1.00 -79.31 40.69 2

 ASSIGN  (segid "   A" and resid 55   and name N   ) (segid "   A" and resid 55   and name CA  )
         (segid "   A" and resid 55   and name C   ) (segid "   A" and resid 56   and name N   )  1.00 -19.80 30.20 2

 ASSIGN  (segid "   A" and resid 55   and name C   ) (segid "   A" and resid 56   and name N   )
         (segid "   A" and resid 56   and name CA  ) (segid "   A" and resid 56   and name C   )  1.00 -65.41 34.59 2

 ASSIGN  (segid "   A" and resid 56   and name N   ) (segid "   A" and resid 56   and name CA  )
         (segid "   A" and resid 56   and name C   ) (segid "   A" and resid 57   and name N   )  1.00 145.04 25.04 2

 ASSIGN  (segid "   A" and resid 56   and name C   ) (segid "   A" and resid 57   and name N   )
         (segid "   A" and resid 57   and name CA  ) (segid "   A" and resid 57   and name C   )  1.00 -57.42 52.58 2

 ASSIGN  (segid "   A" and resid 57   and name N   ) (segid "   A" and resid 57   and name CA  )
         (segid "   A" and resid 57   and name C   ) (segid "   A" and resid 58   and name N   )  1.00 135.02 25.02 2

assign ( resid 52 and name HA
  )
       ( resid 53 and name HN
  ) 4.1 2.3 0.8 volume=0.233 peak=1450 ppm1=3.837 ppm2=7.641

assign ( resid 55 and name HN
  )
       ( resid 55 and name HA
  ) 3.8 2.0 0.8 volume=0.341 peak=1612 ppm1=7.226 ppm2=3.876

assign ( resid 48 and name HG2
  or resid 48 and name HG1
  )
       ( resid 48 and name HA
  ) 4.7 2.9 0.9 volume=0.104 peak=464 ppm1=1.225 ppm2=3.677

assign ( resid 40 and name HN
  )
       ( resid 39 and name HG1
  or resid 39 and name HG2
  ) 3.6 1.8 0.7 volume=0.469 peak=1643 ppm1=7.595 ppm2=1.017

assign ( resid 54 and name HD2
  )
       ( resid 53 and name HG11
  or resid 53 and name HG12
  ) 4.9 3.1 1.0 volume=0.075 peak=1514 ppm1=6.459 ppm2=0.821

assign ( resid 52 and name HD2
  or resid 52 and name HD1
  )
       ( resid 52 and name HA
  ) 4.4 2.6 0.9 volume=0.145 peak=1327 ppm1=1.545 ppm2=3.836

assign ( resid 53 and name HN
  )
       ( resid 54 and name HN
  ) 3.6 1.8 0.7 volume=0.501 peak=1640 ppm1=7.652 ppm2=7.093

assign ( resid 53 and name HA
  )
       ( resid 53 and name HN
  ) 4.3 2.5 0.9 volume=0.167 peak=1144 ppm1=3.827 ppm2=7.667

assign ( resid 56 and name HA
  )
       ( resid 56 and name HB#
  ) 4.6 2.8 0.9 volume=0.324 peak=781 ppm1=4.192 ppm2=1.214

assign ( resid 54 and name HN
  )
       ( resid 53 and name HB
  ) 4.4 2.6 0.9 volume=0.152 peak=1535 ppm1=7.099 ppm2=1.565

assign ( resid 39 and name HN
  )
       ( resid 39 and name HG1
  or resid 39 and name HG2
  ) 3.8 2.0 0.8 volume=0.348 peak=1590 ppm1=8.139 ppm2=1.044

assign ( resid 47 and name HB1
  )
       ( resid 47 and name HN
  ) 5.8 4.0 0.2 volume=0.029 peak=448 ppm1=1.087 ppm2=6.893

assign ( resid 49 and name HA
  )
       ( resid 49 and name HB#
  ) 4.2 2.4 0.8 volume=0.578 peak=589 ppm1=3.936 ppm2=1.298

assign ( resid 53 and name HN
  )
       ( resid 55 and name HN
  ) 4.3 2.5 0.9 volume=0.182 peak=1586 ppm1=7.655 ppm2=7.262

assign ( resid 54 and name HN
  )
       ( resid 51 and name HA
  ) 4.5 2.7 0.9 volume=0.125 peak=1642 ppm1=7.091 ppm2=3.647

assign ( resid 51 and name HN
  )
       ( resid 50 and name HB2
  ) 3.9 2.1 0.8 volume=0.312 peak=1606 ppm1=8.088 ppm2=3.030

assign ( resid 53 and name HN
  )
       ( resid 52 and name HN
  ) 3.6 1.8 0.7 volume=0.468 peak=1589 ppm1=7.641 ppm2=6.873

assign ( resid 50 and name HN
  )
       ( resid 47 and name HA
  ) 3.0 1.2 0.6 volume=1.348 peak=1553 ppm1=7.318 ppm2=2.934

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 48 and name HE1
  or resid 48 and name HE2
  ) 4.6 2.8 0.9 volume=0.112 peak=1284 ppm1=1.679 ppm2=2.737

assign ( resid 47 and name HB1
  )
       ( resid 47 and name HG
  ) 4.7 2.9 0.9 volume=0.100 peak=806 ppm1=1.073 ppm2=1.339

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 47 and name HA
  ) 4.9 3.1 1.0 volume=0.147 peak=1524 ppm1=6.718 ppm2=2.959

assign ( resid 49 and name HB#
  )
       ( resid 50 and name HN
  ) 5.5 3.7 0.5 volume=0.118 peak=1391 ppm1=1.295 ppm2=7.336

assign ( resid 50 and name HA
  )
       ( resid 51 and name HN
  ) 5.7 3.9 0.3 volume=0.032 peak=556 ppm1=4.079 ppm2=8.075

assign ( resid 50 and name HN
  )
       ( resid 50 and name HA
  ) 3.1 1.3 0.6 volume=1.118 peak=1598 ppm1=7.322 ppm2=4.070

assign ( resid 52 and name HA
  )
       ( resid 52 and name HN
  ) 4.8 3.0 1.0 volume=0.084 peak=983 ppm1=3.827 ppm2=6.872

assign ( resid 52 and name HN
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 3.1 1.3 0.6 volume=1.178 peak=1559 ppm1=6.877 ppm2=1.686

assign ( resid 51 and name HN
  )
       ( resid 47 and name HA
  ) 3.5 1.7 0.7 volume=0.628 peak=1616 ppm1=8.084 ppm2=2.942

assign ( resid 53 and name HB
  )
       ( resid 53 and name HN
  ) 4.5 2.7 0.9 volume=0.133 peak=1177 ppm1=1.575 ppm2=7.672

assign ( resid 51 and name HN
  )
       ( resid 51 and name HA
  ) 3.3 1.5 0.7 volume=0.822 peak=1627 ppm1=8.088 ppm2=3.683

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 39 and name HG1
  or resid 39 and name HG2
  ) 5.0 3.2 1.0 volume=0.138 peak=1504 ppm1=6.714 ppm2=1.025

assign ( resid 41 and name HD1 or resid 41 and name HD2
  )
       ( resid 41 and name HE1 or resid 41 and name HE2
  ) 4.6 2.8 0.9 volume=0.474 peak=1496 ppm1=7.099 ppm2=6.698

assign ( resid 55 and name HG2#
  )
       ( resid 55 and name HN
  ) 6.0 4.2 0.0 volume=0.040 peak=102 ppm1=0.747 ppm2=7.262

assign ( resid 53 and name HA
  )
       ( resid 53 and name HB
  ) 3.6 1.8 0.7 volume=0.534 peak=141 ppm1=3.827 ppm2=1.577

assign ( resid 52 and name HN
  )
       ( resid 52 and name HA
  ) 3.5 1.7 0.7 volume=0.628 peak=1591 ppm1=6.874 ppm2=3.817

assign ( resid 55 and name HG11
  )
       ( resid 55 and name HB
  ) 4.3 2.5 0.9 volume=0.172 peak=103 ppm1=1.010 ppm2=1.701

assign ( resid 48 and name HA
  )
       ( resid 48 and name HN
  ) 4.6 2.8 0.9 volume=0.109 peak=1194 ppm1=3.670 ppm2=8.197

assign ( resid 50 and name HB2
  )
       ( resid 50 and name HA
  ) 5.6 3.8 0.4 volume=0.033 peak=576 ppm1=3.063 ppm2=4.052

assign ( resid 38 and name HN
  )
       ( resid 39 and name HN
  ) 3.2 1.4 0.6 volume=0.926 peak=1632 ppm1=7.984 ppm2=8.148

assign ( resid 53 and name HG11
  or resid 53 and name HG12
  )
       ( resid 53 and name HN
  ) 5.5 3.7 0.5 volume=0.039 peak=421 ppm1=0.791 ppm2=7.638

assign ( resid 55 and name HN
  )
       ( resid 55 and name HD1#
  ) 4.8 3.0 1.0 volume=0.268 peak=1647 ppm1=7.246 ppm2=0.712

assign ( resid 53 and name HN
  )
       ( resid 50 and name HN
  ) 4.1 2.3 0.8 volume=0.226 peak=1540 ppm1=7.645 ppm2=7.317

assign ( resid 40 and name HN
  )
       ( resid 39 and name HB2
  or resid 39 and name HB1
  ) 3.3 1.5 0.7 volume=0.785 peak=1594 ppm1=7.595 ppm2=1.284

assign ( resid 39 and name HG1
  or resid 39 and name HG2
  )
       ( resid 50 and name HE1
  ) 5.9 4.1 0.1 volume=0.025 peak=1087 ppm1=1.029 ppm2=7.841

assign ( resid 50 and name HD2
  )
       ( resid 34 and name HB1
  ) 5.4 3.6 0.6 volume=0.042 peak=1499 ppm1=7.075 ppm2=2.705

assign ( resid 52 and name HB2
  or resid 52 and name HB1
  )
       ( resid 52 and name HE2
  or resid 52 and name HE1
  ) 4.4 2.6 0.9 volume=0.149 peak=1125 ppm1=1.690 ppm2=2.849

assign ( resid 55 and name HG11
  )
       ( resid 55 and name HN
  ) 5.7 3.9 0.3 volume=0.031 peak=453 ppm1=1.020 ppm2=7.273

assign ( resid 55 and name HB
  )
       ( resid 55 and name HN
  ) 5.0 3.2 1.0 volume=0.068 peak=1379 ppm1=1.717 ppm2=7.271

assign ( resid 52 and name HA
  )
       ( resid 55 and name HN
  ) 5.6 3.8 0.4 volume=0.033 peak=356 ppm1=3.840 ppm2=7.239

assign ( resid 52 and name HN
  )
       ( resid 51 and name HB2
  ) 3.4 1.6 0.7 volume=0.697 peak=1631 ppm1=6.874 ppm2=1.461

assign ( resid 47 and name HA
  )
       ( resid 47 and name HB1
  ) 4.5 2.7 0.9 volume=0.125 peak=373 ppm1=2.934 ppm2=1.069

assign ( resid 48 and name HN
  )
       ( resid 47 and name HB1
  ) 4.2 2.4 0.8 volume=0.206 peak=1569 ppm1=8.182 ppm2=1.030

assign ( resid 57 and name HN
  )
       ( resid 57 and name HA
  ) 3.2 1.4 0.6 volume=1.049 peak=1597 ppm1=7.919 ppm2=4.448

assign ( resid 51 and name HB2
  )
       ( resid 51 and name HN
  ) 4.8 3.0 1.0 volume=0.090 peak=840 ppm1=1.497 ppm2=8.080

assign ( resid 58 and name HN
  )
       ( resid 57 and name HB1
  or resid 57 and name HB2
  ) 4.1 2.3 0.8 volume=0.212 peak=1532 ppm1=7.898 ppm2=2.511

assign ( resid 45 and name HA2
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 5.3 3.5 0.7 volume=0.049 peak=815 ppm1=3.563 ppm2=1.668

assign ( resid 47 and name HA
  )
       ( resid 47 and name HN
  ) 5.8 4.0 0.2 volume=0.028 peak=1280 ppm1=2.934 ppm2=6.881

assign ( resid 50 and name HB1
  )
       ( resid 47 and name HG
  ) 4.2 2.4 0.8 volume=0.186 peak=452 ppm1=2.830 ppm2=1.286

assign ( resid 49 and name HA
  )
       ( resid 51 and name HN
  ) 6.0 4.2 0.0 volume=0.013 peak=324 ppm1=3.946 ppm2=8.091

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 41 and name HZ
  ) 4.6 2.8 0.9 volume=0.215 peak=1520 ppm1=6.714 ppm2=6.144

assign ( resid 46 and name HN
  )
       ( resid 45 and name HA1
  ) 3.9 2.1 0.8 volume=0.302 peak=1572 ppm1=6.989 ppm2=3.762

assign ( resid 51 and name HN
  )
       ( resid 53 and name HN
  ) 4.7 2.9 0.9 volume=0.094 peak=1601 ppm1=8.078 ppm2=7.626

assign ( resid 53 and name HG11
  or resid 53 and name HG12
  )
       ( resid 53 and name HG2#
  ) 4.9 3.1 1.0 volume=0.235 peak=1090 ppm1=0.787 ppm2=0.477

assign ( resid 50 and name HB1
  )
       ( resid 53 and name HG2#
  ) 6.0 4.2 0.0 volume=0.022 peak=39 ppm1=2.827 ppm2=0.446

assign ( resid 58 and name HA2
  )
       ( resid 58 and name HA1
  ) 3.9 2.1 0.8 volume=0.292 peak=1261 ppm1=3.995 ppm2=3.911

assign ( resid 52 and name HG2
  or resid 52 and name HG1
  )
       ( resid 52 and name HN
  ) 5.3 3.5 0.7 volume=0.050 peak=791 ppm1=1.318 ppm2=6.876

assign ( resid 47 and name HN
  )
       ( resid 46 and name HN
  ) 3.8 2.0 0.8 volume=0.374 peak=1617 ppm1=6.877 ppm2=7.000

assign ( resid 50 and name HA
  )
       ( resid 50 and name HB2
  ) 4.9 3.1 1.0 volume=0.074 peak=1023 ppm1=4.077 ppm2=3.054

assign ( resid 54 and name HN
  )
       ( resid 55 and name HN
  ) 3.7 1.9 0.7 volume=0.404 peak=1576 ppm1=7.107 ppm2=7.251

assign ( resid 50 and name HB2
  )
       ( resid 51 and name HN
  ) 5.6 3.8 0.4 volume=0.036 peak=696 ppm1=3.062 ppm2=8.080

assign ( resid 48 and name HA
  )
       ( resid 48 and name HD1
  or resid 48 and name HD2
  ) 4.2 2.4 0.8 volume=0.193 peak=1248 ppm1=3.670 ppm2=1.447

assign ( resid 49 and name HN
  )
       ( resid 45 and name HA2
  ) 4.5 2.7 0.9 volume=0.136 peak=1531 ppm1=7.190 ppm2=3.566

assign ( resid 39 and name HG1
  or resid 39 and name HG2
  )
       ( resid 39 and name HD2
  or resid 39 and name HD1
  ) 3.6 1.8 0.7 volume=0.471 peak=860 ppm1=1.027 ppm2=1.315

assign ( resid 52 and name HB2
  or resid 52 and name HB1
  )
       ( resid 49 and name HA
  ) 4.6 2.8 0.9 volume=0.118 peak=1029 ppm1=1.692 ppm2=3.953

assign ( resid 53 and name HB
  )
       ( resid 54 and name HN
  ) 5.7 3.9 0.3 volume=0.032 peak=923 ppm1=1.572 ppm2=7.091

assign ( resid 41 and name HZ
  )
       ( resid 39 and name HE2
  ) 5.7 3.9 0.3 volume=0.033 peak=1509 ppm1=6.143 ppm2=2.800

assign ( resid 41 and name HZ
  )
       ( resid 41 and name HE1 or resid 41 and name HE2
  ) 4.5 2.7 0.9 volume=0.247 peak=1523 ppm1=6.145 ppm2=6.714

assign ( resid 49 and name HN
  )
       ( resid 50 and name HN
  ) 3.2 1.4 0.6 volume=1.058 peak=1582 ppm1=7.188 ppm2=7.302

assign ( resid 55 and name HA
  )
       ( resid 55 and name HG2#
  ) 4.9 3.1 1.0 volume=0.236 peak=1088 ppm1=3.879 ppm2=0.771

assign ( resid 49 and name HA
  )
       ( resid 50 and name HN
  ) 6.0 4.2 0.0 volume=0.022 peak=306 ppm1=3.937 ppm2=7.339

assign ( resid 54 and name HD2
  )
       ( resid 53 and name HG2#
  ) 6.0 4.2 0.0 volume=0.029 peak=1508 ppm1=6.452 ppm2=0.479

assign ( resid 55 and name HB
  )
       ( resid 56 and name HN
  ) 5.3 3.5 0.7 volume=0.050 peak=764 ppm1=1.709 ppm2=8.022

assign ( resid 41 and name HZ
  )
       ( resid 39 and name HD2
  or resid 39 and name HD1
  ) 5.2 3.4 0.8 volume=0.051 peak=1513 ppm1=6.137 ppm2=1.278

assign ( resid 52 and name HN
  )
       ( resid 49 and name HA
  ) 4.3 2.5 0.9 volume=0.165 peak=1527 ppm1=6.874 ppm2=3.942

assign ( resid 48 and name HA
  )
       ( resid 48 and name HG2
  or resid 48 and name HG1
  ) 4.4 2.6 0.9 volume=0.145 peak=688 ppm1=3.668 ppm2=1.226

assign ( resid 55 and name HA
  )
       ( resid 55 and name HB
  ) 4.1 2.3 0.8 volume=0.234 peak=1282 ppm1=3.898 ppm2=1.727

assign ( resid 47 and name HN
  )
       ( resid 47 and name HB2
  ) 3.9 2.1 0.8 volume=0.318 peak=1629 ppm1=6.875 ppm2=1.845

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 48 and name HD1
  or resid 48 and name HD2
  ) 3.1 1.3 0.6 volume=1.181 peak=828 ppm1=1.679 ppm2=1.454

assign ( resid 51 and name HA
  )
       ( resid 51 and name HG
  ) 4.7 2.9 0.9 volume=0.104 peak=264 ppm1=3.678 ppm2=1.133

assign ( resid 52 and name HA
  )
       ( resid 55 and name HG2#
  ) 5.8 4.0 0.2 volume=0.084 peak=1045 ppm1=3.833 ppm2=0.733

assign ( resid 55 and name HG2#
  )
       ( resid 55 and name HG12
  ) 4.9 3.1 1.0 volume=0.229 peak=980 ppm1=0.748 ppm2=1.299

assign ( resid 52 and name HD2
  or resid 52 and name HD1
  )
       ( resid 52 and name HE2
  or resid 52 and name HE1
  ) 3.1 1.3 0.6 volume=1.111 peak=738 ppm1=1.545 ppm2=2.845

assign ( resid 55 and name HD1#
  )
       ( resid 55 and name HN
  ) 6.0 4.2 0.0 volume=0.018 peak=426 ppm1=0.699 ppm2=7.276

assign ( resid 53 and name HN
  )
       ( resid 53 and name HG2#
  ) 3.7 1.9 0.7 volume=1.312 peak=1636 ppm1=7.650 ppm2=0.447

assign ( resid 53 and name HN
  )
       ( resid 50 and name HA
  ) 4.5 2.7 0.9 volume=0.133 peak=1609 ppm1=7.644 ppm2=4.070

assign ( resid 53 and name HN
  )
       ( resid 53 and name HA
  ) 3.3 1.5 0.7 volume=0.867 peak=1575 ppm1=7.651 ppm2=3.826

assign ( resid 49 and name HB#
  )
       ( resid 49 and name HN
  ) 4.7 2.9 0.9 volume=0.293 peak=1442 ppm1=1.293 ppm2=7.193

assign ( resid 56 and name HN
  )
       ( resid 57 and name HA
  ) 4.4 2.6 0.9 volume=0.143 peak=1529 ppm1=8.011 ppm2=4.437

assign ( resid 55 and name HA
  )
       ( resid 55 and name HG12
  ) 5.2 3.4 0.8 volume=0.055 peak=72 ppm1=3.867 ppm2=1.349

assign ( resid 51 and name HB1
  )
       ( resid 51 and name HG
  ) 5.1 3.3 0.9 volume=0.058 peak=835 ppm1=1.798 ppm2=1.135

assign ( resid 47 and name HB2
  )
       ( resid 47 and name HA
  ) 5.5 3.7 0.5 volume=0.039 peak=1386 ppm1=1.869 ppm2=2.917

assign ( resid 47 and name HN
  )
       ( resid 47 and name HG
  ) 4.2 2.4 0.8 volume=0.198 peak=1539 ppm1=6.866 ppm2=1.326

assign ( resid 50 and name HN
  )
       ( resid 50 and name HB2
  ) 3.2 1.4 0.6 volume=1.029 peak=1593 ppm1=7.321 ppm2=3.018

assign ( resid 48 and name HD1
  or resid 48 and name HD2
  )
       ( resid 48 and name HA
  ) 4.8 3.0 1.0 volume=0.092 peak=1393 ppm1=1.463 ppm2=3.659

assign ( resid 51 and name HB1
  )
       ( resid 51 and name HB2
  ) 4.3 2.5 0.9 volume=0.180 peak=1206 ppm1=1.798 ppm2=1.486

assign ( resid 55 and name HB
  )
       ( resid 55 and name HG2#
  ) 4.4 2.6 0.9 volume=0.434 peak=192 ppm1=1.717 ppm2=0.782

assign ( resid 57 and name HA
  )
       ( resid 57 and name HB1
  or resid 57 and name HB2
  ) 5.1 3.3 0.9 volume=0.063 peak=329 ppm1=4.446 ppm2=2.534

assign ( resid 49 and name HA
  )
       ( resid 52 and name HN
  ) 6.0 4.2 0.0 volume=0.016 peak=1476 ppm1=3.940 ppm2=6.904

assign ( resid 49 and name HN
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 3.4 1.6 0.7 volume=0.676 peak=1633 ppm1=7.188 ppm2=1.672

assign ( resid 58 and name HN
  )
       ( resid 58 and name HA1
  ) 3.4 1.6 0.7 volume=0.645 peak=1615 ppm1=7.897 ppm2=3.933

assign ( resid 47 and name HA
  )
       ( resid 47 and name HG
  ) 5.3 3.5 0.7 volume=0.050 peak=1056 ppm1=2.934 ppm2=1.301

assign ( resid 48 and name HD1
  or resid 48 and name HD2
  )
       ( resid 48 and name HE1
  or resid 48 and name HE2
  ) 3.4 1.6 0.7 volume=0.644 peak=441 ppm1=1.463 ppm2=2.736

assign ( resid 52 and name HN
  )
       ( resid 53 and name HN
  ) 3.7 1.9 0.7 volume=0.440 peak=1571 ppm1=6.877 ppm2=7.658

assign ( resid 52 and name HB2
  or resid 52 and name HB1
  )
       ( resid 52 and name HN
  ) 4.5 2.7 0.9 volume=0.137 peak=864 ppm1=1.691 ppm2=6.872

assign ( resid 51 and name HG
  )
       ( resid 51 and name HB2
  ) 3.4 1.6 0.7 volume=0.710 peak=121 ppm1=1.136 ppm2=1.494

assign ( resid 48 and name HN
  )
       ( resid 46 and name HA
  ) 4.7 2.9 0.9 volume=0.100 peak=1547 ppm1=8.176 ppm2=4.423

assign ( resid 51 and name HN
  )
       ( resid 52 and name HN
  ) 3.6 1.8 0.7 volume=0.503 peak=1551 ppm1=8.088 ppm2=6.917

assign ( resid 47 and name HB2
  )
       ( resid 47 and name HB1
  ) 4.7 2.9 0.9 volume=0.099 peak=436 ppm1=1.881 ppm2=1.063

assign ( resid 50 and name HB1
  )
       ( resid 50 and name HB2
  ) 5.0 3.2 1.0 volume=0.067 peak=943 ppm1=2.813 ppm2=3.071

assign ( resid 52 and name HG2
  or resid 52 and name HG1
  )
       ( resid 52 and name HA
  ) 5.3 3.5 0.7 volume=0.048 peak=1417 ppm1=1.328 ppm2=3.849

assign ( resid 51 and name HA
  )
       ( resid 51 and name HB2
  ) 5.8 4.0 0.2 volume=0.028 peak=919 ppm1=3.670 ppm2=1.484

assign ( resid 46 and name HB1
  or resid 46 and name HB2
  )
       ( resid 47 and name HN
  ) 3.9 2.1 0.8 volume=0.313 peak=205 ppm1=2.826 ppm2=6.892

assign ( resid 48 and name HN
  )
       ( resid 47 and name HB2
  ) 3.7 1.9 0.7 volume=0.422 peak=1649 ppm1=8.177 ppm2=1.829

assign ( resid 39 and name HB2
  or resid 39 and name HB1
  )
       ( resid 40 and name HN
  ) 6.0 4.2 0.0 volume=0.022 peak=643 ppm1=1.267 ppm2=7.602

assign ( resid 39 and name HD2
  or resid 39 and name HD1
  )
       ( resid 39 and name HE1
  ) 4.4 2.6 0.9 volume=0.150 peak=744 ppm1=1.335 ppm2=3.085

assign ( resid 49 and name HN
  )
       ( resid 49 and name HA
  ) 3.4 1.6 0.7 volume=0.643 peak=1542 ppm1=7.185 ppm2=3.932

assign ( resid 48 and name HN
  )
       ( resid 48 and name HA
  ) 3.6 1.8 0.7 volume=0.516 peak=1624 ppm1=8.182 ppm2=3.627

assign ( resid 55 and name HD1#
  )
       ( resid 55 and name HB
  ) 4.8 3.0 1.0 volume=0.267 peak=45 ppm1=0.692 ppm2=1.699

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 50 and name HE1
  ) 6.0 4.2 0.0 volume=0.043 peak=1502 ppm1=6.715 ppm2=7.873

assign ( resid 54 and name HN
  )
       ( resid 54 and name HB1
  or resid 54 and name HB2
  ) 3.7 1.9 0.7 volume=0.426 peak=1604 ppm1=7.100 ppm2=2.663

assign ( resid 55 and name HN
  )
       ( resid 55 and name HB
  ) 3.5 1.7 0.7 volume=0.595 peak=1545 ppm1=7.229 ppm2=1.719

assign ( resid 53 and name HA
  )
       ( resid 53 and name HG2#
  ) 4.1 2.3 0.8 volume=0.680 peak=8 ppm1=3.827 ppm2=0.496

assign ( resid 45 and name HA2
  )
       ( resid 45 and name HA1
  ) 3.5 1.7 0.7 volume=0.618 peak=1188 ppm1=3.564 ppm2=3.747

assign ( resid 48 and name HG2
  or resid 48 and name HG1
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 3.4 1.6 0.7 volume=0.700 peak=711 ppm1=1.231 ppm2=1.675

assign ( resid 49 and name HN
  )
       ( resid 48 and name HD1
  or resid 48 and name HD2
  ) 4.1 2.3 0.8 volume=0.220 peak=1630 ppm1=7.195 ppm2=1.422

assign ( resid 48 and name HD1
  or resid 48 and name HD2
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 3.6 1.8 0.7 volume=0.484 peak=1004 ppm1=1.463 ppm2=1.685

assign ( resid 50 and name HA
  )
       ( resid 52 and name HN
  ) 6.0 4.2 0.0 volume=0.019 peak=977 ppm1=4.093 ppm2=6.884

assign ( resid 51 and name HN
  )
       ( resid 50 and name HA
  ) 3.9 2.1 0.8 volume=0.313 peak=1565 ppm1=8.088 ppm2=4.054

assign ( resid 55 and name HG11
  )
       ( resid 55 and name HD1#
  ) 4.4 2.6 0.9 volume=0.471 peak=1291 ppm1=1.018 ppm2=0.711

assign ( resid 56 and name HA
  )
       ( resid 56 and name HN
  ) 4.7 2.9 0.9 volume=0.106 peak=244 ppm1=4.189 ppm2=7.991

assign ( resid 49 and name HA
  )
       ( resid 49 and name HN
  ) 4.6 2.8 0.9 volume=0.109 peak=252 ppm1=3.945 ppm2=7.193

assign ( resid 55 and name HG12
  )
       ( resid 55 and name HD1#
  ) 4.2 2.4 0.8 volume=0.553 peak=549 ppm1=1.327 ppm2=0.699

assign ( resid 55 and name HG11
  )
       ( resid 55 and name HG12
  ) 3.4 1.6 0.7 volume=0.645 peak=680 ppm1=1.020 ppm2=1.323

assign ( resid 56 and name HB#
  )
       ( resid 55 and name HD1#
  ) 6.0 4.2 0.0 volume=0.042 peak=844 ppm1=1.216 ppm2=0.711

assign ( resid 48 and name HE1
  or resid 48 and name HE2
  )
       ( resid 48 and name HA
  ) 4.6 2.8 0.9 volume=0.112 peak=94 ppm1=2.730 ppm2=3.656

assign ( resid 56 and name HN
  )
       ( resid 55 and name HG2#
  ) 4.9 3.1 1.0 volume=0.219 peak=1644 ppm1=8.004 ppm2=0.718

assign ( resid 55 and name HD1#
  )
       ( resid 55 and name HG12
  ) 4.5 2.7 0.9 volume=0.371 peak=775 ppm1=0.693 ppm2=1.350

assign ( resid 55 and name HD1#
  )
       ( resid 51 and name HB2
  ) 6.0 4.2 0.0 volume=0.068 peak=971 ppm1=0.692 ppm2=1.514

assign ( resid 55 and name HA
  )
       ( resid 55 and name HN
  ) 5.6 3.8 0.4 volume=0.036 peak=1397 ppm1=3.860 ppm2=7.276

assign ( resid 49 and name HN
  )
       ( resid 47 and name HN
  ) 4.3 2.5 0.9 volume=0.172 peak=1558 ppm1=7.189 ppm2=6.845

assign ( resid 47 and name HN
  )
       ( resid 47 and name HB1
  ) 4.2 2.4 0.8 volume=0.200 peak=1641 ppm1=6.884 ppm2=1.043

assign ( resid 54 and name HD2
  )
       ( resid 54 and name HB1
  or resid 54 and name HB2
  ) 4.8 3.0 1.0 volume=0.092 peak=1517 ppm1=6.454 ppm2=2.701

assign ( resid 51 and name HG
  )
       ( resid 52 and name HN
  ) 5.2 3.4 0.8 volume=0.055 peak=1119 ppm1=1.139 ppm2=6.895

assign ( resid 50 and name HD2
  )
       ( resid 51 and name HB2
  ) 6.0 4.2 0.0 volume=0.019 peak=1505 ppm1=7.070 ppm2=1.494

assign ( resid 47 and name HN
  )
       ( resid 48 and name HN
  ) 3.8 2.0 0.8 volume=0.336 peak=1534 ppm1=6.868 ppm2=8.169

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 49 and name HN
  ) 4.9 3.1 1.0 volume=0.076 peak=535 ppm1=1.679 ppm2=7.219

assign ( resid 49 and name HN
  )
       ( resid 47 and name HA
  ) 4.1 2.3 0.8 volume=0.238 peak=1546 ppm1=7.205 ppm2=2.947

assign ( resid 51 and name HN
  )
       ( resid 48 and name HA
  ) 3.2 1.4 0.6 volume=1.086 peak=1637 ppm1=8.084 ppm2=3.659

assign ( resid 39 and name HD2
  or resid 39 and name HD1
  )
       ( resid 39 and name HE2
  ) 3.7 1.9 0.7 volume=0.438 peak=468 ppm1=1.331 ppm2=2.809

assign ( resid 52 and name HB2
  or resid 52 and name HB1
  )
       ( resid 52 and name HG2
  or resid 52 and name HG1
  ) 3.3 1.5 0.7 volume=0.785 peak=750 ppm1=1.695 ppm2=1.344

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 48 and name HN
  ) 4.2 2.4 0.8 volume=0.202 peak=477 ppm1=1.677 ppm2=8.171

assign ( resid 48 and name HN
  )
       ( resid 47 and name HA
  ) 4.3 2.5 0.9 volume=0.173 peak=1538 ppm1=8.175 ppm2=2.926

assign ( resid 55 and name HD1#
  )
       ( resid 55 and name HA
  ) 5.7 3.9 0.3 volume=0.094 peak=73 ppm1=0.693 ppm2=3.844

assign ( resid 58 and name HN
  )
       ( resid 58 and name HA2
  ) 3.7 1.9 0.7 volume=0.403 peak=1543 ppm1=7.896 ppm2=3.998

assign ( resid 50 and name HA
  )
       ( resid 53 and name HN
  ) 6.0 4.2 0.0 volume=0.008 peak=954 ppm1=4.092 ppm2=7.682

assign ( resid 50 and name HN
  )
       ( resid 52 and name HN
  ) 3.9 2.1 0.8 volume=0.308 peak=1566 ppm1=7.322 ppm2=6.885

assign ( resid 39 and name HN
  )
       ( resid 38 and name HN
  ) 3.6 1.8 0.7 volume=0.499 peak=1619 ppm1=8.152 ppm2=7.996

assign ( resid 53 and name HA
  )
       ( resid 57 and name HN
  ) 5.4 3.6 0.6 volume=0.043 peak=571 ppm1=3.827 ppm2=7.911

assign ( resid 39 and name HN
  )
       ( resid 39 and name HA
  ) 3.9 2.1 0.8 volume=0.328 peak=1645 ppm1=8.149 ppm2=3.779

assign ( resid 53 and name HB
  )
       ( resid 53 and name HA
  ) 3.8 2.0 0.8 volume=0.366 peak=1149 ppm1=1.572 ppm2=3.823

assign ( resid 50 and name HA
  )
       ( resid 53 and name HG2#
  ) 5.3 3.5 0.7 volume=0.153 peak=584 ppm1=4.081 ppm2=0.501

assign ( resid 54 and name HD2
  )
       ( resid 51 and name HA
  ) 4.4 2.6 0.9 volume=0.147 peak=1511 ppm1=6.452 ppm2=3.682

assign ( resid 52 and name HD2
  or resid 52 and name HD1
  )
       ( resid 52 and name HN
  ) 5.2 3.4 0.8 volume=0.053 peak=99 ppm1=1.545 ppm2=6.866

assign ( resid 56 and name HN
  )
       ( resid 56 and name HA
  ) 3.9 2.1 0.8 volume=0.320 peak=1614 ppm1=8.003 ppm2=4.175

assign ( resid 54 and name HN
  )
       ( resid 53 and name HA
  ) 3.9 2.1 0.8 volume=0.286 peak=1610 ppm1=7.099 ppm2=3.835

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 48 and name HG2
  or resid 48 and name HG1
  ) 3.4 1.6 0.7 volume=0.734 peak=793 ppm1=1.679 ppm2=1.229

assign ( resid 51 and name HB1
  )
       ( resid 51 and name HN
  ) 5.1 3.3 0.9 volume=0.061 peak=936 ppm1=1.799 ppm2=8.082

assign ( resid 55 and name HN
  )
       ( resid 54 and name HA
  ) 4.3 2.5 0.9 volume=0.169 peak=1599 ppm1=7.226 ppm2=4.459

assign ( resid 53 and name HN
  )
       ( resid 52 and name HG2
  or resid 52 and name HG1
  ) 4.4 2.6 0.9 volume=0.146 peak=1555 ppm1=7.651 ppm2=1.360

assign ( resid 57 and name HB1
  or resid 57 and name HB2
  )
       ( resid 57 and name HN
  ) 4.7 2.9 0.9 volume=0.101 peak=1157 ppm1=2.528 ppm2=7.945

assign ( resid 49 and name HA
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 4.7 2.9 0.9 volume=0.104 peak=281 ppm1=3.939 ppm2=1.692

assign ( resid 39 and name HN
  )
       ( resid 39 and name HB2
  or resid 39 and name HB1
  ) 3.3 1.5 0.7 volume=0.832 peak=1596 ppm1=8.153 ppm2=1.278

assign ( resid 48 and name HA
  )
       ( resid 51 and name HN
  ) 5.4 3.6 0.6 volume=0.045 peak=1043 ppm1=3.670 ppm2=8.067

assign ( resid 56 and name HN
  )
       ( resid 55 and name HB
  ) 4.2 2.4 0.8 volume=0.203 peak=1537 ppm1=8.011 ppm2=1.718

assign ( resid 57 and name HN
  )
       ( resid 57 and name HB1
  or resid 57 and name HB2
  ) 3.7 1.9 0.7 volume=0.446 peak=1592 ppm1=7.918 ppm2=2.491

assign ( resid 45 and name HN
  )
       ( resid 45 and name HA2
  ) 4.2 2.4 0.8 volume=0.189 peak=1611 ppm1=8.870 ppm2=3.559

assign ( resid 41 and name HD1 or resid 41 and name HD2
  )
       ( resid 41 and name HZ
  ) 6.0 4.2 0.0 volume=0.006 peak=1507 ppm1=7.099 ppm2=6.126

assign ( resid 50 and name HB2
  )
       ( resid 50 and name HB1
  ) 4.5 2.7 0.9 volume=0.134 peak=976 ppm1=3.061 ppm2=2.822

assign ( resid 55 and name HN
  )
       ( resid 51 and name HA
  ) 4.4 2.6 0.9 volume=0.156 peak=1621 ppm1=7.232 ppm2=3.652

assign ( resid 49 and name HN
  )
       ( resid 46 and name HA
  ) 3.9 2.1 0.8 volume=0.301 peak=1554 ppm1=7.184 ppm2=4.431

assign ( resid 50 and name HD2
  )
       ( resid 51 and name HG
  ) 5.7 3.9 0.3 volume=0.031 peak=1510 ppm1=7.071 ppm2=1.134

assign ( resid 50 and name HN
  )
       ( resid 49 and name HN
  ) 2.7 0.9 0.5 volume=2.777 peak=1603 ppm1=7.322 ppm2=7.189

assign ( resid 54 and name HD2
  )
       ( resid 55 and name HN
  ) 5.6 3.8 0.4 volume=0.034 peak=1516 ppm1=6.453 ppm2=7.243

assign ( resid 39 and name HD2
  or resid 39 and name HD1
  )
       ( resid 39 and name HN
  ) 5.1 3.3 0.9 volume=0.058 peak=727 ppm1=1.309 ppm2=8.120

assign ( resid 55 and name HN
  )
       ( resid 56 and name HN
  ) 4.2 2.4 0.8 volume=0.185 peak=1533 ppm1=7.215 ppm2=8.024

assign ( resid 52 and name HN
  )
       ( resid 52 and name HG2
  or resid 52 and name HG1
  ) 3.7 1.9 0.7 volume=0.407 peak=1525 ppm1=6.875 ppm2=1.309

assign ( resid 48 and name HN
  )
       ( resid 48 and name HD1
  or resid 48 and name HD2
  ) 3.7 1.9 0.7 volume=0.415 peak=1618 ppm1=8.168 ppm2=1.462

assign ( resid 52 and name HA
  )
       ( resid 54 and name HN
  ) 5.8 4.0 0.2 volume=0.028 peak=1143 ppm1=3.827 ppm2=7.106

assign ( resid 46 and name HN
  )
       ( resid 47 and name HN
  ) 3.6 1.8 0.7 volume=0.527 peak=1550 ppm1=6.992 ppm2=6.870

assign ( resid 47 and name HA
  )
       ( resid 47 and name HB2
  ) 5.0 3.2 1.0 volume=0.070 peak=723 ppm1=2.934 ppm2=1.874

assign ( resid 50 and name HA
  )
       ( resid 50 and name HB1
  ) 4.1 2.3 0.8 volume=0.228 peak=987 ppm1=4.076 ppm2=2.846

assign ( resid 55 and name HG12
  )
       ( resid 55 and name HG11
  ) 3.4 1.6 0.7 volume=0.708 peak=1038 ppm1=1.327 ppm2=1.034

assign ( resid 51 and name HN
  )
       ( resid 49 and name HA
  ) 4.0 2.2 0.8 volume=0.272 peak=1650 ppm1=8.088 ppm2=3.974

assign ( resid 50 and name HA
  )
       ( resid 50 and name HN
  ) 4.1 2.3 0.8 volume=0.229 peak=390 ppm1=4.083 ppm2=7.333

assign ( resid 50 and name HD2
  )
       ( resid 34 and name HB2
  ) 6.0 4.2 0.0 volume=0.019 peak=1506 ppm1=7.068 ppm2=3.313

assign ( resid 55 and name HD1#
  )
       ( resid 55 and name HG11
  ) 4.5 2.7 0.9 volume=0.398 peak=530 ppm1=0.696 ppm2=1.013

assign ( resid 47 and name HA
  )
       ( resid 51 and name HN
  ) 6.0 4.2 0.0 volume=0.023 peak=1233 ppm1=2.934 ppm2=8.072

assign ( resid 50 and name HN
  )
       ( resid 48 and name HA
  ) 4.2 2.4 0.8 volume=0.182 peak=1581 ppm1=7.317 ppm2=3.629

assign ( resid 53 and name HA
  )
       ( resid 54 and name HN
  ) 5.1 3.3 0.9 volume=0.062 peak=754 ppm1=3.827 ppm2=7.078

assign ( resid 48 and name HA
  )
       ( resid 49 and name HN
  ) 6.0 4.2 0.0 volume=0.021 peak=1072 ppm1=3.670 ppm2=7.184

assign ( resid 50 and name HD2
  )
       ( resid 50 and name HB1
  ) 4.9 3.1 1.0 volume=0.076 peak=1501 ppm1=7.073 ppm2=2.799

assign ( resid 52 and name HN
  )
       ( resid 50 and name HA
  ) 4.8 3.0 1.0 volume=0.086 peak=1526 ppm1=6.870 ppm2=4.077

assign ( resid 47 and name HB1
  )
       ( resid 47 and name HA
  ) 5.2 3.4 0.8 volume=0.055 peak=714 ppm1=1.078 ppm2=2.925

assign ( resid 55 and name HB
  )
       ( resid 55 and name HG11
  ) 4.2 2.4 0.8 volume=0.200 peak=1120 ppm1=1.705 ppm2=0.979

assign ( resid 55 and name HG11
  )
       ( resid 55 and name HG2#
  ) 5.0 3.2 1.0 volume=0.205 peak=1329 ppm1=1.024 ppm2=0.784

assign ( resid 57 and name HN
  )
       ( resid 56 and name HB#
  ) 4.1 2.3 0.8 volume=0.671 peak=1574 ppm1=7.919 ppm2=1.205

assign ( resid 55 and name HD1#
  )
       ( resid 51 and name HA
  ) 6.0 4.2 0.0 volume=0.010 peak=670 ppm1=0.690 ppm2=3.643

assign ( resid 56 and name HB#
  )
       ( resid 56 and name HA
  ) 5.0 3.2 1.0 volume=0.205 peak=1214 ppm1=1.215 ppm2=4.181

assign ( resid 55 and name HN
  )
       ( resid 53 and name HN
  ) 4.4 2.6 0.9 volume=0.145 peak=1634 ppm1=7.217 ppm2=7.645

assign ( resid 50 and name HB2
  )
       ( resid 50 and name HN
  ) 5.1 3.3 0.9 volume=0.061 peak=701 ppm1=3.065 ppm2=7.327

assign ( resid 39 and name HB2
  or resid 39 and name HB1
  )
       ( resid 39 and name HG1
  or resid 39 and name HG2
  ) 4.1 2.3 0.8 volume=0.238 peak=1107 ppm1=1.281 ppm2=1.028

assign ( resid 47 and name HB2
  )
       ( resid 47 and name HN
  ) 5.7 3.9 0.3 volume=0.030 peak=498 ppm1=1.868 ppm2=6.899

assign ( resid 39 and name HG1
  or resid 39 and name HG2
  )
       ( resid 39 and name HB2
  or resid 39 and name HB1
  ) 3.6 1.8 0.7 volume=0.471 peak=790 ppm1=1.027 ppm2=1.293

assign ( resid 47 and name HB2
  )
       ( resid 48 and name HN
  ) 6.0 4.2 0.0 volume=0.022 peak=845 ppm1=1.868 ppm2=8.199

assign ( resid 39 and name HG1
  or resid 39 and name HG2
  )
       ( resid 39 and name HN
  ) 6.0 4.2 0.0 volume=0.007 peak=1411 ppm1=1.029 ppm2=8.157

assign ( resid 48 and name HN
  )
       ( resid 48 and name HG2
  or resid 48 and name HG1
  ) 3.9 2.1 0.8 volume=0.295 peak=1646 ppm1=8.173 ppm2=1.218

assign ( resid 55 and name HA
  )
       ( resid 56 and name HN
  ) 4.7 2.9 0.9 volume=0.095 peak=746 ppm1=3.886 ppm2=8.040

assign ( resid 50 and name HA
  )
       ( resid 53 and name HB
  ) 5.3 3.5 0.7 volume=0.047 peak=1103 ppm1=4.080 ppm2=1.526

assign ( resid 52 and name HN
  )
       ( resid 51 and name HA
  ) 4.3 2.5 0.9 volume=0.169 peak=1600 ppm1=6.871 ppm2=3.655

assign ( resid 48 and name HD1
  or resid 48 and name HD2
  )
       ( resid 48 and name HN
  ) 5.2 3.4 0.8 volume=0.052 peak=1441 ppm1=1.463 ppm2=8.190

assign ( resid 47 and name HB1
  )
       ( resid 48 and name HN
  ) 5.5 3.7 0.5 volume=0.040 peak=1416 ppm1=1.084 ppm2=8.199

assign ( resid 50 and name HB1
  )
       ( resid 51 and name HN
  ) 6.0 4.2 0.0 volume=0.023 peak=1473 ppm1=2.826 ppm2=8.085

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 50 and name HB1
  ) 4.5 2.7 0.9 volume=0.250 peak=1503 ppm1=6.716 ppm2=2.839

assign ( resid 53 and name HG11
  or resid 53 and name HG12
  )
       ( resid 50 and name HA
  ) 6.0 4.2 0.0 volume=0.022 peak=1492 ppm1=0.790 ppm2=4.057

assign ( resid 47 and name HN
  )
       ( resid 46 and name HA
  ) 4.6 2.8 0.9 volume=0.116 peak=1583 ppm1=6.853 ppm2=4.436

assign ( resid 53 and name HN
  )
       ( resid 51 and name HA
  ) 4.4 2.6 0.9 volume=0.158 peak=1638 ppm1=7.657 ppm2=3.668

assign ( resid 52 and name HG2
  or resid 52 and name HG1
  )
       ( resid 52 and name HE2
  or resid 52 and name HE1
  ) 4.2 2.4 0.8 volume=0.193 peak=749 ppm1=1.318 ppm2=2.851

assign ( resid 52 and name HB2
  or resid 52 and name HB1
  )
       ( resid 52 and name HD2
  or resid 52 and name HD1
  ) 2.7 0.9 0.5 volume=2.656 peak=935 ppm1=1.690 ppm2=1.569

assign ( resid 54 and name HD2
  )
       ( resid 54 and name HN
  ) 5.0 3.2 1.0 volume=0.072 peak=1512 ppm1=6.455 ppm2=7.111

assign ( resid 51 and name HG
  )
       ( resid 51 and name HB1
  ) 4.3 2.5 0.9 volume=0.172 peak=736 ppm1=1.136 ppm2=1.833

assign ( resid 51 and name HB1
  )
       ( resid 51 and name HA
  ) 4.5 2.7 0.9 volume=0.125 peak=496 ppm1=1.798 ppm2=3.680

assign ( resid 48 and name HN
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 3.0 1.2 0.6 volume=1.475 peak=1635 ppm1=8.175 ppm2=1.659

assign ( resid 55 and name HN
  )
       ( resid 55 and name HG12
  ) 3.4 1.6 0.7 volume=0.703 peak=1561 ppm1=7.227 ppm2=1.338

assign ( resid 54 and name HB1
  or resid 54 and name HB2
  )
       ( resid 54 and name HN
  ) 5.0 3.2 1.0 volume=0.066 peak=1068 ppm1=2.674 ppm2=7.108

assign ( resid 52 and name HB2
  or resid 52 and name HB1
  )
       ( resid 52 and name HA
  ) 4.1 2.3 0.8 volume=0.237 peak=1161 ppm1=1.690 ppm2=3.816

assign ( resid 48 and name HD1
  or resid 48 and name HD2
  )
       ( resid 49 and name HN
  ) 5.8 4.0 0.2 volume=0.028 peak=846 ppm1=1.463 ppm2=7.164

assign ( resid 45 and name HA1
  )
       ( resid 45 and name HA2
  ) 3.2 1.4 0.6 volume=0.949 peak=58 ppm1=3.748 ppm2=3.563

assign ( resid 55 and name HG12
  )
       ( resid 55 and name HG2#
  ) 4.2 2.4 0.8 volume=0.596 peak=414 ppm1=1.327 ppm2=0.774

assign ( resid 50 and name HD2
  )
       ( resid 50 and name HN
  ) 6.0 4.2 0.0 volume=0.011 peak=1500 ppm1=7.069 ppm2=7.321

assign ( resid 48 and name HA
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 3.8 2.0 0.8 volume=0.365 peak=338 ppm1=3.670 ppm2=1.694

assign ( resid 51 and name HA
  )
       ( resid 55 and name HN
  ) 6.0 4.2 0.0 volume=0.015 peak=368 ppm1=3.679 ppm2=7.248

assign ( resid 55 and name HN
  )
       ( resid 54 and name HB1
  or resid 54 and name HB2
  ) 4.1 2.3 0.8 volume=0.211 peak=1623 ppm1=7.226 ppm2=2.642

assign ( resid 51 and name HN
  )
       ( resid 50 and name HB1
  ) 3.7 1.9 0.7 volume=0.452 peak=1568 ppm1=8.088 ppm2=2.820

assign ( resid 51 and name HA
  )
       ( resid 51 and name HB1
  ) 5.3 3.5 0.7 volume=0.046 peak=600 ppm1=3.679 ppm2=1.828

assign ( resid 39 and name HD2
  or resid 39 and name HD1
  )
       ( resid 50 and name HE1
  ) 4.6 2.8 0.9 volume=0.109 peak=1381 ppm1=1.309 ppm2=7.868

assign ( resid 54 and name HN
  )
       ( resid 54 and name HA
  ) 4.3 2.5 0.9 volume=0.164 peak=1605 ppm1=7.094 ppm2=4.466

assign ( resid 57 and name HN
  )
       ( resid 56 and name HA
  ) 3.2 1.4 0.6 volume=1.001 peak=1548 ppm1=7.919 ppm2=4.196

assign ( resid 48 and name HA
  )
       ( resid 50 and name HN
  ) 6.0 4.2 0.0 volume=0.012 peak=1065 ppm1=3.691 ppm2=7.338

assign ( resid 51 and name HA
  )
       ( resid 51 and name HN
  ) 5.1 3.3 0.9 volume=0.064 peak=982 ppm1=3.679 ppm2=8.080

assign ( resid 51 and name HN
  )
       ( resid 50 and name HN
  ) 3.4 1.6 0.7 volume=0.639 peak=1588 ppm1=8.088 ppm2=7.320

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 45 and name HA2
  ) 4.2 2.4 0.8 volume=0.207 peak=216 ppm1=1.679 ppm2=3.561

assign ( resid 48 and name HN
  )
       ( resid 47 and name HN
  ) 3.9 2.1 0.8 volume=0.286 peak=1639 ppm1=8.176 ppm2=6.871

assign ( resid 50 and name HD2
  )
       ( resid 51 and name HN
  ) 6.0 4.2 0.0 volume=0.004 peak=1494 ppm1=7.069 ppm2=8.065

assign ( resid 55 and name HG12
  )
       ( resid 55 and name HN
  ) 5.1 3.3 0.9 volume=0.062 peak=48 ppm1=1.335 ppm2=7.294

assign ( resid 50 and name HN
  )
       ( resid 50 and name HB1
  ) 3.1 1.3 0.6 volume=1.185 peak=1549 ppm1=7.322 ppm2=2.813

assign ( resid 55 and name HG2#
  )
       ( resid 55 and name HG11
  ) 4.9 3.1 1.0 volume=0.228 peak=1190 ppm1=0.748 ppm2=1.010

assign ( resid 49 and name HB#
  )
       ( resid 49 and name HA
  ) 4.6 2.8 0.9 volume=0.347 peak=488 ppm1=1.292 ppm2=3.936

assign ( resid 53 and name HN
  )
       ( resid 52 and name HA
  ) 3.5 1.7 0.7 volume=0.628 peak=1585 ppm1=7.648 ppm2=3.794

assign ( resid 50 and name HB2
  )
       ( resid 53 and name HG2#
  ) 6.0 4.2 0.0 volume=0.014 peak=104 ppm1=3.062 ppm2=0.498

assign ( resid 47 and name HN
  )
       ( resid 47 and name HA
  ) 4.1 2.3 0.8 volume=0.222 peak=1557 ppm1=6.872 ppm2=2.956

assign ( resid 49 and name HN
  )
       ( resid 48 and name HN
  ) 3.8 2.0 0.8 volume=0.341 peak=1563 ppm1=7.189 ppm2=8.171

assign ( resid 51 and name HN
  )
       ( resid 51 and name HB2
  ) 3.7 1.9 0.7 volume=0.441 peak=1580 ppm1=8.088 ppm2=1.494

assign ( resid 53 and name HN
  )
       ( resid 49 and name HA
  ) 4.2 2.4 0.8 volume=0.201 peak=1620 ppm1=7.653 ppm2=3.938

assign ( resid 56 and name HN
  )
       ( resid 55 and name HA
  ) 3.6 1.8 0.7 volume=0.515 peak=1584 ppm1=8.003 ppm2=3.853

assign ( resid 48 and name HA
  )
       ( resid 51 and name HB2
  ) 4.4 2.6 0.9 volume=0.145 peak=1164 ppm1=3.670 ppm2=1.493

assign ( resid 53 and name HG11
  or resid 53 and name HG12
  )
       ( resid 53 and name HB
  ) 4.1 2.3 0.8 volume=0.232 peak=1014 ppm1=0.773 ppm2=1.554

assign ( resid 41 and name HZ
  )
       ( resid 41 and name HD1 or resid 41 and name HD2
  ) 6.0 4.2 0.0 volume=0.009 peak=1521 ppm1=6.143 ppm2=7.091

assign ( resid 50 and name HD2
  )
       ( resid 54 and name HD2
  ) 5.7 3.9 0.3 volume=0.033 peak=1498 ppm1=7.055 ppm2=6.457

assign ( resid 52 and name HD2
  or resid 52 and name HD1
  )
       ( resid 52 and name HG2
  or resid 52 and name HG1
  ) 2.7 0.9 0.5 volume=2.725 peak=1305 ppm1=1.545 ppm2=1.332

assign ( resid 54 and name HN
  )
       ( resid 53 and name HG2#
  ) 4.7 2.9 0.9 volume=0.287 peak=1579 ppm1=7.094 ppm2=0.460

assign ( resid 51 and name HB2
  )
       ( resid 51 and name HA
  ) 5.3 3.5 0.7 volume=0.048 peak=1081 ppm1=1.490 ppm2=3.680

assign ( resid 53 and name HN
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 3.6 1.8 0.7 volume=0.460 peak=1541 ppm1=7.644 ppm2=1.690

assign ( resid 55 and name HG12
  )
       ( resid 55 and name HB
  ) 3.2 1.4 0.6 volume=0.968 peak=292 ppm1=1.329 ppm2=1.697

assign ( resid 47 and name HA
  )
       ( resid 48 and name HN
  ) 5.9 4.1 0.1 volume=0.024 peak=291 ppm1=2.934 ppm2=8.179

assign ( resid 46 and name HB1
  or resid 46 and name HB2
  )
       ( resid 46 and name HN
  ) 4.1 2.3 0.8 volume=0.242 peak=663 ppm1=2.826 ppm2=6.991

assign ( resid 54 and name HD2
  )
       ( resid 50 and name HD2
  ) 4.9 3.1 1.0 volume=0.079 peak=1515 ppm1=6.452 ppm2=7.074

assign ( resid 49 and name HN
  )
       ( resid 49 and name HB#
  ) 3.6 1.8 0.7 volume=1.597 peak=1626 ppm1=7.187 ppm2=1.289

assign ( resid 52 and name HD2
  or resid 52 and name HD1
  )
       ( resid 55 and name HD1#
  ) 5.5 3.7 0.5 volume=0.112 peak=901 ppm1=1.552 ppm2=0.672

assign ( resid 39 and name HA
  )
       ( resid 40 and name HN
  ) 4.6 2.8 0.9 volume=0.114 peak=1195 ppm1=3.832 ppm2=7.597

assign ( resid 46 and name HN
  )
       ( resid 45 and name HN
  ) 4.4 2.6 0.9 volume=0.158 peak=1573 ppm1=6.992 ppm2=8.887

assign ( resid 50 and name HA
  )
       ( resid 54 and name HN
  ) 6.0 4.2 0.0 volume=0.022 peak=334 ppm1=4.091 ppm2=7.078

assign ( resid 51 and name HG
  )
       ( resid 51 and name HN
  ) 5.4 3.6 0.6 volume=0.045 peak=1471 ppm1=1.135 ppm2=8.089

assign ( resid 54 and name HN
  )
       ( resid 53 and name HN
  ) 4.0 2.2 0.8 volume=0.280 peak=1651 ppm1=7.094 ppm2=7.659

assign ( resid 50 and name HD2
  )
       ( resid 50 and name HB2
  ) 6.0 4.2 0.0 volume=0.007 peak=1495 ppm1=7.081 ppm2=3.029

assign ( resid 51 and name HB2
  )
       ( resid 51 and name HB1
  ) 4.3 2.5 0.9 volume=0.159 peak=1309 ppm1=1.490 ppm2=1.792

assign ( resid 55 and name HG2#
  )
       ( resid 55 and name HA
  ) 5.1 3.3 0.9 volume=0.175 peak=574 ppm1=0.748 ppm2=3.886

assign ( resid 55 and name HA
  )
       ( resid 55 and name HG11
  ) 4.7 2.9 0.9 volume=0.105 peak=694 ppm1=3.895 ppm2=1.019

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 41 and name HD1 or resid 41 and name HD2
  ) 3.7 1.9 0.7 volume=1.781 peak=1497 ppm1=6.715 ppm2=7.083

assign ( resid 52 and name HB2
  or resid 52 and name HB1
  )
       ( resid 53 and name HN
  ) 5.2 3.4 0.8 volume=0.052 peak=745 ppm1=1.691 ppm2=7.641

assign ( resid 47 and name HB1
  )
       ( resid 47 and name HB2
  ) 4.7 2.9 0.9 volume=0.097 peak=310 ppm1=1.082 ppm2=1.854

assign ( resid 45 and name HA2
  )
       ( resid 48 and name HN
  ) 6.0 4.2 0.0 volume=0.024 peak=624 ppm1=3.564 ppm2=8.154

assign ( resid 56 and name HA
  )
       ( resid 57 and name HN
  ) 4.8 3.0 1.0 volume=0.090 peak=1253 ppm1=4.194 ppm2=7.944

assign ( resid 51 and name HN
  )
       ( resid 51 and name HB1
  ) 3.1 1.3 0.6 volume=1.180 peak=1613 ppm1=8.088 ppm2=1.777

assign ( resid 46 and name HN
  )
       ( resid 46 and name HB1
  or resid 46 and name HB2
  ) 3.6 1.8 0.7 volume=0.482 peak=1567 ppm1=6.989 ppm2=2.778

assign ( resid 55 and name HB
  )
       ( resid 55 and name HG12
  ) 4.2 2.4 0.8 volume=0.198 peak=1117 ppm1=1.713 ppm2=1.329

assign ( resid 58 and name HA1
  )
       ( resid 58 and name HA2
  ) 3.9 2.1 0.8 volume=0.325 peak=77 ppm1=3.907 ppm2=3.995

assign ( resid 56 and name HB#
  )
       ( resid 56 and name HN
  ) 5.1 3.3 0.9 volume=0.173 peak=1472 ppm1=1.213 ppm2=7.971

assign ( resid 55 and name HG12
  )
       ( resid 55 and name HA
  ) 4.4 2.6 0.9 volume=0.139 peak=522 ppm1=1.327 ppm2=3.872

assign ( resid 58 and name HN
  )
       ( resid 57 and name HA
  ) 3.4 1.6 0.7 volume=0.665 peak=1628 ppm1=7.897 ppm2=4.439

assign ( resid 51 and name HB2
  )
       ( resid 48 and name HA
  ) 5.4 3.6 0.6 volume=0.042 peak=1204 ppm1=1.491 ppm2=3.649

assign ( resid 53 and name HN
  )
       ( resid 53 and name HG11
  or resid 53 and name HG12
  ) 3.5 1.7 0.7 volume=0.537 peak=1528 ppm1=7.650 ppm2=0.788

assign ( resid 53 and name HB
  )
       ( resid 50 and name HA
  ) 5.9 4.1 0.1 volume=0.024 peak=75 ppm1=1.572 ppm2=4.059

assign ( resid 50 and name HB1
  )
       ( resid 50 and name HA
  ) 4.9 3.1 1.0 volume=0.075 peak=579 ppm1=2.829 ppm2=4.084

assign ( resid 46 and name HN
  )
       ( resid 46 and name HA
  ) 3.7 1.9 0.7 volume=0.405 peak=1602 ppm1=6.993 ppm2=4.442

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 48 and name HA
  ) 4.2 2.4 0.8 volume=0.201 peak=418 ppm1=1.679 ppm2=3.670

assign ( resid 51 and name HG
  )
       ( resid 51 and name HA
  ) 4.5 2.7 0.9 volume=0.131 peak=1370 ppm1=1.136 ppm2=3.674

assign ( resid 48 and name HG2
  or resid 48 and name HG1
  )
       ( resid 48 and name HD1
  or resid 48 and name HD2
  ) 2.8 1.0 0.6 volume=2.301 peak=619 ppm1=1.225 ppm2=1.448

assign ( resid 53 and name HN
  )
       ( resid 53 and name HB
  ) 3.4 1.6 0.7 volume=0.744 peak=1562 ppm1=7.651 ppm2=1.561

assign ( resid 50 and name HN
  )
       ( resid 49 and name HB#
  ) 3.8 2.0 0.8 volume=1.060 peak=1536 ppm1=7.320 ppm2=1.288

assign ( resid 51 and name HG
  )
       ( resid 50 and name HB1
  ) 4.4 2.6 0.9 volume=0.147 peak=798 ppm1=1.143 ppm2=2.854

assign ( resid 55 and name HN
  )
       ( resid 55 and name HG11
  ) 4.1 2.3 0.8 volume=0.216 peak=1552 ppm1=7.244 ppm2=1.017

assign ( resid 45 and name HA1
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 4.4 2.6 0.9 volume=0.141 peak=1102 ppm1=3.773 ppm2=1.700

assign ( resid 53 and name HA
  )
       ( resid 55 and name HN
  ) 5.2 3.4 0.8 volume=0.052 peak=295 ppm1=3.836 ppm2=7.265

assign ( resid 50 and name HN
  )
       ( resid 46 and name HA
  ) 3.9 2.1 0.8 volume=0.290 peak=1578 ppm1=7.304 ppm2=4.446

assign ( resid 55 and name HG2#
  )
       ( resid 56 and name HN
  ) 5.8 4.0 0.2 volume=0.082 peak=1375 ppm1=0.748 ppm2=8.000

assign ( resid 45 and name HN
  )
       ( resid 45 and name HA1
  ) 4.0 2.2 0.8 volume=0.250 peak=1622 ppm1=8.875 ppm2=3.769

assign ( resid 49 and name HN
  )
       ( resid 48 and name HA
  ) 4.1 2.3 0.8 volume=0.236 peak=1556 ppm1=7.183 ppm2=3.662

assign ( resid 55 and name HB
  )
       ( resid 55 and name HA
  ) 4.1 2.3 0.8 volume=0.232 peak=1036 ppm1=1.711 ppm2=3.905

assign ( resid 45 and name HA1
  )
       ( resid 48 and name HD1
  or resid 48 and name HD2
  ) 4.8 3.0 1.0 volume=0.085 peak=211 ppm1=3.780 ppm2=1.480

assign ( resid 50 and name HB2
  )
       ( resid 50 and name HD2
  ) 5.5 3.7 0.5 volume=0.040 peak=153 ppm1=3.040 ppm2=7.089

assign ( resid 39 and name HD2
  or resid 39 and name HD1
  )
       ( resid 39 and name HG1
  or resid 39 and name HG2
  ) 3.6 1.8 0.7 volume=0.488 peak=23 ppm1=1.306 ppm2=1.035

assign ( resid 39 and name HB2
  or resid 39 and name HB1
  )
       ( resid 39 and name HA
  ) 5.3 3.5 0.7 volume=0.046 peak=1365 ppm1=1.279 ppm2=3.832

assign ( resid 55 and name HB
  )
       ( resid 55 and name HD1#
  ) 4.1 2.3 0.8 volume=0.691 peak=925 ppm1=1.717 ppm2=0.723

assign ( resid 40 and name HN
  )
       ( resid 39 and name HA
  ) 3.1 1.3 0.6 volume=1.229 peak=1587 ppm1=7.594 ppm2=3.787

assign ( resid 48 and name HG2
  or resid 48 and name HG1
  )
       ( resid 48 and name HE1
  or resid 48 and name HE2
  ) 4.0 2.2 0.8 volume=0.258 peak=1208 ppm1=1.225 ppm2=2.736

assign ( resid 52 and name HA
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 3.3 1.5 0.7 volume=0.768 peak=231 ppm1=3.837 ppm2=1.673

assign ( resid 48 and name HD1
  or resid 48 and name HD2
  )
       ( resid 48 and name HG2
  or resid 48 and name HG1
  ) 3.0 1.2 0.6 volume=1.497 peak=1055 ppm1=1.463 ppm2=1.226

assign ( resid 39 and name HB2
  or resid 39 and name HB1
  )
       ( resid 39 and name HN
  ) 5.6 3.8 0.4 volume=0.035 peak=891 ppm1=1.276 ppm2=8.130

assign ( resid 52 and name HG2
  or resid 52 and name HG1
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 3.6 1.8 0.7 volume=0.484 peak=307 ppm1=1.318 ppm2=1.698

assign ( resid 39 and name HA
  )
       ( resid 39 and name HN
  ) 4.9 3.1 1.0 volume=0.080 peak=142 ppm1=3.829 ppm2=8.156

assign ( resid 47 and name HB2
  )
       ( resid 47 and name HG
  ) 4.8 3.0 1.0 volume=0.092 peak=1345 ppm1=1.869 ppm2=1.352

assign ( resid 50 and name HN
  )
       ( resid 51 and name HN
  ) 3.3 1.5 0.7 volume=0.768 peak=1577 ppm1=7.323 ppm2=8.077

assign ( resid 55 and name HN
  )
       ( resid 54 and name HN
  ) 4.1 2.3 0.8 volume=0.222 peak=1607 ppm1=7.215 ppm2=7.091

assign ( resid 52 and name HD2
  or resid 52 and name HD1
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 3.2 1.4 0.6 volume=0.949 peak=1288 ppm1=1.545 ppm2=1.698

assign ( resid 53 and name HA
  )
       ( resid 53 and name HG11
  or resid 53 and name HG12
  ) 4.2 2.4 0.8 volume=0.193 peak=1061 ppm1=3.827 ppm2=0.788

assign ( resid 50 and name HD2
  )
       ( resid 50 and name HE1
  ) 6.0 4.2 0.0 volume=0.012 peak=1522 ppm1=7.069 ppm2=7.881

assign ( resid 52 and name HA
  )
       ( resid 52 and name HD2
  or resid 52 and name HD1
  ) 3.8 2.0 0.8 volume=0.355 peak=821 ppm1=3.839 ppm2=1.587

assign ( resid 51 and name HN
  )
       ( resid 51 and name HG
  ) 3.8 2.0 0.8 volume=0.373 peak=1608 ppm1=8.088 ppm2=1.134

assign ( resid 47 and name HN
  )
       ( resid 45 and name HA2
  ) 5.3 3.5 0.7 volume=0.046 peak=1648 ppm1=6.862 ppm2=3.581

assign ( resid 55 and name HG11
  )
       ( resid 55 and name HA
  ) 4.2 2.4 0.8 volume=0.194 peak=777 ppm1=1.020 ppm2=3.876

assign ( resid 56 and name HN
  )
       ( resid 55 and name HN
  ) 4.3 2.5 0.9 volume=0.159 peak=1564 ppm1=8.008 ppm2=7.265

assign ( resid 55 and name HG2#
  )
       ( resid 55 and name HB
  ) 4.2 2.4 0.8 volume=0.566 peak=832 ppm1=0.748 ppm2=1.707

assign ( resid 52 and name HN
  )
       ( resid 51 and name HN
  ) 3.9 2.1 0.8 volume=0.323 peak=1595 ppm1=6.877 ppm2=8.087

assign ( resid 55 and name HA
  )
       ( resid 55 and name HD1#
  ) 4.8 3.0 1.0 volume=0.261 peak=678 ppm1=3.879 ppm2=0.705

assign ( resid 52 and name HG2
  or resid 52 and name HG1
  )
       ( resid 52 and name HD2
  or resid 52 and name HD1
  ) 2.6 0.8 0.5 volume=3.386 peak=110 ppm1=1.318 ppm2=1.542

assign ( resid 48 and name HN
  )
       ( resid 49 and name HN
  ) 3.9 2.1 0.8 volume=0.294 peak=1544 ppm1=8.181 ppm2=7.191

assign ( resid 51 and name HB2
  )
       ( resid 51 and name HG
  ) 5.0 3.2 1.0 volume=0.067 peak=884 ppm1=1.479 ppm2=1.131

assign ( resid 50 and name HN
  )
       ( resid 49 and name HA
  ) 3.8 2.0 0.8 volume=0.347 peak=1570 ppm1=7.323 ppm2=3.937

assign ( resid 56 and name HN
  )
       ( resid 56 and name HB#
  ) 4.2 2.4 0.8 volume=0.593 peak=1625 ppm1=7.999 ppm2=1.215

assign ( resid 46 and name HN
  )
       ( resid 45 and name HA2
  ) 4.0 2.2 0.8 volume=0.249 peak=1560 ppm1=6.985 ppm2=3.554

assign ( resid 56 and name HB#
  )
       ( resid 55 and name HA
  ) 6.0 4.2 0.0 volume=0.038 peak=270 ppm1=1.212 ppm2=3.844

assign ( resid 45 and name HA2
  )
       ( resid 45 and name HN
  ) 6.0 4.2 0.0 volume=0.014 peak=801 ppm1=3.564 ppm2=8.845

assign ( resid 50 and name HB1
  )
       ( resid 50 and name HN
  ) 4.5 2.7 0.9 volume=0.130 peak=1187 ppm1=2.829 ppm2=7.338

assign ( resid 58 and name HA1
  )
       ( resid 58 and name HN
  ) 4.9 3.1 1.0 volume=0.080 peak=847 ppm1=3.909 ppm2=7.918

assign ( resid 53 and name HG11
  or resid 53 and name HG12
  )
       ( resid 53 and name HA
  ) 5.3 3.5 0.7 volume=0.048 peak=1296 ppm1=0.790 ppm2=3.859

assign ( resid 42 and name HA
  )
       ( resid 42 and name HB2
  or resid 42 and name HB1
  ) 4.8 3.0 1.0 volume=0.088 peak=991 ppm1=4.186 ppm2=2.130

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 39 and name HD2
  or resid 39 and name HD1
  ) 4.4 2.6 0.9 volume=0.299 peak=1519 ppm1=6.713 ppm2=1.301

assign ( resid 48 and name HG2
  or resid 48 and name HG1
  )
       ( resid 48 and name HN
  ) 4.9 3.1 1.0 volume=0.077 peak=135 ppm1=1.228 ppm2=8.183

assign ( resid 52 and name HA
  )
       ( resid 52 and name HG2
  or resid 52 and name HG1
  ) 3.4 1.6 0.7 volume=0.650 peak=1223 ppm1=3.837 ppm2=1.339

assign ( resid 50 and name HD2
  )
       ( resid 41 and name HE1 or resid 41 and name HE2
  ) 5.7 3.9 0.3 volume=0.062 peak=1518 ppm1=7.058 ppm2=6.714

assign ( resid 48 and name HN
  )
       ( resid 45 and name HA2
  ) 3.9 2.1 0.8 volume=0.291 peak=1530 ppm1=8.176 ppm2=3.553

assign ( resid 53 and name HB
  )
       ( resid 53 and name HG2#
  ) 3.8 2.0 0.8 volume=1.075 peak=501 ppm1=1.566 ppm2=0.499

assign ( resid 53 and name HB
  )
       ( resid 53 and name HG11
  or resid 53 and name HG12
  ) 4.1 2.3 0.8 volume=0.239 peak=1394 ppm1=1.569 ppm2=0.785


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS  30           HT1      LYS  30 -13.427   2.681   4.465
    2    H2   LYS  30           HT2      LYS  30 -12.744   1.791   5.732
    3    H3   LYS  30           HT3      LYS  30 -13.209   1.003   4.300
    4    HA   LYS  30           HA       LYS  30 -10.844   1.250   4.323
    5    HB2  LYS  30           HB2      LYS  30 -12.053   1.507   2.175
    6    HB3  LYS  30           HB1      LYS  30 -12.154   3.238   2.454
    7    HG2  LYS  30           HG2      LYS  30  -9.753   3.445   2.295
    8    HG3  LYS  30           HG1      LYS  30  -9.586   1.695   2.135
    9    HD2  LYS  30           HD2      LYS  30  -9.433   2.829  -0.036
   10    HD3  LYS  30           HD1      LYS  30 -10.828   1.751   0.041
   11    HE2  LYS  30           HE2      LYS  30 -12.219   3.753   0.636
   12    HE3  LYS  30           HE1      LYS  30 -10.807   4.755   0.299
   13    HZ1  LYS  30           HZ1      LYS  30 -12.139   2.942  -1.640
   14    HZ2  LYS  30           HZ2      LYS  30 -10.800   3.932  -1.965
   15    HZ3  LYS  30           HZ3      LYS  30 -12.299   4.630  -1.595
   16    H    GLU  31           HN       GLU  31  -9.927   2.116   6.141
   17    HA   GLU  31           HA       GLU  31 -10.291   4.965   6.675
   18    HB2  GLU  31           HB2      GLU  31  -9.253   2.692   8.364
   19    HB3  GLU  31           HB1      GLU  31  -9.205   4.368   8.885
   20    HG2  GLU  31           HG2      GLU  31 -11.097   3.334   9.881
   21    HG3  GLU  31           HG1      GLU  31 -11.680   4.450   8.648
   22    H    HIS  32           HN       HIS  32  -7.849   2.727   5.657
   23    HA   HIS  32           HA       HIS  32  -5.799   4.764   6.146
   24    HB2  HIS  32           HB2      HIS  32  -5.686   1.794   6.038
   25    HB3  HIS  32           HB1      HIS  32  -4.268   2.695   5.510
   26    HD1  HIS  32           HD1      HIS  32  -2.957   4.028   7.296
   27    HD2  HIS  32           HD2      HIS  32  -6.214   1.909   8.790
   28    HE1  HIS  32           HE1      HIS  32  -2.686   4.029   9.795
   29    HE2  HIS  32           HE2      HIS  32  -4.765   2.918  10.685
   30    H    LYS  33           HN       LYS  33  -4.737   5.705   4.609
   31    HA   LYS  33           HA       LYS  33  -4.615   4.512   1.934
   32    HB2  LYS  33           HB2      LYS  33  -6.315   6.247   1.753
   33    HB3  LYS  33           HB1      LYS  33  -5.271   7.404   2.574
   34    HG2  LYS  33           HG2      LYS  33  -3.676   7.219   0.676
   35    HG3  LYS  33           HG1      LYS  33  -4.844   6.188  -0.147
   36    HD2  LYS  33           HD2      LYS  33  -6.470   7.991  -0.153
   37    HD3  LYS  33           HD1      LYS  33  -5.358   9.024   0.744
   38    HE2  LYS  33           HE2      LYS  33  -4.828   7.878  -1.995
   39    HE3  LYS  33           HE1      LYS  33  -5.412   9.511  -1.684
   40    HZ1  LYS  33           HZ1      LYS  33  -3.048   9.531  -2.028
   41    HZ2  LYS  33           HZ2      LYS  33  -2.802   8.383  -0.811
   42    HZ3  LYS  33           HZ3      LYS  33  -3.368   9.930  -0.415
   43    H    CYS  34           HN       CYS  34  -2.610   4.828   0.938
   44    HA   CYS  34           HA       CYS  34  -0.453   5.694   2.584
   45    HB2  CYS  34           HB2      CYS  34  -0.095   3.980   0.857
   46    HB3  CYS  34           HB1      CYS  34  -0.485   5.157  -0.398
   47    HA   PRO  35           HA       PRO  35  -0.964   9.997   1.789
   48    HB2  PRO  35           HB2      PRO  35   1.690  10.347   2.958
   49    HB3  PRO  35           HB1      PRO  35   0.117  10.855   3.579
   50    HG2  PRO  35           HG2      PRO  35   1.551   8.867   4.719
   51    HG3  PRO  35           HG1      PRO  35  -0.223   8.879   4.708
   52    HD2  PRO  35           HD2      PRO  35   1.676   7.369   2.949
   53    HD3  PRO  35           HD1      PRO  35   0.166   6.818   3.712
   54    H    HIS  36           HN       HIS  36   2.077   8.379   0.927
   55    HA   HIS  36           HA       HIS  36   2.931  10.603  -0.700
   56    HB2  HIS  36           HB2      HIS  36   4.534   9.151   0.542
   57    HB3  HIS  36           HB1      HIS  36   4.122   7.826  -0.541
   58    HD1  HIS  36           HD1      HIS  36   5.639   7.593  -2.507
   59    HD2  HIS  36           HD2      HIS  36   5.625  11.466  -0.994
   60    HE1  HIS  36           HE1      HIS  36   7.346   8.847  -3.849
   61    HE2  HIS  36           HE2      HIS  36   7.462  11.127  -2.784
   62    H    CYS  37           HN       CYS  37   1.365   7.510  -1.242
   63    HA   CYS  37           HA       CYS  37   1.568   7.943  -4.146
   64    HB2  CYS  37           HB2      CYS  37   0.701   5.376  -2.835
   65    HB3  CYS  37           HB1      CYS  37   1.322   5.619  -4.466
   66    H    ASP  38           HN       ASP  38  -0.278   7.928  -5.431
   67    HA   ASP  38           HA       ASP  38  -2.789   8.228  -3.918
   68    HB2  ASP  38           HB2      ASP  38  -2.041  10.296  -5.034
   69    HB3  ASP  38           HB1      ASP  38  -2.058   9.456  -6.582
   70    H    LYS  39           HN       LYS  39  -1.192   6.400  -6.340
   71    HA   LYS  39           HA       LYS  39  -3.348   5.712  -7.989
   72    HB2  LYS  39           HB2      LYS  39  -2.011   3.953  -8.868
   73    HB3  LYS  39           HB1      LYS  39  -0.939   5.296  -8.513
   74    HG2  LYS  39           HG2      LYS  39  -0.154   4.182  -6.512
   75    HG3  LYS  39           HG1      LYS  39  -1.287   2.852  -6.787
   76    HD2  LYS  39           HD2      LYS  39  -0.171   2.500  -9.010
   77    HD3  LYS  39           HD1      LYS  39   1.051   3.667  -8.510
   78    HE2  LYS  39           HE2      LYS  39   1.645   2.252  -6.622
   79    HE3  LYS  39           HE1      LYS  39   0.385   1.101  -7.075
   80    HZ1  LYS  39           HZ1      LYS  39   2.477   0.313  -7.885
   81    HZ2  LYS  39           HZ2      LYS  39   2.812   1.790  -8.644
   82    HZ3  LYS  39           HZ3      LYS  39   1.556   0.810  -9.220
   83    H    LYS  40           HN       LYS  40  -4.652   3.866  -8.116
   84    HA   LYS  40           HA       LYS  40  -5.266   2.820  -5.428
   85    HB2  LYS  40           HB2      LYS  40  -7.341   3.243  -7.554
   86    HB3  LYS  40           HB1      LYS  40  -7.550   3.157  -5.808
   87    HG2  LYS  40           HG2      LYS  40  -6.371   5.321  -5.598
   88    HG3  LYS  40           HG1      LYS  40  -6.278   5.407  -7.356
   89    HD2  LYS  40           HD2      LYS  40  -8.826   5.181  -7.314
   90    HD3  LYS  40           HD1      LYS  40  -8.700   5.553  -5.590
   91    HE2  LYS  40           HE2      LYS  40  -7.848   7.266  -7.916
   92    HE3  LYS  40           HE1      LYS  40  -9.107   7.608  -6.732
   93    HZ1  LYS  40           HZ1      LYS  40  -7.089   8.868  -6.294
   94    HZ2  LYS  40           HZ2      LYS  40  -6.197   7.435  -6.147
   95    HZ3  LYS  40           HZ3      LYS  40  -7.413   7.794  -5.021
   96    H    PHE  41           HN       PHE  41  -6.137   0.760  -5.269
   97    HA   PHE  41           HA       PHE  41  -6.541  -0.987  -7.463
   98    HB2  PHE  41           HB2      PHE  41  -4.624  -2.561  -6.784
   99    HB3  PHE  41           HB1      PHE  41  -4.190  -1.140  -7.726
  100    HD1  PHE  41           HD1      PHE  41  -4.380  -2.375  -4.215
  101    HD2  PHE  41           HD2      PHE  41  -2.526   0.283  -6.975
  102    HE1  PHE  41           HE1      PHE  41  -2.753  -1.725  -2.490
  103    HE2  PHE  41           HE2      PHE  41  -0.898   0.937  -5.252
  104    HZ   PHE  41           HZ       PHE  41  -1.013  -0.065  -3.008
  105    H    ASN  42           HN       ASN  42  -6.498  -3.408  -6.426
  106    HA   ASN  42           HA       ASN  42  -8.358  -3.255  -4.250
  107    HB2  ASN  42           HB2      ASN  42  -8.490  -5.692  -4.396
  108    HB3  ASN  42           HB1      ASN  42  -8.645  -4.962  -5.986
  109   HD21  ASN  42          HD21      ASN  42  -7.883  -7.648  -5.167
  110   HD22  ASN  42          HD22      ASN  42  -6.328  -7.946  -5.880
  111    H    GLN  43           HN       GLN  43  -8.105  -4.107  -2.154
  112    HA   GLN  43           HA       GLN  43  -5.460  -3.399  -1.187
  113    HB2  GLN  43           HB2      GLN  43  -8.024  -3.836   0.344
  114    HB3  GLN  43           HB1      GLN  43  -6.527  -3.193   1.004
  115    HG2  GLN  43           HG2      GLN  43  -7.847  -1.315   0.653
  116    HG3  GLN  43           HG1      GLN  43  -6.765  -1.338  -0.737
  117   HE21  GLN  43          HE21      GLN  43  -8.134  -0.159  -2.044
  118   HE22  GLN  43          HE22      GLN  43  -9.621  -0.795  -2.669
  119    H    VAL  44           HN       VAL  44  -6.396  -6.220  -2.208
  120    HA   VAL  44           HA       VAL  44  -6.094  -7.816   0.187
  121    HB   VAL  44           HB       VAL  44  -6.324  -8.730  -2.684
  122   HG11  VAL  44          HG11      VAL  44  -5.350 -10.449  -1.286
  123   HG12  VAL  44          HG12      VAL  44  -7.014 -10.883  -1.675
  124   HG13  VAL  44          HG13      VAL  44  -6.620 -10.232  -0.083
  125   HG21  VAL  44          HG21      VAL  44  -8.280  -7.457  -2.006
  126   HG22  VAL  44          HG22      VAL  44  -8.438  -8.440  -0.551
  127   HG23  VAL  44          HG23      VAL  44  -8.678  -9.170  -2.138
  128    H    GLY  45           HN       GLY  45  -4.416  -8.062  -2.974
  129    HA2  GLY  45           HA2      GLY  45  -2.111  -9.176  -1.556
  130    HA3  GLY  45           HA1      GLY  45  -2.375  -9.202  -3.299
  131    H    ASN  46           HN       ASN  46  -2.731  -6.667  -3.967
  132    HA   ASN  46           HA       ASN  46  -0.116  -5.739  -4.203
  133    HB2  ASN  46           HB2      ASN  46  -2.769  -4.410  -4.714
  134    HB3  ASN  46           HB1      ASN  46  -1.238  -3.616  -5.065
  135   HD21  ASN  46          HD21      ASN  46  -3.489  -4.613  -6.760
  136   HD22  ASN  46          HD22      ASN  46  -2.727  -5.596  -7.956
  137    H    LEU  47           HN       LEU  47  -2.628  -4.832  -1.904
  138    HA   LEU  47           HA       LEU  47  -1.315  -2.514  -0.939
  139    HB2  LEU  47           HB2      LEU  47  -3.721  -2.951  -0.598
  140    HB3  LEU  47           HB1      LEU  47  -3.310  -4.267   0.499
  141    HG   LEU  47           HG       LEU  47  -2.173  -2.608   1.974
  142   HD11  LEU  47          HD11      LEU  47  -2.645  -0.227   1.641
  143   HD12  LEU  47          HD12      LEU  47  -3.412  -0.599   0.097
  144   HD13  LEU  47          HD13      LEU  47  -1.689  -0.898   0.319
  145   HD21  LEU  47          HD21      LEU  47  -4.449  -3.344   2.433
  146   HD22  LEU  47          HD22      LEU  47  -5.081  -2.065   1.397
  147   HD23  LEU  47          HD23      LEU  47  -4.228  -1.654   2.883
  148    H    LYS  48           HN       LYS  48  -1.175  -5.917  -0.052
  149    HA   LYS  48           HA       LYS  48   0.307  -5.681   2.316
  150    HB2  LYS  48           HB2      LYS  48   0.470  -7.846   0.210
  151    HB3  LYS  48           HB1      LYS  48   1.124  -7.962   1.835
  152    HG2  LYS  48           HG2      LYS  48  -1.141  -7.773   2.750
  153    HG3  LYS  48           HG1      LYS  48  -1.784  -7.703   1.109
  154    HD2  LYS  48           HD2      LYS  48  -0.194  -9.980   2.277
  155    HD3  LYS  48           HD1      LYS  48  -1.943  -9.965   2.042
  156    HE2  LYS  48           HE2      LYS  48  -1.614  -9.728  -0.370
  157    HE3  LYS  48           HE1      LYS  48   0.131  -9.722  -0.134
  158    HZ1  LYS  48           HZ1      LYS  48  -0.648 -11.887  -0.832
  159    HZ2  LYS  48           HZ2      LYS  48  -1.696 -11.980   0.500
  160    HZ3  LYS  48           HZ3      LYS  48  -0.019 -11.975   0.740
  161    H    ALA  49           HN       ALA  49   1.362  -6.109  -1.030
  162    HA   ALA  49           HA       ALA  49   4.120  -5.870  -0.552
  163    HB1  ALA  49           HB1      ALA  49   2.602  -5.161  -3.061
  164    HB2  ALA  49           HB2      ALA  49   3.172  -6.772  -2.626
  165    HB3  ALA  49           HB3      ALA  49   4.332  -5.483  -2.940
  166    H    HIS  50           HN       HIS  50   1.665  -3.454  -1.371
  167    HA   HIS  50           HA       HIS  50   3.317  -1.247  -1.762
  168    HB2  HIS  50           HB2      HIS  50   0.818  -1.439  -2.188
  169    HB3  HIS  50           HB1      HIS  50   0.591  -1.141  -0.462
  170    HD1  HIS  50           HD1      HIS  50   0.700   0.597  -3.594
  171    HD2  HIS  50           HD2      HIS  50   1.855   1.463   0.302
  172    HE1  HIS  50           HE1      HIS  50   0.856   3.111  -3.449
  173    H    LEU  51           HN       LEU  51   1.721  -2.311   1.248
  174    HA   LEU  51           HA       LEU  51   2.889  -0.273   2.848
  175    HB2  LEU  51           HB2      LEU  51   1.737  -2.951   3.654
  176    HB3  LEU  51           HB1      LEU  51   2.135  -1.642   4.764
  177    HG   LEU  51           HG       LEU  51   0.017  -1.548   2.606
  178   HD11  LEU  51          HD11      LEU  51  -0.189  -1.690   5.608
  179   HD12  LEU  51          HD12      LEU  51  -0.629  -2.958   4.466
  180   HD13  LEU  51          HD13      LEU  51  -1.540  -1.447   4.503
  181   HD21  LEU  51          HD21      LEU  51   0.795   0.510   4.673
  182   HD22  LEU  51          HD22      LEU  51  -0.585   0.618   3.582
  183   HD23  LEU  51          HD23      LEU  51   1.055   0.638   2.934
  184    H    LYS  52           HN       LYS  52   3.843  -3.502   1.938
  185    HA   LYS  52           HA       LYS  52   5.880  -3.819   3.883
  186    HB2  LYS  52           HB2      LYS  52   4.767  -5.691   2.656
  187    HB3  LYS  52           HB1      LYS  52   5.642  -5.206   1.210
  188    HG2  LYS  52           HG2      LYS  52   7.753  -5.696   2.272
  189    HG3  LYS  52           HG1      LYS  52   6.934  -6.067   3.791
  190    HD2  LYS  52           HD2      LYS  52   5.713  -7.891   2.615
  191    HD3  LYS  52           HD1      LYS  52   6.698  -7.568   1.185
  192    HE2  LYS  52           HE2      LYS  52   8.717  -8.095   2.429
  193    HE3  LYS  52           HE1      LYS  52   7.771  -8.333   3.899
  194    HZ1  LYS  52           HZ1      LYS  52   7.613  -9.970   1.423
  195    HZ2  LYS  52           HZ2      LYS  52   6.622 -10.172   2.783
  196    HZ3  LYS  52           HZ3      LYS  52   8.290 -10.441   2.905
  197    H    ILE  53           HN       ILE  53   5.876  -2.639   0.526
  198    HA   ILE  53           HA       ILE  53   8.735  -2.421   0.422
  199    HB   ILE  53           HB       ILE  53   8.449  -1.202  -1.668
  200   HG12  ILE  53          HG12      ILE  53   5.479  -1.378  -1.120
  201   HG13  ILE  53          HG11      ILE  53   6.439   0.094  -1.022
  202   HG21  ILE  53          HG21      ILE  53   7.306  -2.961  -2.942
  203   HG22  ILE  53          HG22      ILE  53   6.657  -3.613  -1.436
  204   HG23  ILE  53          HG23      ILE  53   8.399  -3.622  -1.723
  205   HD11  ILE  53          HD11      ILE  53   6.929  -0.071  -3.408
  206   HD12  ILE  53          HD12      ILE  53   5.194  -0.010  -3.099
  207   HD13  ILE  53          HD13      ILE  53   5.964  -1.543  -3.505
  208    H    HIS  54           HN       HIS  54   6.293  -0.509   1.816
  209    HA   HIS  54           HA       HIS  54   7.898   1.905   1.823
  210    HB2  HIS  54           HB2      HIS  54   5.204   1.160   2.833
  211    HB3  HIS  54           HB1      HIS  54   6.039   2.464   3.669
  212    HD1  HIS  54           HD1      HIS  54   6.179   4.718   2.480
  213    HD2  HIS  54           HD2      HIS  54   4.556   1.700   0.129
  214    HE1  HIS  54           HE1      HIS  54   5.177   5.854   0.450
  215    H    ILE  55           HN       ILE  55   7.644  -0.963   3.649
  216    HA   ILE  55           HA       ILE  55   9.016   0.236   5.945
  217    HB   ILE  55           HB       ILE  55   7.962  -2.573   5.529
  218   HG12  ILE  55          HG12      ILE  55   6.935  -0.330   7.285
  219   HG13  ILE  55          HG11      ILE  55   6.209  -0.842   5.761
  220   HG21  ILE  55          HG21      ILE  55   9.898  -2.574   7.000
  221   HG22  ILE  55          HG22      ILE  55   8.425  -2.914   7.907
  222   HG23  ILE  55          HG23      ILE  55   9.163  -1.314   7.992
  223   HD11  ILE  55          HD11      ILE  55   5.747  -3.036   6.731
  224   HD12  ILE  55          HD12      ILE  55   4.994  -1.740   7.658
  225   HD13  ILE  55          HD13      ILE  55   6.463  -2.512   8.255
  226    H    ALA  56           HN       ALA  56   9.362  -2.582   3.810
  227    HA   ALA  56           HA       ALA  56  12.285  -2.327   4.002
  228    HB1  ALA  56           HB1      ALA  56  12.344  -4.609   3.065
  229    HB2  ALA  56           HB2      ALA  56  10.581  -4.634   3.058
  230    HB3  ALA  56           HB3      ALA  56  11.457  -4.532   4.587
  231    H    ASP  57           HN       ASP  57  13.343  -1.463   2.264
  232    HA   ASP  57           HA       ASP  57  11.888  -0.632  -0.022
  233    HB2  ASP  57           HB2      ASP  57  14.060   0.002  -0.992
  234    HB3  ASP  57           HB1      ASP  57  13.905   0.569   0.665
  235    H    GLY  58           HN       GLY  58  11.051  -1.937  -1.442
  236    HA2  GLY  58           HA2      GLY  58  12.635  -4.181  -2.464
  237    HA3  GLY  58           HA1      GLY  58  11.027  -4.498  -1.804
  Start of MODEL    2
    1    H1   LYS  30           HT1      LYS  30 -11.901   2.578   5.785
    2    H2   LYS  30           HT2      LYS  30 -12.575   3.441   4.490
    3    H3   LYS  30           HT3      LYS  30 -11.603   4.239   5.629
    4    HA   LYS  30           HA       LYS  30 -10.715   2.154   3.724
    5    HB2  LYS  30           HB2      LYS  30 -11.196   4.525   2.874
    6    HB3  LYS  30           HB1      LYS  30  -9.849   5.041   3.878
    7    HG2  LYS  30           HG2      LYS  30  -9.096   4.758   1.619
    8    HG3  LYS  30           HG1      LYS  30  -8.372   3.506   2.631
    9    HD2  LYS  30           HD2      LYS  30  -9.156   2.606   0.486
   10    HD3  LYS  30           HD1      LYS  30 -10.021   1.892   1.850
   11    HE2  LYS  30           HE2      LYS  30 -11.858   3.519   1.461
   12    HE3  LYS  30           HE1      LYS  30 -11.005   4.087   0.027
   13    HZ1  LYS  30           HZ1      LYS  30 -11.246   1.960  -0.990
   14    HZ2  LYS  30           HZ2      LYS  30 -12.775   2.437  -0.427
   15    HZ3  LYS  30           HZ3      LYS  30 -11.880   1.279   0.427
   16    H    GLU  31           HN       GLU  31  -9.317   0.898   4.762
   17    HA   GLU  31           HA       GLU  31  -7.638   2.109   6.857
   18    HB2  GLU  31           HB2      GLU  31  -7.574  -0.058   7.938
   19    HB3  GLU  31           HB1      GLU  31  -9.242   0.411   7.662
   20    HG2  GLU  31           HG2      GLU  31  -7.663  -1.569   6.032
   21    HG3  GLU  31           HG1      GLU  31  -8.901  -1.952   7.224
   22    H    HIS  32           HN       HIS  32  -7.538   0.995   3.767
   23    HA   HIS  32           HA       HIS  32  -4.658   0.398   3.965
   24    HB2  HIS  32           HB2      HIS  32  -6.657  -0.615   1.925
   25    HB3  HIS  32           HB1      HIS  32  -4.920  -0.867   1.829
   26    HD1  HIS  32           HD1      HIS  32  -7.992  -2.072   3.541
   27    HD2  HIS  32           HD2      HIS  32  -3.894  -2.772   3.660
   28    HE1  HIS  32           HE1      HIS  32  -7.708  -4.217   4.813
   29    HE2  HIS  32           HE2      HIS  32  -5.219  -4.487   5.080
   30    H    LYS  33           HN       LYS  33  -3.774   2.370   3.552
   31    HA   LYS  33           HA       LYS  33  -4.401   3.655   1.014
   32    HB2  LYS  33           HB2      LYS  33  -6.074   4.626   2.460
   33    HB3  LYS  33           HB1      LYS  33  -4.869   4.980   3.687
   34    HG2  LYS  33           HG2      LYS  33  -3.775   6.516   2.024
   35    HG3  LYS  33           HG1      LYS  33  -5.197   6.287   1.002
   36    HD2  LYS  33           HD2      LYS  33  -6.628   7.209   2.696
   37    HD3  LYS  33           HD1      LYS  33  -5.293   7.276   3.848
   38    HE2  LYS  33           HE2      LYS  33  -4.139   8.864   2.317
   39    HE3  LYS  33           HE1      LYS  33  -5.586   8.874   1.307
   40    HZ1  LYS  33           HZ1      LYS  33  -5.491   9.671   4.167
   41    HZ2  LYS  33           HZ2      LYS  33  -6.844   9.752   3.149
   42    HZ3  LYS  33           HZ3      LYS  33  -5.503  10.751   2.861
   43    H    CYS  34           HN       CYS  34  -2.679   4.703   0.155
   44    HA   CYS  34           HA       CYS  34  -0.280   5.082   1.755
   45    HB2  CYS  34           HB2      CYS  34  -0.808   5.693  -1.164
   46    HB3  CYS  34           HB1      CYS  34   0.743   5.851  -0.360
   47    HA   PRO  35           HA       PRO  35  -1.712   9.017   3.199
   48    HB2  PRO  35           HB2      PRO  35   1.201   9.663   3.167
   49    HB3  PRO  35           HB1      PRO  35   0.013   9.882   4.456
   50    HG2  PRO  35           HG2      PRO  35   1.744   7.866   4.555
   51    HG3  PRO  35           HG1      PRO  35   0.061   7.645   5.068
   52    HD2  PRO  35           HD2      PRO  35   1.421   6.730   2.580
   53    HD3  PRO  35           HD1      PRO  35   0.119   5.959   3.506
   54    H    HIS  36           HN       HIS  36   1.232   9.640   1.299
   55    HA   HIS  36           HA       HIS  36  -0.201  11.779  -0.122
   56    HB2  HIS  36           HB2      HIS  36   1.807  12.497   1.038
   57    HB3  HIS  36           HB1      HIS  36   2.758  11.244   0.253
   58    HD1  HIS  36           HD1      HIS  36   4.273  12.329  -1.355
   59    HD2  HIS  36           HD2      HIS  36   0.515  14.111  -1.339
   60    HE1  HIS  36           HE1      HIS  36   4.357  14.106  -3.131
   61    HE2  HIS  36           HE2      HIS  36   2.003  14.985  -3.271
   62    H    CYS  37           HN       CYS  37   1.380   8.751  -0.510
   63    HA   CYS  37           HA       CYS  37   2.036   8.817  -3.220
   64    HB2  CYS  37           HB2      CYS  37   2.970   7.086  -1.934
   65    HB3  CYS  37           HB1      CYS  37   1.403   6.582  -1.313
   66    H    ASP  38           HN       ASP  38   0.962   8.574  -5.028
   67    HA   ASP  38           HA       ASP  38  -1.923   8.641  -5.000
   68    HB2  ASP  38           HB2      ASP  38  -1.646   9.002  -7.446
   69    HB3  ASP  38           HB1      ASP  38  -0.701  10.137  -6.483
   70    H    LYS  39           HN       LYS  39   0.357   6.186  -5.087
   71    HA   LYS  39           HA       LYS  39  -1.241   4.538  -6.910
   72    HB2  LYS  39           HB2      LYS  39   1.607   4.207  -5.969
   73    HB3  LYS  39           HB1      LYS  39   0.762   3.070  -7.017
   74    HG2  LYS  39           HG2      LYS  39   0.530   4.734  -8.730
   75    HG3  LYS  39           HG1      LYS  39   1.194   5.976  -7.668
   76    HD2  LYS  39           HD2      LYS  39   3.319   4.664  -7.593
   77    HD3  LYS  39           HD1      LYS  39   2.633   3.590  -8.817
   78    HE2  LYS  39           HE2      LYS  39   4.099   5.373  -9.752
   79    HE3  LYS  39           HE1      LYS  39   2.453   5.391 -10.386
   80    HZ1  LYS  39           HZ1      LYS  39   3.349   7.620  -9.780
   81    HZ2  LYS  39           HZ2      LYS  39   3.380   7.121  -8.159
   82    HZ3  LYS  39           HZ3      LYS  39   1.903   7.224  -8.983
   83    H    LYS  40           HN       LYS  40  -2.717   3.443  -5.926
   84    HA   LYS  40           HA       LYS  40  -1.922   1.634  -3.755
   85    HB2  LYS  40           HB2      LYS  40  -4.493   3.212  -3.989
   86    HB3  LYS  40           HB1      LYS  40  -4.301   1.837  -2.910
   87    HG2  LYS  40           HG2      LYS  40  -2.545   2.997  -1.707
   88    HG3  LYS  40           HG1      LYS  40  -2.667   4.363  -2.816
   89    HD2  LYS  40           HD2      LYS  40  -5.096   3.448  -1.338
   90    HD3  LYS  40           HD1      LYS  40  -3.881   4.412  -0.497
   91    HE2  LYS  40           HE2      LYS  40  -5.529   5.906  -1.341
   92    HE3  LYS  40           HE1      LYS  40  -4.079   6.108  -2.315
   93    HZ1  LYS  40           HZ1      LYS  40  -5.071   4.813  -4.061
   94    HZ2  LYS  40           HZ2      LYS  40  -6.133   6.061  -3.626
   95    HZ3  LYS  40           HZ3      LYS  40  -6.433   4.477  -3.104
   96    H    PHE  41           HN       PHE  41  -3.055  -0.396  -3.802
   97    HA   PHE  41           HA       PHE  41  -4.268  -0.989  -6.416
   98    HB2  PHE  41           HB2      PHE  41  -2.214  -2.631  -4.919
   99    HB3  PHE  41           HB1      PHE  41  -3.081  -3.180  -6.351
  100    HD1  PHE  41           HD2      PHE  41  -2.793  -1.876  -8.500
  101    HD2  PHE  41           HD1      PHE  41  -0.273  -1.355  -5.113
  102    HE1  PHE  41           HE2      PHE  41  -1.086  -0.847  -9.937
  103    HE2  PHE  41           HE1      PHE  41   1.438  -0.318  -6.546
  104    HZ   PHE  41           HZ       PHE  41   1.033  -0.066  -8.961
  105    H    ASN  42           HN       ASN  42  -4.758  -3.700  -5.963
  106    HA   ASN  42           HA       ASN  42  -7.196  -3.782  -4.709
  107    HB2  ASN  42           HB2      ASN  42  -5.148  -5.939  -5.176
  108    HB3  ASN  42           HB1      ASN  42  -6.686  -6.298  -4.397
  109   HD21  ASN  42          HD21      ASN  42  -7.178  -7.675  -6.156
  110   HD22  ASN  42          HD22      ASN  42  -7.728  -7.025  -7.667
  111    H    GLN  43           HN       GLN  43  -7.872  -3.607  -2.729
  112    HA   GLN  43           HA       GLN  43  -6.293  -2.500  -0.806
  113    HB2  GLN  43           HB2      GLN  43  -8.924  -3.928  -0.458
  114    HB3  GLN  43           HB1      GLN  43  -8.192  -2.890   0.757
  115    HG2  GLN  43           HG2      GLN  43  -8.319  -0.994  -0.761
  116    HG3  GLN  43           HG1      GLN  43  -9.012  -2.026  -2.011
  117   HE21  GLN  43          HE21      GLN  43 -10.634  -3.514  -0.067
  118   HE22  GLN  43          HE22      GLN  43 -11.938  -2.460   0.352
  119    H    VAL  44           HN       VAL  44  -7.324  -5.941  -0.828
  120    HA   VAL  44           HA       VAL  44  -5.920  -6.239   1.708
  121    HB   VAL  44           HB       VAL  44  -8.171  -7.188   1.548
  122   HG11  VAL  44          HG11      VAL  44  -8.565  -9.252   0.272
  123   HG12  VAL  44          HG12      VAL  44  -6.984  -9.062  -0.487
  124   HG13  VAL  44          HG13      VAL  44  -8.246  -7.860  -0.762
  125   HG21  VAL  44          HG21      VAL  44  -5.992  -9.233   1.942
  126   HG22  VAL  44          HG22      VAL  44  -7.656  -9.394   2.505
  127   HG23  VAL  44          HG23      VAL  44  -6.623  -8.120   3.153
  128    H    GLY  45           HN       GLY  45  -5.699  -7.544  -1.600
  129    HA2  GLY  45           HA2      GLY  45  -3.502  -9.262  -0.734
  130    HA3  GLY  45           HA1      GLY  45  -4.297  -9.305  -2.300
  131    H    ASN  46           HN       ASN  46  -3.975  -6.948  -3.421
  132    HA   ASN  46           HA       ASN  46  -1.184  -7.199  -4.072
  133    HB2  ASN  46           HB2      ASN  46  -3.048  -6.979  -5.773
  134    HB3  ASN  46           HB1      ASN  46  -3.153  -5.281  -5.318
  135   HD21  ASN  46          HD21      ASN  46  -2.629  -4.727  -7.470
  136   HD22  ASN  46          HD22      ASN  46  -0.994  -4.816  -8.038
  137    H    LEU  47           HN       LEU  47  -3.249  -4.748  -2.622
  138    HA   LEU  47           HA       LEU  47  -1.232  -2.739  -2.526
  139    HB2  LEU  47           HB2      LEU  47  -3.644  -2.236  -2.375
  140    HB3  LEU  47           HB1      LEU  47  -3.704  -3.051  -0.816
  141    HG   LEU  47           HG       LEU  47  -2.249  -1.362   0.160
  142   HD11  LEU  47          HD11      LEU  47  -1.564   0.606  -1.103
  143   HD12  LEU  47          HD12      LEU  47  -2.281  -0.071  -2.565
  144   HD13  LEU  47          HD13      LEU  47  -0.895  -0.862  -1.815
  145   HD21  LEU  47          HD21      LEU  47  -3.762   0.554   0.022
  146   HD22  LEU  47          HD22      LEU  47  -4.654  -0.962   0.164
  147   HD23  LEU  47          HD23      LEU  47  -4.530  -0.155  -1.399
  148    H    LYS  48           HN       LYS  48  -2.085  -5.458  -0.541
  149    HA   LYS  48           HA       LYS  48  -0.672  -4.798   1.796
  150    HB2  LYS  48           HB2      LYS  48  -2.273  -6.682   1.579
  151    HB3  LYS  48           HB1      LYS  48  -1.123  -7.525   0.558
  152    HG2  LYS  48           HG2      LYS  48  -0.362  -6.722   3.335
  153    HG3  LYS  48           HG1      LYS  48  -1.349  -8.158   3.058
  154    HD2  LYS  48           HD2      LYS  48   0.454  -8.893   1.423
  155    HD3  LYS  48           HD1      LYS  48   1.447  -7.595   2.089
  156    HE2  LYS  48           HE2      LYS  48   0.249  -9.889   3.639
  157    HE3  LYS  48           HE1      LYS  48   1.937  -9.731   3.162
  158    HZ1  LYS  48           HZ1      LYS  48   0.498  -7.866   4.978
  159    HZ2  LYS  48           HZ2      LYS  48   2.139  -7.790   4.561
  160    HZ3  LYS  48           HZ3      LYS  48   1.555  -9.096   5.468
  161    H    ALA  49           HN       ALA  49   0.319  -6.462  -1.177
  162    HA   ALA  49           HA       ALA  49   3.030  -6.832  -0.417
  163    HB1  ALA  49           HB1      ALA  49   1.806  -6.685  -3.171
  164    HB2  ALA  49           HB2      ALA  49   2.007  -8.141  -2.197
  165    HB3  ALA  49           HB3      ALA  49   3.424  -7.279  -2.795
  166    H    HIS  50           HN       HIS  50   1.278  -4.257  -1.999
  167    HA   HIS  50           HA       HIS  50   3.522  -2.717  -2.802
  168    HB2  HIS  50           HB2      HIS  50   1.300  -2.452  -3.809
  169    HB3  HIS  50           HB1      HIS  50   0.661  -1.899  -2.263
  170    HD1  HIS  50           HD1      HIS  50   2.931  -0.763  -5.076
  171    HD2  HIS  50           HD2      HIS  50   0.952   0.746  -1.741
  172    HE1  HIS  50           HE1      HIS  50   3.116   1.751  -5.219
  173    H    LEU  51           HN       LEU  51   1.523  -2.785   0.119
  174    HA   LEU  51           HA       LEU  51   2.696  -0.547   1.386
  175    HB2  LEU  51           HB2      LEU  51   1.365  -2.995   2.560
  176    HB3  LEU  51           HB1      LEU  51   1.829  -1.578   3.497
  177    HG   LEU  51           HG       LEU  51  -0.184  -1.605   1.244
  178   HD11  LEU  51          HD11      LEU  51  -1.820  -1.204   3.039
  179   HD12  LEU  51          HD12      LEU  51  -0.543  -1.456   4.229
  180   HD13  LEU  51          HD13      LEU  51  -1.033  -2.778   3.170
  181   HD21  LEU  51          HD21      LEU  51   0.992   0.528   1.434
  182   HD22  LEU  51          HD22      LEU  51   0.600   0.594   3.153
  183   HD23  LEU  51          HD23      LEU  51  -0.689   0.672   1.951
  184    H    LYS  52           HN       LYS  52   3.554  -3.943   1.231
  185    HA   LYS  52           HA       LYS  52   5.637  -3.995   3.099
  186    HB2  LYS  52           HB2      LYS  52   4.743  -6.016   2.036
  187    HB3  LYS  52           HB1      LYS  52   5.354  -5.487   0.477
  188    HG2  LYS  52           HG2      LYS  52   6.795  -7.188   1.359
  189    HG3  LYS  52           HG1      LYS  52   7.654  -5.648   1.367
  190    HD2  LYS  52           HD2      LYS  52   7.299  -5.395   3.723
  191    HD3  LYS  52           HD1      LYS  52   6.236  -6.804   3.762
  192    HE2  LYS  52           HE2      LYS  52   8.396  -7.424   4.618
  193    HE3  LYS  52           HE1      LYS  52   8.144  -8.210   3.062
  194    HZ1  LYS  52           HZ1      LYS  52  10.364  -7.344   3.189
  195    HZ2  LYS  52           HZ2      LYS  52   9.797  -5.796   3.575
  196    HZ3  LYS  52           HZ3      LYS  52   9.502  -6.444   2.035
  197    H    ILE  53           HN       ILE  53   5.515  -3.006  -0.261
  198    HA   ILE  53           HA       ILE  53   8.268  -2.465  -0.614
  199    HB   ILE  53           HB       ILE  53   5.816  -1.415  -2.031
  200   HG12  ILE  53          HG12      ILE  53   6.126  -3.811  -2.279
  201   HG13  ILE  53          HG11      ILE  53   6.494  -3.007  -3.800
  202   HG21  ILE  53          HG21      ILE  53   7.334  -0.739  -3.846
  203   HG22  ILE  53          HG22      ILE  53   8.706  -1.090  -2.794
  204   HG23  ILE  53          HG23      ILE  53   7.566   0.186  -2.363
  205   HD11  ILE  53          HD11      ILE  53   8.876  -3.204  -3.326
  206   HD12  ILE  53          HD12      ILE  53   8.078  -4.778  -3.328
  207   HD13  ILE  53          HD13      ILE  53   8.504  -4.005  -1.800
  208    H    HIS  54           HN       HIS  54   5.571  -0.541   0.589
  209    HA   HIS  54           HA       HIS  54   7.052   1.906   0.659
  210    HB2  HIS  54           HB2      HIS  54   4.389   1.019   1.660
  211    HB3  HIS  54           HB1      HIS  54   5.092   2.480   2.341
  212    HD1  HIS  54           HD1      HIS  54   5.385   4.522   0.713
  213    HD2  HIS  54           HD2      HIS  54   3.420   1.237  -0.915
  214    HE1  HIS  54           HE1      HIS  54   4.281   5.333  -1.421
  215    H    ILE  55           HN       ILE  55   6.640  -0.779   2.818
  216    HA   ILE  55           HA       ILE  55   7.681   0.602   5.127
  217    HB   ILE  55           HB       ILE  55   7.207  -2.342   4.623
  218   HG12  ILE  55          HG12      ILE  55   5.649  -0.328   6.260
  219   HG13  ILE  55          HG11      ILE  55   5.177  -0.926   4.664
  220   HG21  ILE  55          HG21      ILE  55   8.943  -2.052   6.299
  221   HG22  ILE  55          HG22      ILE  55   7.452  -2.632   7.043
  222   HG23  ILE  55          HG23      ILE  55   7.910  -0.936   7.194
  223   HD11  ILE  55          HD11      ILE  55   3.944  -2.023   6.458
  224   HD12  ILE  55          HD12      ILE  55   5.458  -2.599   7.153
  225   HD13  ILE  55          HD13      ILE  55   4.942  -3.169   5.567
  226    H    ALA  56           HN       ALA  56   8.896  -1.603   2.671
  227    HA   ALA  56           HA       ALA  56  11.536  -1.693   3.897
  228    HB1  ALA  56           HB1      ALA  56  10.526  -2.995   1.370
  229    HB2  ALA  56           HB2      ALA  56  10.567  -3.744   2.965
  230    HB3  ALA  56           HB3      ALA  56  12.073  -3.305   2.158
  231    H    ASP  57           HN       ASP  57  13.423  -1.446   2.359
  232    HA   ASP  57           HA       ASP  57  13.099   1.014   0.792
  233    HB2  ASP  57           HB2      ASP  57  14.815   1.119   2.517
  234    HB3  ASP  57           HB1      ASP  57  15.567  -0.351   1.905
  235    H    GLY  58           HN       GLY  58  12.740   0.668  -1.309
  236    HA2  GLY  58           HA2      GLY  58  14.537  -0.938  -2.853
  237    HA3  GLY  58           HA1      GLY  58  12.948  -1.690  -2.684
  Start of MODEL    3
    1    H1   LYS  30           HT1      LYS  30 -11.344   6.064   7.644
    2    H2   LYS  30           HT2      LYS  30 -12.909   5.659   7.131
    3    H3   LYS  30           HT3      LYS  30 -11.639   5.741   6.009
    4    HA   LYS  30           HA       LYS  30 -11.899   3.795   8.222
    5    HB2  LYS  30           HB2      LYS  30 -12.036   3.416   5.222
    6    HB3  LYS  30           HB1      LYS  30 -12.088   2.125   6.415
    7    HG2  LYS  30           HG2      LYS  30 -14.175   3.145   7.322
    8    HG3  LYS  30           HG1      LYS  30 -14.141   4.277   5.968
    9    HD2  LYS  30           HD2      LYS  30 -14.280   1.271   5.759
   10    HD3  LYS  30           HD1      LYS  30 -15.624   2.387   5.512
   11    HE2  LYS  30           HE2      LYS  30 -14.469   3.379   3.614
   12    HE3  LYS  30           HE1      LYS  30 -13.086   2.321   3.883
   13    HZ1  LYS  30           HZ1      LYS  30 -14.350   1.364   2.160
   14    HZ2  LYS  30           HZ2      LYS  30 -15.809   1.554   2.994
   15    HZ3  LYS  30           HZ3      LYS  30 -14.665   0.422   3.535
   16    H    GLU  31           HN       GLU  31  -9.886   3.832   9.075
   17    HA   GLU  31           HA       GLU  31  -7.734   3.168   9.310
   18    HB2  GLU  31           HB2      GLU  31  -8.307   1.976   6.612
   19    HB3  GLU  31           HB1      GLU  31  -6.686   1.912   7.287
   20    HG2  GLU  31           HG2      GLU  31  -7.974  -0.138   7.694
   21    HG3  GLU  31           HG1      GLU  31  -7.474   0.655   9.186
   22    H    HIS  32           HN       HIS  32  -5.537   3.203   7.739
   23    HA   HIS  32           HA       HIS  32  -5.351   6.053   7.060
   24    HB2  HIS  32           HB2      HIS  32  -2.904   5.782   7.660
   25    HB3  HIS  32           HB1      HIS  32  -4.036   5.653   9.000
   26    HD1  HIS  32           HD1      HIS  32  -4.257   3.372  10.162
   27    HD2  HIS  32           HD2      HIS  32  -1.511   3.407   7.032
   28    HE1  HIS  32           HE1      HIS  32  -2.954   1.231  10.374
   29    HE2  HIS  32           HE2      HIS  32  -1.165   1.378   8.612
   30    H    LYS  33           HN       LYS  33  -4.484   6.675   5.184
   31    HA   LYS  33           HA       LYS  33  -3.804   4.553   3.253
   32    HB2  LYS  33           HB2      LYS  33  -4.951   7.301   2.718
   33    HB3  LYS  33           HB1      LYS  33  -4.674   6.041   1.524
   34    HG2  LYS  33           HG2      LYS  33  -6.651   5.950   3.796
   35    HG3  LYS  33           HG1      LYS  33  -7.019   6.166   2.084
   36    HD2  LYS  33           HD2      LYS  33  -5.753   3.723   3.328
   37    HD3  LYS  33           HD1      LYS  33  -7.435   3.866   2.811
   38    HE2  LYS  33           HE2      LYS  33  -4.995   4.052   1.044
   39    HE3  LYS  33           HE1      LYS  33  -6.114   2.694   1.136
   40    HZ1  LYS  33           HZ1      LYS  33  -6.993   5.418   0.376
   41    HZ2  LYS  33           HZ2      LYS  33  -7.818   3.955   0.149
   42    HZ3  LYS  33           HZ3      LYS  33  -6.427   4.305  -0.760
   43    H    CYS  34           HN       CYS  34  -2.349   5.409   1.415
   44    HA   CYS  34           HA       CYS  34   0.000   6.500   2.728
   45    HB2  CYS  34           HB2      CYS  34   0.048   4.580   1.061
   46    HB3  CYS  34           HB1      CYS  34  -0.281   5.772  -0.192
   47    HA   PRO  35           HA       PRO  35  -1.557  10.545   1.814
   48    HB2  PRO  35           HB2      PRO  35   0.600  11.947   2.756
   49    HB3  PRO  35           HB1      PRO  35  -0.674  11.273   3.777
   50    HG2  PRO  35           HG2      PRO  35   2.040  10.180   3.157
   51    HG3  PRO  35           HG1      PRO  35   1.171  10.213   4.703
   52    HD2  PRO  35           HD2      PRO  35   1.307   7.987   3.202
   53    HD3  PRO  35           HD1      PRO  35  -0.136   8.391   4.155
   54    H    HIS  36           HN       HIS  36   1.822   9.827   0.922
   55    HA   HIS  36           HA       HIS  36   1.867  11.997  -0.978
   56    HB2  HIS  36           HB2      HIS  36   3.897  11.453   0.247
   57    HB3  HIS  36           HB1      HIS  36   3.890   9.822  -0.410
   58    HD1  HIS  36           HD1      HIS  36   5.947   9.812  -1.826
   59    HD2  HIS  36           HD2      HIS  36   3.582  13.161  -2.507
   60    HE1  HIS  36           HE1      HIS  36   6.973  10.973  -3.807
   61    HE2  HIS  36           HE2      HIS  36   5.376  12.852  -4.341
   62    H    CYS  37           HN       CYS  37   1.441   8.531  -1.073
   63    HA   CYS  37           HA       CYS  37   0.617   8.670  -3.845
   64    HB2  CYS  37           HB2      CYS  37   2.202   6.734  -4.403
   65    HB3  CYS  37           HB1      CYS  37   2.913   8.342  -4.282
   66    H    ASP  38           HN       ASP  38  -1.335   7.795  -3.482
   67    HA   ASP  38           HA       ASP  38  -1.519   5.423  -1.766
   68    HB2  ASP  38           HB2      ASP  38  -2.816   7.515  -1.186
   69    HB3  ASP  38           HB1      ASP  38  -3.773   7.232  -2.636
   70    H    LYS  39           HN       LYS  39  -0.811   5.592  -4.704
   71    HA   LYS  39           HA       LYS  39  -2.823   4.678  -6.354
   72    HB2  LYS  39           HB2      LYS  39   0.099   3.929  -6.345
   73    HB3  LYS  39           HB1      LYS  39  -1.017   3.474  -7.623
   74    HG2  LYS  39           HG2      LYS  39  -1.511   5.971  -7.833
   75    HG3  LYS  39           HG1      LYS  39  -0.050   6.204  -6.870
   76    HD2  LYS  39           HD2      LYS  39   0.455   6.339  -9.250
   77    HD3  LYS  39           HD1      LYS  39   1.238   4.933  -8.522
   78    HE2  LYS  39           HE2      LYS  39   0.227   4.420 -10.710
   79    HE3  LYS  39           HE1      LYS  39  -0.479   3.474  -9.402
   80    HZ1  LYS  39           HZ1      LYS  39  -2.137   4.362 -10.963
   81    HZ2  LYS  39           HZ2      LYS  39  -1.683   5.941 -10.544
   82    HZ3  LYS  39           HZ3      LYS  39  -2.380   4.922  -9.382
   83    H    LYS  40           HN       LYS  40  -4.170   3.084  -6.114
   84    HA   LYS  40           HA       LYS  40  -3.607   0.947  -4.258
   85    HB2  LYS  40           HB2      LYS  40  -6.001   0.360  -4.647
   86    HB3  LYS  40           HB1      LYS  40  -5.747   1.998  -4.069
   87    HG2  LYS  40           HG2      LYS  40  -5.991   2.819  -6.386
   88    HG3  LYS  40           HG1      LYS  40  -6.340   1.167  -6.901
   89    HD2  LYS  40           HD2      LYS  40  -8.296   1.099  -5.484
   90    HD3  LYS  40           HD1      LYS  40  -7.919   2.695  -4.835
   91    HE2  LYS  40           HE2      LYS  40  -8.182   3.650  -7.091
   92    HE3  LYS  40           HE1      LYS  40  -8.624   2.053  -7.698
   93    HZ1  LYS  40           HZ1      LYS  40 -10.556   2.050  -6.310
   94    HZ2  LYS  40           HZ2      LYS  40 -10.544   3.500  -7.194
   95    HZ3  LYS  40           HZ3      LYS  40 -10.093   3.499  -5.562
   96    H    PHE  41           HN       PHE  41  -3.953  -1.256  -4.713
   97    HA   PHE  41           HA       PHE  41  -3.496  -2.017  -7.526
   98    HB2  PHE  41           HB2      PHE  41  -2.499  -3.428  -5.038
   99    HB3  PHE  41           HB1      PHE  41  -2.180  -3.913  -6.700
  100    HD1  PHE  41           HD2      PHE  41  -0.943  -2.187  -8.179
  101    HD2  PHE  41           HD1      PHE  41  -1.012  -2.058  -3.927
  102    HE1  PHE  41           HE2      PHE  41   1.083  -0.789  -8.192
  103    HE2  PHE  41           HE1      PHE  41   1.010  -0.660  -3.930
  104    HZ   PHE  41           HZ       PHE  41   2.062  -0.026  -6.065
  105    H    ASN  42           HN       ASN  42  -3.696  -4.860  -6.764
  106    HA   ASN  42           HA       ASN  42  -6.455  -5.266  -7.154
  107    HB2  ASN  42           HB2      ASN  42  -4.261  -7.147  -6.282
  108    HB3  ASN  42           HB1      ASN  42  -5.916  -7.679  -6.562
  109   HD21  ASN  42          HD21      ASN  42  -3.444  -8.415  -7.939
  110   HD22  ASN  42          HD22      ASN  42  -3.700  -8.028  -9.606
  111    H    GLN  43           HN       GLN  43  -7.764  -6.746  -5.655
  112    HA   GLN  43           HA       GLN  43  -8.547  -5.171  -3.519
  113    HB2  GLN  43           HB2      GLN  43  -9.061  -8.126  -3.882
  114    HB3  GLN  43           HB1      GLN  43  -9.980  -7.041  -2.851
  115    HG2  GLN  43           HG2      GLN  43  -9.758  -6.769  -5.838
  116    HG3  GLN  43           HG1      GLN  43 -11.079  -7.578  -5.005
  117   HE21  GLN  43          HE21      GLN  43 -12.637  -6.201  -5.736
  118   HE22  GLN  43          HE22      GLN  43 -12.763  -4.550  -5.231
  119    H    VAL  44           HN       VAL  44  -6.911  -8.338  -3.284
  120    HA   VAL  44           HA       VAL  44  -6.674  -8.040  -0.419
  121    HB   VAL  44           HB       VAL  44  -5.549 -10.208  -2.204
  122   HG11  VAL  44          HG11      VAL  44  -6.044 -10.183   0.768
  123   HG12  VAL  44          HG12      VAL  44  -4.470 -10.121  -0.026
  124   HG13  VAL  44          HG13      VAL  44  -5.479 -11.560  -0.177
  125   HG21  VAL  44          HG21      VAL  44  -7.520 -11.515  -1.507
  126   HG22  VAL  44          HG22      VAL  44  -7.946 -10.096  -2.461
  127   HG23  VAL  44          HG23      VAL  44  -8.165 -10.080  -0.711
  128    H    GLY  45           HN       GLY  45  -4.651  -7.565  -3.195
  129    HA2  GLY  45           HA2      GLY  45  -2.191  -7.650  -1.650
  130    HA3  GLY  45           HA1      GLY  45  -2.331  -7.380  -3.386
  131    H    ASN  46           HN       ASN  46  -4.489  -5.296  -2.506
  132    HA   ASN  46           HA       ASN  46  -3.170  -3.088  -3.350
  133    HB2  ASN  46           HB2      ASN  46  -5.588  -3.172  -3.078
  134    HB3  ASN  46           HB1      ASN  46  -5.411  -3.154  -1.325
  135   HD21  ASN  46          HD21      ASN  46  -6.599  -1.278  -1.102
  136   HD22  ASN  46          HD22      ASN  46  -5.990   0.268  -1.585
  137    H    LEU  47           HN       LEU  47  -3.953  -3.413   0.125
  138    HA   LEU  47           HA       LEU  47  -2.167  -1.224   0.685
  139    HB2  LEU  47           HB2      LEU  47  -4.412  -1.685   1.809
  140    HB3  LEU  47           HB1      LEU  47  -3.587  -2.958   2.702
  141    HG   LEU  47           HG       LEU  47  -2.014  -1.209   3.581
  142   HD11  LEU  47          HD11      LEU  47  -2.356   0.454   1.828
  143   HD12  LEU  47          HD12      LEU  47  -2.692   1.126   3.424
  144   HD13  LEU  47          HD13      LEU  47  -4.024   0.676   2.360
  145   HD21  LEU  47          HD21      LEU  47  -4.950  -0.858   4.187
  146   HD22  LEU  47          HD22      LEU  47  -3.618  -0.314   5.207
  147   HD23  LEU  47          HD23      LEU  47  -3.864  -2.038   4.925
  148    H    LYS  48           HN       LYS  48  -2.184  -4.678   1.011
  149    HA   LYS  48           HA       LYS  48  -0.093  -4.916   2.890
  150    HB2  LYS  48           HB2      LYS  48  -1.808  -6.650   2.363
  151    HB3  LYS  48           HB1      LYS  48  -1.008  -6.924   0.826
  152    HG2  LYS  48           HG2      LYS  48   0.933  -7.792   1.904
  153    HG3  LYS  48           HG1      LYS  48   0.334  -7.306   3.495
  154    HD2  LYS  48           HD2      LYS  48  -1.559  -8.852   3.243
  155    HD3  LYS  48           HD1      LYS  48  -0.942  -9.346   1.666
  156    HE2  LYS  48           HE2      LYS  48   0.593  -9.638   4.243
  157    HE3  LYS  48           HE1      LYS  48  -0.418 -10.908   3.554
  158    HZ1  LYS  48           HZ1      LYS  48   1.763 -11.352   2.852
  159    HZ2  LYS  48           HZ2      LYS  48   2.062  -9.738   2.427
  160    HZ3  LYS  48           HZ3      LYS  48   0.998 -10.676   1.498
  161    H    ALA  49           HN       ALA  49  -0.124  -5.019  -0.656
  162    HA   ALA  49           HA       ALA  49   2.703  -5.505  -0.804
  163    HB1  ALA  49           HB1      ALA  49   2.439  -5.220  -3.202
  164    HB2  ALA  49           HB2      ALA  49   0.800  -4.615  -2.962
  165    HB3  ALA  49           HB3      ALA  49   1.192  -6.287  -2.559
  166    H    HIS  50           HN       HIS  50   0.584  -2.699  -1.128
  167    HA   HIS  50           HA       HIS  50   2.514  -0.894  -2.078
  168    HB2  HIS  50           HB2      HIS  50  -0.027  -0.587  -2.003
  169    HB3  HIS  50           HB1      HIS  50   0.191  -0.118  -0.315
  170    HD1  HIS  50           HD1      HIS  50   0.372   1.198  -3.750
  171    HD2  HIS  50           HD2      HIS  50   1.705   2.291   0.029
  172    HE1  HIS  50           HE1      HIS  50   1.117   3.602  -3.934
  173    H    LEU  51           HN       LEU  51   1.517  -1.734   1.241
  174    HA   LEU  51           HA       LEU  51   3.300   0.201   2.391
  175    HB2  LEU  51           HB2      LEU  51   1.470  -1.889   3.425
  176    HB3  LEU  51           HB1      LEU  51   2.811  -1.423   4.469
  177    HG   LEU  51           HG       LEU  51   0.736  -0.184   4.967
  178   HD11  LEU  51          HD11      LEU  51   2.895   0.818   5.475
  179   HD12  LEU  51          HD12      LEU  51   1.727   2.050   4.996
  180   HD13  LEU  51          HD13      LEU  51   2.963   1.516   3.857
  181   HD21  LEU  51          HD21      LEU  51   1.092   0.942   2.192
  182   HD22  LEU  51          HD22      LEU  51  -0.048   1.535   3.401
  183   HD23  LEU  51          HD23      LEU  51  -0.226  -0.092   2.743
  184    H    LYS  52           HN       LYS  52   3.512  -3.119   1.419
  185    HA   LYS  52           HA       LYS  52   5.784  -3.850   2.932
  186    HB2  LYS  52           HB2      LYS  52   4.286  -5.481   1.810
  187    HB3  LYS  52           HB1      LYS  52   4.900  -4.937   0.254
  188    HG2  LYS  52           HG2      LYS  52   7.149  -5.667   0.897
  189    HG3  LYS  52           HG1      LYS  52   6.508  -6.243   2.437
  190    HD2  LYS  52           HD2      LYS  52   5.056  -7.806   1.244
  191    HD3  LYS  52           HD1      LYS  52   5.699  -7.228  -0.296
  192    HE2  LYS  52           HE2      LYS  52   7.284  -8.554   1.901
  193    HE3  LYS  52           HE1      LYS  52   6.768  -9.316   0.398
  194    HZ1  LYS  52           HZ1      LYS  52   8.107  -7.681  -0.821
  195    HZ2  LYS  52           HZ2      LYS  52   9.054  -8.612   0.234
  196    HZ3  LYS  52           HZ3      LYS  52   8.642  -7.021   0.650
  197    H    ILE  53           HN       ILE  53   5.387  -2.341  -0.235
  198    HA   ILE  53           HA       ILE  53   8.212  -2.450  -0.792
  199    HB   ILE  53           HB       ILE  53   7.732  -1.178  -2.803
  200   HG12  ILE  53          HG12      ILE  53   5.094  -0.857  -3.166
  201   HG13  ILE  53          HG11      ILE  53   5.151  -0.618  -1.424
  202   HG21  ILE  53          HG21      ILE  53   6.162  -2.729  -3.877
  203   HG22  ILE  53          HG22      ILE  53   5.689  -3.329  -2.287
  204   HG23  ILE  53          HG23      ILE  53   7.341  -3.562  -2.864
  205   HD11  ILE  53          HD11      ILE  53   5.275   1.493  -2.613
  206   HD12  ILE  53          HD12      ILE  53   6.713   0.942  -3.472
  207   HD13  ILE  53          HD13      ILE  53   6.767   1.185  -1.726
  208    H    HIS  54           HN       HIS  54   6.102  -0.295   0.872
  209    HA   HIS  54           HA       HIS  54   7.926   1.943   0.691
  210    HB2  HIS  54           HB2      HIS  54   5.310   1.501   2.088
  211    HB3  HIS  54           HB1      HIS  54   6.340   2.848   2.566
  212    HD1  HIS  54           HD1      HIS  54   7.262   4.083   0.029
  213    HD2  HIS  54           HD2      HIS  54   3.443   2.467   0.420
  214    HE1  HIS  54           HE1      HIS  54   5.849   5.124  -1.799
  215    H    ILE  55           HN       ILE  55   7.530  -0.816   2.688
  216    HA   ILE  55           HA       ILE  55   9.466   0.316   4.601
  217    HB   ILE  55           HB       ILE  55   8.924  -1.562   6.089
  218   HG12  ILE  55          HG12      ILE  55   6.848  -2.277   4.000
  219   HG13  ILE  55          HG11      ILE  55   8.303  -3.214   4.376
  220   HG21  ILE  55          HG21      ILE  55   6.504  -0.023   5.163
  221   HG22  ILE  55          HG22      ILE  55   7.713   0.529   6.321
  222   HG23  ILE  55          HG23      ILE  55   6.673  -0.838   6.719
  223   HD11  ILE  55          HD11      ILE  55   7.450  -3.609   6.633
  224   HD12  ILE  55          HD12      ILE  55   6.345  -4.203   5.394
  225   HD13  ILE  55          HD13      ILE  55   5.994  -2.695   6.239
  226    H    ALA  56           HN       ALA  56   9.628  -1.075   1.795
  227    HA   ALA  56           HA       ALA  56  11.259  -3.387   2.326
  228    HB1  ALA  56           HB1      ALA  56  10.733  -1.962  -0.280
  229    HB2  ALA  56           HB2      ALA  56   9.801  -3.314   0.364
  230    HB3  ALA  56           HB3      ALA  56  11.489  -3.545  -0.091
  231    H    ASP  57           HN       ASP  57  13.429  -3.580   2.129
  232    HA   ASP  57           HA       ASP  57  14.934  -1.059   1.864
  233    HB2  ASP  57           HB2      ASP  57  15.051  -2.301   4.073
  234    HB3  ASP  57           HB1      ASP  57  15.880  -3.594   3.213
  235    H    GLY  58           HN       GLY  58  16.085  -0.863   0.039
  236    HA2  GLY  58           HA2      GLY  58  17.960  -2.589  -0.933
  237    HA3  GLY  58           HA1      GLY  58  16.460  -3.104  -1.718
  Start of MODEL    4
    1    H1   LYS  30           HT1      LYS  30  -9.972   2.195   0.273
    2    H2   LYS  30           HT2      LYS  30 -11.590   2.054  -0.219
    3    H3   LYS  30           HT3      LYS  30 -10.867   0.817   0.685
    4    HA   LYS  30           HA       LYS  30 -11.270   3.582   1.656
    5    HB2  LYS  30           HB2      LYS  30 -13.080   2.686   3.049
    6    HB3  LYS  30           HB1      LYS  30 -13.436   2.492   1.340
    7    HG2  LYS  30           HG2      LYS  30 -12.151   0.213   2.729
    8    HG3  LYS  30           HG1      LYS  30 -13.834   0.564   3.117
    9    HD2  LYS  30           HD2      LYS  30 -12.758   0.145   0.329
   10    HD3  LYS  30           HD1      LYS  30 -13.567  -1.093   1.293
   11    HE2  LYS  30           HE2      LYS  30 -14.786   1.543   0.468
   12    HE3  LYS  30           HE1      LYS  30 -15.080   0.000  -0.330
   13    HZ1  LYS  30           HZ1      LYS  30 -16.109  -0.844   1.635
   14    HZ2  LYS  30           HZ2      LYS  30 -16.823   0.654   1.278
   15    HZ3  LYS  30           HZ3      LYS  30 -15.686   0.530   2.530
   16    H    GLU  31           HN       GLU  31 -11.695   2.932   4.274
   17    HA   GLU  31           HA       GLU  31 -10.831   2.195   6.228
   18    HB2  GLU  31           HB2      GLU  31 -10.716  -0.032   5.224
   19    HB3  GLU  31           HB1      GLU  31  -9.143   0.350   4.538
   20    HG2  GLU  31           HG2      GLU  31  -8.146   0.454   6.702
   21    HG3  GLU  31           HG1      GLU  31  -9.721   0.338   7.487
   22    H    HIS  32           HN       HIS  32  -7.949   1.996   4.124
   23    HA   HIS  32           HA       HIS  32  -6.824   4.332   5.423
   24    HB2  HIS  32           HB2      HIS  32  -6.347   2.470   7.005
   25    HB3  HIS  32           HB1      HIS  32  -5.506   1.620   5.716
   26    HD1  HIS  32           HD1      HIS  32  -3.156   1.643   6.595
   27    HD2  HIS  32           HD2      HIS  32  -4.935   5.406   6.678
   28    HE1  HIS  32           HE1      HIS  32  -1.322   3.249   7.211
   29    HE2  HIS  32           HE2      HIS  32  -2.455   5.486   7.434
   30    H    LYS  33           HN       LYS  33  -5.847   5.438   3.876
   31    HA   LYS  33           HA       LYS  33  -4.705   3.988   1.584
   32    HB2  LYS  33           HB2      LYS  33  -6.489   5.736   1.176
   33    HB3  LYS  33           HB1      LYS  33  -5.355   6.938   1.776
   34    HG2  LYS  33           HG2      LYS  33  -3.775   6.012  -0.049
   35    HG3  LYS  33           HG1      LYS  33  -5.242   5.320  -0.737
   36    HD2  LYS  33           HD2      LYS  33  -4.806   8.242  -0.130
   37    HD3  LYS  33           HD1      LYS  33  -4.694   7.498  -1.723
   38    HE2  LYS  33           HE2      LYS  33  -7.036   6.856  -1.604
   39    HE3  LYS  33           HE1      LYS  33  -7.157   7.557   0.010
   40    HZ1  LYS  33           HZ1      LYS  33  -6.699   9.718  -0.892
   41    HZ2  LYS  33           HZ2      LYS  33  -8.000   9.036  -1.745
   42    HZ3  LYS  33           HZ3      LYS  33  -6.451   9.073  -2.442
   43    H    CYS  34           HN       CYS  34  -2.677   4.871   0.714
   44    HA   CYS  34           HA       CYS  34  -0.806   5.630   2.782
   45    HB2  CYS  34           HB2      CYS  34  -0.212   4.010   0.983
   46    HB3  CYS  34           HB1      CYS  34  -0.384   5.300  -0.200
   47    HA   PRO  35           HA       PRO  35  -1.734   9.939   2.145
   48    HB2  PRO  35           HB2      PRO  35   0.750  10.344   3.695
   49    HB3  PRO  35           HB1      PRO  35  -0.893  10.890   4.037
   50    HG2  PRO  35           HG2      PRO  35   0.234   8.920   5.440
   51    HG3  PRO  35           HG1      PRO  35  -1.492   8.903   5.037
   52    HD2  PRO  35           HD2      PRO  35   0.762   7.387   3.780
   53    HD3  PRO  35           HD1      PRO  35  -0.889   6.848   4.153
   54    H    HIS  36           HN       HIS  36   1.277   8.398   1.367
   55    HA   HIS  36           HA       HIS  36   2.326  10.775   0.047
   56    HB2  HIS  36           HB2      HIS  36   3.828   9.348   1.404
   57    HB3  HIS  36           HB1      HIS  36   3.536   8.012   0.296
   58    HD1  HIS  36           HD1      HIS  36   4.698   8.103  -2.014
   59    HD2  HIS  36           HD2      HIS  36   5.565  11.338   0.453
   60    HE1  HIS  36           HE1      HIS  36   6.670   9.250  -3.068
   61    HE2  HIS  36           HE2      HIS  36   7.145  11.239  -1.594
   62    H    CYS  37           HN       CYS  37   0.700   7.808  -0.781
   63    HA   CYS  37           HA       CYS  37   1.033   8.471  -3.615
   64    HB2  CYS  37           HB2      CYS  37   1.140   5.586  -3.034
   65    HB3  CYS  37           HB1      CYS  37   2.033   6.534  -4.220
   66    H    ASP  38           HN       ASP  38  -0.855   8.465  -4.606
   67    HA   ASP  38           HA       ASP  38  -3.169   7.225  -3.339
   68    HB2  ASP  38           HB2      ASP  38  -3.113   9.602  -4.325
   69    HB3  ASP  38           HB1      ASP  38  -3.144   8.823  -5.900
   70    H    LYS  39           HN       LYS  39  -0.919   5.819  -4.755
   71    HA   LYS  39           HA       LYS  39  -2.023   4.674  -7.143
   72    HB2  LYS  39           HB2      LYS  39   0.348   4.913  -7.045
   73    HB3  LYS  39           HB1      LYS  39   0.437   4.087  -5.497
   74    HG2  LYS  39           HG2      LYS  39  -0.155   1.988  -6.540
   75    HG3  LYS  39           HG1      LYS  39  -0.373   2.798  -8.093
   76    HD2  LYS  39           HD2      LYS  39   2.225   2.741  -6.563
   77    HD3  LYS  39           HD1      LYS  39   1.814   1.614  -7.859
   78    HE2  LYS  39           HE2      LYS  39   1.567   3.500  -9.406
   79    HE3  LYS  39           HE1      LYS  39   1.989   4.617  -8.109
   80    HZ1  LYS  39           HZ1      LYS  39   3.805   2.434  -8.938
   81    HZ2  LYS  39           HZ2      LYS  39   4.178   3.835  -8.056
   82    HZ3  LYS  39           HZ3      LYS  39   3.813   3.943  -9.712
   83    H    LYS  40           HN       LYS  40  -3.106   2.814  -7.380
   84    HA   LYS  40           HA       LYS  40  -3.762   1.290  -4.960
   85    HB2  LYS  40           HB2      LYS  40  -5.093   1.308  -7.678
   86    HB3  LYS  40           HB1      LYS  40  -5.600   0.318  -6.321
   87    HG2  LYS  40           HG2      LYS  40  -7.088   2.108  -6.335
   88    HG3  LYS  40           HG1      LYS  40  -5.934   2.516  -5.067
   89    HD2  LYS  40           HD2      LYS  40  -4.779   4.033  -6.518
   90    HD3  LYS  40           HD1      LYS  40  -5.754   3.523  -7.897
   91    HE2  LYS  40           HE2      LYS  40  -7.743   4.451  -6.872
   92    HE3  LYS  40           HE1      LYS  40  -6.825   4.882  -5.428
   93    HZ1  LYS  40           HZ1      LYS  40  -5.682   6.544  -6.556
   94    HZ2  LYS  40           HZ2      LYS  40  -7.261   6.691  -7.152
   95    HZ3  LYS  40           HZ3      LYS  40  -6.070   5.929  -8.087
   96    H    PHE  41           HN       PHE  41  -3.898  -1.031  -5.136
   97    HA   PHE  41           HA       PHE  41  -2.231  -2.225  -7.243
   98    HB2  PHE  41           HB2      PHE  41  -2.140  -2.795  -4.274
   99    HB3  PHE  41           HB1      PHE  41  -1.430  -3.860  -5.482
  100    HD1  PHE  41           HD2      PHE  41   0.506  -3.129  -6.794
  101    HD2  PHE  41           HD1      PHE  41  -1.087  -0.743  -3.647
  102    HE1  PHE  41           HE2      PHE  41   2.583  -1.811  -6.749
  103    HE2  PHE  41           HE1      PHE  41   0.988   0.577  -3.597
  104    HZ   PHE  41           HZ       PHE  41   2.824   0.045  -5.147
  105    H    ASN  42           HN       ASN  42  -2.581  -4.886  -6.207
  106    HA   ASN  42           HA       ASN  42  -5.060  -5.530  -7.390
  107    HB2  ASN  42           HB2      ASN  42  -3.198  -7.183  -5.676
  108    HB3  ASN  42           HB1      ASN  42  -4.599  -7.836  -6.514
  109   HD21  ASN  42          HD21      ASN  42  -4.555  -8.051  -8.735
  110   HD22  ASN  42          HD22      ASN  42  -3.091  -7.923  -9.652
  111    H    GLN  43           HN       GLN  43  -6.856  -6.663  -6.373
  112    HA   GLN  43           HA       GLN  43  -8.166  -5.084  -4.581
  113    HB2  GLN  43           HB2      GLN  43  -9.704  -7.036  -4.223
  114    HB3  GLN  43           HB1      GLN  43  -9.388  -6.628  -5.903
  115    HG2  GLN  43           HG2      GLN  43  -7.690  -8.445  -5.955
  116    HG3  GLN  43           HG1      GLN  43  -8.199  -8.902  -4.330
  117   HE21  GLN  43          HE21      GLN  43 -10.224  -9.832  -4.034
  118   HE22  GLN  43          HE22      GLN  43 -11.114 -10.521  -5.352
  119    H    VAL  44           HN       VAL  44  -6.430  -8.093  -3.698
  120    HA   VAL  44           HA       VAL  44  -7.034  -7.592  -0.885
  121    HB   VAL  44           HB       VAL  44  -5.502  -9.887  -2.127
  122   HG11  VAL  44          HG11      VAL  44  -6.671  -9.559   0.630
  123   HG12  VAL  44          HG12      VAL  44  -4.958  -9.594   0.214
  124   HG13  VAL  44          HG13      VAL  44  -5.947 -11.037  -0.006
  125   HG21  VAL  44          HG21      VAL  44  -8.392  -9.733  -1.279
  126   HG22  VAL  44          HG22      VAL  44  -7.558 -11.182  -1.838
  127   HG23  VAL  44          HG23      VAL  44  -7.797  -9.824  -2.937
  128    H    GLY  45           HN       GLY  45  -4.350  -7.482  -3.110
  129    HA2  GLY  45           HA2      GLY  45  -2.329  -7.368  -1.054
  130    HA3  GLY  45           HA1      GLY  45  -2.075  -7.202  -2.789
  131    H    ASN  46           HN       ASN  46  -4.361  -5.068  -2.473
  132    HA   ASN  46           HA       ASN  46  -2.958  -2.925  -3.249
  133    HB2  ASN  46           HB2      ASN  46  -5.400  -3.026  -3.232
  134    HB3  ASN  46           HB1      ASN  46  -5.407  -2.828  -1.484
  135   HD21  ASN  46          HD21      ASN  46  -5.081  -0.807  -0.610
  136   HD22  ASN  46          HD22      ASN  46  -5.036   0.631  -1.563
  137    H    LEU  47           HN       LEU  47  -3.999  -3.145   0.187
  138    HA   LEU  47           HA       LEU  47  -2.235  -0.902   0.765
  139    HB2  LEU  47           HB2      LEU  47  -4.518  -0.944   1.672
  140    HB3  LEU  47           HB1      LEU  47  -4.143  -2.422   2.545
  141    HG   LEU  47           HG       LEU  47  -2.473  -1.193   3.882
  142   HD11  LEU  47          HD11      LEU  47  -1.858   0.534   2.312
  143   HD12  LEU  47          HD12      LEU  47  -2.455   1.268   3.800
  144   HD13  LEU  47          HD13      LEU  47  -3.486   1.211   2.370
  145   HD21  LEU  47          HD21      LEU  47  -4.086   0.115   5.199
  146   HD22  LEU  47          HD22      LEU  47  -4.725  -1.460   4.733
  147   HD23  LEU  47          HD23      LEU  47  -5.248  -0.009   3.879
  148    H    LYS  48           HN       LYS  48  -2.524  -4.313   1.474
  149    HA   LYS  48           HA       LYS  48  -0.655  -4.468   3.564
  150    HB2  LYS  48           HB2      LYS  48  -2.377  -6.184   2.892
  151    HB3  LYS  48           HB1      LYS  48  -1.318  -6.634   1.566
  152    HG2  LYS  48           HG2      LYS  48   0.333  -7.458   3.045
  153    HG3  LYS  48           HG1      LYS  48  -0.460  -6.731   4.447
  154    HD2  LYS  48           HD2      LYS  48  -2.397  -8.205   4.094
  155    HD3  LYS  48           HD1      LYS  48  -1.567  -8.951   2.728
  156    HE2  LYS  48           HE2      LYS  48  -0.474  -8.907   5.534
  157    HE3  LYS  48           HE1      LYS  48  -1.446 -10.226   4.886
  158    HZ1  LYS  48           HZ1      LYS  48   1.169  -9.305   3.813
  159    HZ2  LYS  48           HZ2      LYS  48   0.224 -10.557   3.167
  160    HZ3  LYS  48           HZ3      LYS  48   0.896 -10.719   4.714
  161    H    ALA  49           HN       ALA  49  -0.267  -4.935   0.061
  162    HA   ALA  49           HA       ALA  49   2.563  -5.440   0.287
  163    HB1  ALA  49           HB1      ALA  49   1.228  -6.442  -1.520
  164    HB2  ALA  49           HB2      ALA  49   2.561  -5.470  -2.143
  165    HB3  ALA  49           HB3      ALA  49   0.918  -4.831  -2.168
  166    H    HIS  50           HN       HIS  50   0.497  -2.696  -0.208
  167    HA   HIS  50           HA       HIS  50   2.329  -0.854  -1.267
  168    HB2  HIS  50           HB2      HIS  50  -0.233  -0.662  -0.878
  169    HB3  HIS  50           HB1      HIS  50   0.206  -0.115   0.740
  170    HD1  HIS  50           HD1      HIS  50  -0.679   1.244  -2.400
  171    HD2  HIS  50           HD2      HIS  50   2.215   2.143   0.442
  172    HE1  HIS  50           HE1      HIS  50   0.004   3.639  -2.826
  173    H    LEU  51           HN       LEU  51   1.477  -1.652   2.083
  174    HA   LEU  51           HA       LEU  51   3.336   0.101   3.298
  175    HB2  LEU  51           HB2      LEU  51   2.145  -2.465   4.362
  176    HB3  LEU  51           HB1      LEU  51   2.986  -1.257   5.324
  177    HG   LEU  51           HG       LEU  51   0.382  -0.815   3.850
  178   HD11  LEU  51          HD11      LEU  51   0.126  -2.303   5.763
  179   HD12  LEU  51          HD12      LEU  51  -0.605  -0.731   6.085
  180   HD13  LEU  51          HD13      LEU  51   0.958  -1.138   6.793
  181   HD21  LEU  51          HD21      LEU  51   1.920   0.977   5.733
  182   HD22  LEU  51          HD22      LEU  51   0.326   1.314   5.058
  183   HD23  LEU  51          HD23      LEU  51   1.731   1.217   3.996
  184    H    LYS  52           HN       LYS  52   3.560  -3.136   2.016
  185    HA   LYS  52           HA       LYS  52   5.982  -3.889   3.257
  186    HB2  LYS  52           HB2      LYS  52   4.431  -5.490   2.208
  187    HB3  LYS  52           HB1      LYS  52   4.810  -4.822   0.629
  188    HG2  LYS  52           HG2      LYS  52   7.026  -5.893   2.312
  189    HG3  LYS  52           HG1      LYS  52   5.955  -7.021   1.483
  190    HD2  LYS  52           HD2      LYS  52   6.472  -5.933  -0.654
  191    HD3  LYS  52           HD1      LYS  52   7.551  -4.813   0.181
  192    HE2  LYS  52           HE2      LYS  52   8.972  -6.649   0.866
  193    HE3  LYS  52           HE1      LYS  52   7.866  -7.813   0.141
  194    HZ1  LYS  52           HZ1      LYS  52   8.338  -6.859  -2.029
  195    HZ2  LYS  52           HZ2      LYS  52   9.766  -7.388  -1.284
  196    HZ3  LYS  52           HZ3      LYS  52   9.402  -5.735  -1.333
  197    H    ILE  53           HN       ILE  53   5.305  -2.344   0.111
  198    HA   ILE  53           HA       ILE  53   8.064  -2.350  -0.646
  199    HB   ILE  53           HB       ILE  53   7.415  -1.003  -2.559
  200   HG12  ILE  53          HG12      ILE  53   4.739  -0.718  -2.671
  201   HG13  ILE  53          HG11      ILE  53   4.975  -0.502  -0.939
  202   HG21  ILE  53          HG21      ILE  53   5.406  -3.172  -1.991
  203   HG22  ILE  53          HG22      ILE  53   7.036  -3.410  -2.624
  204   HG23  ILE  53          HG23      ILE  53   5.832  -2.544  -3.583
  205   HD11  ILE  53          HD11      ILE  53   6.326   1.087  -3.108
  206   HD12  ILE  53          HD12      ILE  53   6.531   1.318  -1.373
  207   HD13  ILE  53          HD13      ILE  53   4.965   1.623  -2.124
  208    H    HIS  54           HN       HIS  54   6.251  -0.366   1.423
  209    HA   HIS  54           HA       HIS  54   8.092   1.869   1.209
  210    HB2  HIS  54           HB2      HIS  54   5.647   1.308   2.827
  211    HB3  HIS  54           HB1      HIS  54   6.785   2.517   3.414
  212    HD1  HIS  54           HD1      HIS  54   6.907   4.759   2.136
  213    HD2  HIS  54           HD2      HIS  54   4.330   1.968   0.432
  214    HE1  HIS  54           HE1      HIS  54   5.556   6.000   0.381
  215    H    ILE  55           HN       ILE  55   8.052  -1.123   2.689
  216    HA   ILE  55           HA       ILE  55   9.913  -0.280   4.803
  217    HB   ILE  55           HB       ILE  55   8.398  -2.877   4.460
  218   HG12  ILE  55          HG12      ILE  55   8.127  -0.707   6.556
  219   HG13  ILE  55          HG11      ILE  55   7.067  -0.875   5.155
  220   HG21  ILE  55          HG21      ILE  55   9.288  -3.513   6.635
  221   HG22  ILE  55          HG22      ILE  55  10.215  -2.014   6.708
  222   HG23  ILE  55          HG23      ILE  55  10.600  -3.227   5.489
  223   HD11  ILE  55          HD11      ILE  55   6.352  -3.060   5.964
  224   HD12  ILE  55          HD12      ILE  55   6.044  -1.791   7.149
  225   HD13  ILE  55          HD13      ILE  55   7.409  -2.888   7.365
  226    H    ALA  56           HN       ALA  56   9.484  -2.695   2.239
  227    HA   ALA  56           HA       ALA  56  12.282  -3.463   2.403
  228    HB1  ALA  56           HB1      ALA  56  10.121  -4.430   0.537
  229    HB2  ALA  56           HB2      ALA  56  10.547  -5.173   2.078
  230    HB3  ALA  56           HB3      ALA  56  11.716  -5.148   0.758
  231    H    ASP  57           HN       ASP  57  13.822  -2.619   1.202
  232    HA   ASP  57           HA       ASP  57  13.423  -0.446  -0.530
  233    HB2  ASP  57           HB2      ASP  57  15.810  -2.285  -0.242
  234    HB3  ASP  57           HB1      ASP  57  15.815  -0.805  -1.190
  235    H    GLY  58           HN       GLY  58  12.904  -0.338  -2.619
  236    HA2  GLY  58           HA2      GLY  58  12.874  -2.862  -4.149
  237    HA3  GLY  58           HA1      GLY  58  11.793  -1.498  -4.434
  Start of MODEL    5
    1    H1   LYS  30           HT1      LYS  30  -8.666  -4.996   3.016
    2    H2   LYS  30           HT2      LYS  30  -7.731  -3.782   2.290
    3    H3   LYS  30           HT3      LYS  30  -9.410  -3.799   2.068
    4    HA   LYS  30           HA       LYS  30  -9.759  -3.387   4.407
    5    HB2  LYS  30           HB2      LYS  30  -6.738  -3.208   4.462
    6    HB3  LYS  30           HB1      LYS  30  -7.792  -2.698   5.775
    7    HG2  LYS  30           HG2      LYS  30  -8.601  -4.980   6.031
    8    HG3  LYS  30           HG1      LYS  30  -7.583  -5.499   4.687
    9    HD2  LYS  30           HD2      LYS  30  -5.592  -4.819   5.962
   10    HD3  LYS  30           HD1      LYS  30  -6.632  -4.339   7.305
   11    HE2  LYS  30           HE2      LYS  30  -7.406  -6.621   7.555
   12    HE3  LYS  30           HE1      LYS  30  -6.457  -7.121   6.157
   13    HZ1  LYS  30           HZ1      LYS  30  -4.444  -6.542   7.362
   14    HZ2  LYS  30           HZ2      LYS  30  -5.353  -7.684   8.230
   15    HZ3  LYS  30           HZ3      LYS  30  -5.355  -6.055   8.707
   16    H    GLU  31           HN       GLU  31 -10.013  -1.243   5.120
   17    HA   GLU  31           HA       GLU  31  -9.765   0.657   2.950
   18    HB2  GLU  31           HB2      GLU  31 -11.175   2.116   4.377
   19    HB3  GLU  31           HB1      GLU  31 -11.897   0.548   4.064
   20    HG2  GLU  31           HG2      GLU  31 -10.413   1.185   6.602
   21    HG3  GLU  31           HG1      GLU  31 -12.144   1.449   6.404
   22    H    HIS  32           HN       HIS  32  -7.287   0.186   3.649
   23    HA   HIS  32           HA       HIS  32  -6.499   2.562   5.206
   24    HB2  HIS  32           HB2      HIS  32  -5.087  -0.112   5.040
   25    HB3  HIS  32           HB1      HIS  32  -4.376   1.333   5.747
   26    HD1  HIS  32           HD1      HIS  32  -4.864   1.768   8.165
   27    HD2  HIS  32           HD2      HIS  32  -7.420  -1.068   6.502
   28    HE1  HIS  32           HE1      HIS  32  -6.196   0.834  10.088
   29    HE2  HIS  32           HE2      HIS  32  -7.847  -0.757   9.031
   30    H    LYS  33           HN       LYS  33  -6.367   3.879   3.400
   31    HA   LYS  33           HA       LYS  33  -4.880   2.978   1.088
   32    HB2  LYS  33           HB2      LYS  33  -5.419   5.160   0.121
   33    HB3  LYS  33           HB1      LYS  33  -6.859   4.379   0.753
   34    HG2  LYS  33           HG2      LYS  33  -6.858   5.809   2.678
   35    HG3  LYS  33           HG1      LYS  33  -5.310   6.511   2.200
   36    HD2  LYS  33           HD2      LYS  33  -6.325   7.426   0.186
   37    HD3  LYS  33           HD1      LYS  33  -7.872   6.691   0.613
   38    HE2  LYS  33           HE2      LYS  33  -8.041   8.078   2.576
   39    HE3  LYS  33           HE1      LYS  33  -6.426   8.730   2.297
   40    HZ1  LYS  33           HZ1      LYS  33  -7.198   9.762   0.277
   41    HZ2  LYS  33           HZ2      LYS  33  -8.185  10.246   1.566
   42    HZ3  LYS  33           HZ3      LYS  33  -8.741   9.080   0.463
   43    H    CYS  34           HN       CYS  34  -3.042   4.091   0.251
   44    HA   CYS  34           HA       CYS  34  -1.210   4.896   2.352
   45    HB2  CYS  34           HB2      CYS  34  -0.490   3.275   0.633
   46    HB3  CYS  34           HB1      CYS  34  -0.754   4.492  -0.612
   47    HA   PRO  35           HA       PRO  35  -2.348   9.142   1.423
   48    HB2  PRO  35           HB2      PRO  35  -0.305   9.789   3.433
   49    HB3  PRO  35           HB1      PRO  35  -2.035  10.136   3.442
   50    HG2  PRO  35           HG2      PRO  35  -0.953   8.306   5.084
   51    HG3  PRO  35           HG1      PRO  35  -2.577   8.109   4.399
   52    HD2  PRO  35           HD2      PRO  35   0.004   6.842   3.554
   53    HD3  PRO  35           HD1      PRO  35  -1.614   6.118   3.690
   54    H    HIS  36           HN       HIS  36   0.810   7.727   1.357
   55    HA   HIS  36           HA       HIS  36   2.109  10.093   0.319
   56    HB2  HIS  36           HB2      HIS  36   3.247   8.429   1.824
   57    HB3  HIS  36           HB1      HIS  36   3.205   7.280   0.489
   58    HD1  HIS  36           HD1      HIS  36   5.000   7.500  -1.297
   59    HD2  HIS  36           HD2      HIS  36   4.968  10.659   1.405
   60    HE1  HIS  36           HE1      HIS  36   7.053   8.847  -1.808
   61    HE2  HIS  36           HE2      HIS  36   7.143  10.583   0.011
   62    H    CYS  37           HN       CYS  37   0.338   7.489  -0.986
   63    HA   CYS  37           HA       CYS  37   1.596   7.928  -3.608
   64    HB2  CYS  37           HB2      CYS  37   0.298   5.427  -2.527
   65    HB3  CYS  37           HB1      CYS  37   0.779   5.639  -4.209
   66    H    ASP  38           HN       ASP  38   0.284   8.004  -5.435
   67    HA   ASP  38           HA       ASP  38  -2.434   8.955  -4.817
   68    HB2  ASP  38           HB2      ASP  38  -2.132  10.186  -7.053
   69    HB3  ASP  38           HB1      ASP  38  -1.224  10.780  -5.667
   70    H    LYS  39           HN       LYS  39  -1.444   6.186  -5.531
   71    HA   LYS  39           HA       LYS  39  -2.995   5.800  -8.001
   72    HB2  LYS  39           HB2      LYS  39  -0.938   3.855  -6.983
   73    HB3  LYS  39           HB1      LYS  39  -1.586   4.014  -8.610
   74    HG2  LYS  39           HG2      LYS  39  -0.452   6.253  -8.727
   75    HG3  LYS  39           HG1      LYS  39   0.350   5.839  -7.212
   76    HD2  LYS  39           HD2      LYS  39   1.137   3.727  -8.395
   77    HD3  LYS  39           HD1      LYS  39   0.610   4.501  -9.890
   78    HE2  LYS  39           HE2      LYS  39   2.722   5.428  -7.964
   79    HE3  LYS  39           HE1      LYS  39   2.928   4.953  -9.649
   80    HZ1  LYS  39           HZ1      LYS  39   1.519   7.372  -8.653
   81    HZ2  LYS  39           HZ2      LYS  39   1.584   6.900 -10.280
   82    HZ3  LYS  39           HZ3      LYS  39   3.010   7.324  -9.461
   83    H    LYS  40           HN       LYS  40  -4.154   3.743  -8.164
   84    HA   LYS  40           HA       LYS  40  -5.398   3.121  -5.583
   85    HB2  LYS  40           HB2      LYS  40  -6.379   2.742  -8.415
   86    HB3  LYS  40           HB1      LYS  40  -7.258   2.216  -6.987
   87    HG2  LYS  40           HG2      LYS  40  -7.496   4.483  -6.228
   88    HG3  LYS  40           HG1      LYS  40  -6.470   5.068  -7.541
   89    HD2  LYS  40           HD2      LYS  40  -8.110   4.336  -9.178
   90    HD3  LYS  40           HD1      LYS  40  -9.117   3.661  -7.895
   91    HE2  LYS  40           HE2      LYS  40  -8.363   6.571  -8.085
   92    HE3  LYS  40           HE1      LYS  40  -9.847   5.897  -8.755
   93    HZ1  LYS  40           HZ1      LYS  40 -10.596   5.298  -6.602
   94    HZ2  LYS  40           HZ2      LYS  40 -10.073   6.908  -6.507
   95    HZ3  LYS  40           HZ3      LYS  40  -9.102   5.664  -5.890
   96    H    PHE  41           HN       PHE  41  -4.856   1.300  -4.634
   97    HA   PHE  41           HA       PHE  41  -3.798  -0.907  -6.273
   98    HB2  PHE  41           HB2      PHE  41  -3.226  -0.389  -3.349
   99    HB3  PHE  41           HB1      PHE  41  -2.402  -1.521  -4.417
  100    HD1  PHE  41           HD2      PHE  41  -1.118  -0.525  -6.402
  101    HD2  PHE  41           HD1      PHE  41  -2.389   1.745  -3.039
  102    HE1  PHE  41           HE2      PHE  41   0.552   1.198  -6.942
  103    HE2  PHE  41           HE1      PHE  41  -0.719   3.473  -3.569
  104    HZ   PHE  41           HZ       PHE  41   0.752   3.199  -5.524
  105    H    ASN  42           HN       ASN  42  -4.557  -2.984  -5.896
  106    HA   ASN  42           HA       ASN  42  -7.113  -3.372  -4.831
  107    HB2  ASN  42           HB2      ASN  42  -4.864  -5.265  -5.456
  108    HB3  ASN  42           HB1      ASN  42  -6.338  -5.852  -4.693
  109   HD21  ASN  42          HD21      ASN  42  -5.260  -6.491  -7.293
  110   HD22  ASN  42          HD22      ASN  42  -6.473  -6.053  -8.448
  111    H    GLN  43           HN       GLN  43  -7.857  -3.528  -2.845
  112    HA   GLN  43           HA       GLN  43  -6.126  -2.571  -0.819
  113    HB2  GLN  43           HB2      GLN  43  -9.013  -3.438  -0.600
  114    HB3  GLN  43           HB1      GLN  43  -8.129  -2.484   0.583
  115    HG2  GLN  43           HG2      GLN  43  -9.415  -0.940  -0.605
  116    HG3  GLN  43           HG1      GLN  43  -7.790  -0.775  -1.264
  117   HE21  GLN  43          HE21      GLN  43  -8.473   0.059  -3.205
  118   HE22  GLN  43          HE22      GLN  43  -9.316  -0.871  -4.394
  119    H    VAL  44           HN       VAL  44  -7.027  -5.760  -1.680
  120    HA   VAL  44           HA       VAL  44  -6.428  -6.754   0.983
  121    HB   VAL  44           HB       VAL  44  -6.839  -9.039  -0.045
  122   HG11  VAL  44          HG11      VAL  44  -9.037  -6.977  -0.063
  123   HG12  VAL  44          HG12      VAL  44  -8.480  -7.908   1.327
  124   HG13  VAL  44          HG13      VAL  44  -9.282  -8.722  -0.017
  125   HG21  VAL  44          HG21      VAL  44  -8.301  -8.931  -2.122
  126   HG22  VAL  44          HG22      VAL  44  -6.577  -8.692  -2.371
  127   HG23  VAL  44          HG23      VAL  44  -7.664  -7.304  -2.366
  128    H    GLY  45           HN       GLY  45  -5.162  -7.693  -2.261
  129    HA2  GLY  45           HA2      GLY  45  -2.840  -8.801  -0.876
  130    HA3  GLY  45           HA1      GLY  45  -3.304  -9.116  -2.545
  131    H    ASN  46           HN       ASN  46  -3.418  -6.675  -3.686
  132    HA   ASN  46           HA       ASN  46  -0.689  -6.153  -4.134
  133    HB2  ASN  46           HB2      ASN  46  -2.598  -5.729  -5.746
  134    HB3  ASN  46           HB1      ASN  46  -2.951  -4.273  -4.821
  135   HD21  ASN  46          HD21      ASN  46  -1.464  -2.555  -4.863
  136   HD22  ASN  46          HD22      ASN  46  -0.268  -2.427  -6.101
  137    H    LEU  47           HN       LEU  47  -3.084  -4.571  -2.119
  138    HA   LEU  47           HA       LEU  47  -1.582  -2.252  -1.529
  139    HB2  LEU  47           HB2      LEU  47  -4.043  -2.508  -1.242
  140    HB3  LEU  47           HB1      LEU  47  -3.740  -3.564   0.130
  141    HG   LEU  47           HG       LEU  47  -2.572  -0.820   0.211
  142   HD11  LEU  47          HD11      LEU  47  -4.685   0.065   1.107
  143   HD12  LEU  47          HD12      LEU  47  -5.490  -1.441   0.667
  144   HD13  LEU  47          HD13      LEU  47  -4.824  -0.398  -0.590
  145   HD21  LEU  47          HD21      LEU  47  -2.147  -2.428   2.011
  146   HD22  LEU  47          HD22      LEU  47  -3.883  -2.601   2.268
  147   HD23  LEU  47          HD23      LEU  47  -3.093  -1.055   2.586
  148    H    LYS  48           HN       LYS  48  -1.904  -5.369   0.168
  149    HA   LYS  48           HA       LYS  48  -0.346  -4.618   2.400
  150    HB2  LYS  48           HB2      LYS  48  -0.308  -6.929   3.010
  151    HB3  LYS  48           HB1      LYS  48  -1.885  -6.602   2.311
  152    HG2  LYS  48           HG2      LYS  48  -1.205  -7.626   0.228
  153    HG3  LYS  48           HG1      LYS  48   0.413  -7.905   0.876
  154    HD2  LYS  48           HD2      LYS  48  -0.521  -9.373   2.585
  155    HD3  LYS  48           HD1      LYS  48  -2.147  -9.069   1.968
  156    HE2  LYS  48           HE2      LYS  48  -1.525 -10.057  -0.174
  157    HE3  LYS  48           HE1      LYS  48   0.107 -10.349   0.426
  158    HZ1  LYS  48           HZ1      LYS  48  -2.361 -11.519   1.593
  159    HZ2  LYS  48           HZ2      LYS  48  -0.765 -11.866   2.050
  160    HZ3  LYS  48           HZ3      LYS  48  -1.329 -12.326   0.517
  161    H    ALA  49           HN       ALA  49   0.475  -6.080  -0.702
  162    HA   ALA  49           HA       ALA  49   3.218  -6.541  -0.139
  163    HB1  ALA  49           HB1      ALA  49   3.482  -6.782  -2.549
  164    HB2  ALA  49           HB2      ALA  49   1.895  -6.062  -2.815
  165    HB3  ALA  49           HB3      ALA  49   2.029  -7.625  -2.009
  166    H    HIS  50           HN       HIS  50   1.399  -3.858  -1.490
  167    HA   HIS  50           HA       HIS  50   3.566  -2.202  -2.170
  168    HB2  HIS  50           HB2      HIS  50   1.279  -1.839  -2.985
  169    HB3  HIS  50           HB1      HIS  50   0.753  -1.452  -1.344
  170    HD1  HIS  50           HD1      HIS  50   2.748  -0.030  -4.221
  171    HD2  HIS  50           HD2      HIS  50   1.273   1.096  -0.495
  172    HE1  HIS  50           HE1      HIS  50   3.092   2.470  -4.043
  173    H    LEU  51           HN       LEU  51   1.847  -2.724   0.852
  174    HA   LEU  51           HA       LEU  51   3.107  -0.576   2.242
  175    HB2  LEU  51           HB2      LEU  51   1.726  -3.062   3.254
  176    HB3  LEU  51           HB1      LEU  51   2.304  -1.764   4.293
  177    HG   LEU  51           HG       LEU  51   0.131  -1.575   2.205
  178   HD11  LEU  51          HD11      LEU  51  -1.312  -1.121   4.124
  179   HD12  LEU  51          HD12      LEU  51   0.055  -1.364   5.211
  180   HD13  LEU  51          HD13      LEU  51  -0.550  -2.707   4.242
  181   HD21  LEU  51          HD21      LEU  51  -0.162   0.735   2.994
  182   HD22  LEU  51          HD22      LEU  51   1.409   0.488   2.233
  183   HD23  LEU  51          HD23      LEU  51   1.285   0.568   3.990
  184    H    LYS  52           HN       LYS  52   3.928  -3.906   1.581
  185    HA   LYS  52           HA       LYS  52   5.931  -4.090   3.609
  186    HB2  LYS  52           HB2      LYS  52   4.727  -6.056   2.578
  187    HB3  LYS  52           HB1      LYS  52   5.716  -5.815   1.141
  188    HG2  LYS  52           HG2      LYS  52   7.733  -6.179   2.450
  189    HG3  LYS  52           HG1      LYS  52   6.764  -6.375   3.909
  190    HD2  LYS  52           HD2      LYS  52   7.321  -8.557   3.159
  191    HD3  LYS  52           HD1      LYS  52   5.620  -8.302   2.766
  192    HE2  LYS  52           HE2      LYS  52   6.151  -7.879   0.467
  193    HE3  LYS  52           HE1      LYS  52   7.880  -7.896   0.816
  194    HZ1  LYS  52           HZ1      LYS  52   7.690 -10.234   1.433
  195    HZ2  LYS  52           HZ2      LYS  52   7.173  -9.981  -0.163
  196    HZ3  LYS  52           HZ3      LYS  52   6.031 -10.214   1.070
  197    H    ILE  53           HN       ILE  53   5.931  -3.221   0.185
  198    HA   ILE  53           HA       ILE  53   8.802  -3.043   0.062
  199    HB   ILE  53           HB       ILE  53   8.505  -1.988  -2.119
  200   HG12  ILE  53          HG12      ILE  53   5.539  -2.139  -1.550
  201   HG13  ILE  53          HG11      ILE  53   6.490  -0.657  -1.576
  202   HG21  ILE  53          HG21      ILE  53   7.348  -3.847  -3.247
  203   HG22  ILE  53          HG22      ILE  53   6.732  -4.382  -1.682
  204   HG23  ILE  53          HG23      ILE  53   8.466  -4.398  -2.000
  205   HD11  ILE  53          HD11      ILE  53   6.020  -2.497  -3.910
  206   HD12  ILE  53          HD12      ILE  53   6.973  -1.013  -3.939
  207   HD13  ILE  53          HD13      ILE  53   5.238  -0.941  -3.629
  208    H    HIS  54           HN       HIS  54   6.357  -1.106   1.329
  209    HA   HIS  54           HA       HIS  54   7.682   1.432   1.056
  210    HB2  HIS  54           HB2      HIS  54   5.185   0.436   2.177
  211    HB3  HIS  54           HB1      HIS  54   5.953   1.621   3.228
  212    HD1  HIS  54           HD1      HIS  54   5.849   4.066   2.504
  213    HD2  HIS  54           HD2      HIS  54   4.482   1.416  -0.394
  214    HE1  HIS  54           HE1      HIS  54   4.727   5.469   0.718
  215    H    ILE  55           HN       ILE  55   7.442  -1.099   3.483
  216    HA   ILE  55           HA       ILE  55   9.054   0.402   5.369
  217    HB   ILE  55           HB       ILE  55   8.813  -1.610   6.821
  218   HG12  ILE  55          HG12      ILE  55   7.060  -2.600   4.559
  219   HG13  ILE  55          HG11      ILE  55   8.609  -3.297   5.043
  220   HG21  ILE  55          HG21      ILE  55   7.246   0.226   6.998
  221   HG22  ILE  55          HG22      ILE  55   6.403  -1.306   7.232
  222   HG23  ILE  55          HG23      ILE  55   6.269  -0.451   5.696
  223   HD11  ILE  55          HD11      ILE  55   6.121  -3.194   6.736
  224   HD12  ILE  55          HD12      ILE  55   7.660  -3.925   7.192
  225   HD13  ILE  55          HD13      ILE  55   6.721  -4.602   5.860
  226    H    ALA  56           HN       ALA  56   9.639  -1.483   2.720
  227    HA   ALA  56           HA       ALA  56  12.205  -2.495   3.718
  228    HB1  ALA  56           HB1      ALA  56  10.805  -4.116   2.550
  229    HB2  ALA  56           HB2      ALA  56  12.289  -3.800   1.650
  230    HB3  ALA  56           HB3      ALA  56  10.767  -3.074   1.129
  231    H    ASP  57           HN       ASP  57  14.135  -2.086   2.497
  232    HA   ASP  57           HA       ASP  57  14.050   0.500   1.098
  233    HB2  ASP  57           HB2      ASP  57  16.105  -0.861   2.776
  234    HB3  ASP  57           HB1      ASP  57  16.666   0.187   1.477
  235    H    GLY  58           HN       GLY  58  14.117   0.419  -1.032
  236    HA2  GLY  58           HA2      GLY  58  15.693  -0.299  -2.893
  237    HA3  GLY  58           HA1      GLY  58  15.379  -1.931  -2.300
  Start of MODEL    6
    1    H1   LYS  30           HT1      LYS  30 -10.518   3.036  11.911
    2    H2   LYS  30           HT2      LYS  30 -11.293   2.490  10.504
    3    H3   LYS  30           HT3      LYS  30 -10.733   4.085  10.600
    4    HA   LYS  30           HA       LYS  30  -8.488   3.408  10.606
    5    HB2  LYS  30           HB2      LYS  30  -9.678   0.654  10.854
    6    HB3  LYS  30           HB1      LYS  30  -8.045   0.891  10.244
    7    HG2  LYS  30           HG2      LYS  30  -9.059   1.793  12.932
    8    HG3  LYS  30           HG1      LYS  30  -8.061   0.368  12.625
    9    HD2  LYS  30           HD2      LYS  30  -6.270   1.781  11.784
   10    HD3  LYS  30           HD1      LYS  30  -7.269   3.217  12.010
   11    HE2  LYS  30           HE2      LYS  30  -6.303   1.359  14.182
   12    HE3  LYS  30           HE1      LYS  30  -5.656   2.961  13.826
   13    HZ1  LYS  30           HZ1      LYS  30  -7.919   3.847  14.309
   14    HZ2  LYS  30           HZ2      LYS  30  -7.144   3.159  15.647
   15    HZ3  LYS  30           HZ3      LYS  30  -8.366   2.300  14.848
   16    H    GLU  31           HN       GLU  31  -8.289   4.360   8.704
   17    HA   GLU  31           HA       GLU  31  -9.419   3.098   6.313
   18    HB2  GLU  31           HB2      GLU  31  -8.067   5.771   6.750
   19    HB3  GLU  31           HB1      GLU  31  -8.560   5.180   5.170
   20    HG2  GLU  31           HG2      GLU  31 -10.218   6.694   5.935
   21    HG3  GLU  31           HG1      GLU  31 -10.897   5.072   6.013
   22    H    HIS  32           HN       HIS  32  -8.197   1.871   4.996
   23    HA   HIS  32           HA       HIS  32  -5.299   1.928   5.504
   24    HB2  HIS  32           HB2      HIS  32  -5.323  -0.520   4.793
   25    HB3  HIS  32           HB1      HIS  32  -6.006  -0.137   6.364
   26    HD1  HIS  32           HD1      HIS  32  -8.401  -0.783   6.786
   27    HD2  HIS  32           HD2      HIS  32  -7.268  -1.270   2.809
   28    HE1  HIS  32           HE1      HIS  32 -10.287  -2.029   5.685
   29    HE2  HIS  32           HE2      HIS  32  -9.591  -2.310   3.279
   30    H    LYS  33           HN       LYS  33  -4.909   3.415   3.889
   31    HA   LYS  33           HA       LYS  33  -4.265   2.028   1.437
   32    HB2  LYS  33           HB2      LYS  33  -5.122   3.639  -0.084
   33    HB3  LYS  33           HB1      LYS  33  -6.455   3.237   0.986
   34    HG2  LYS  33           HG2      LYS  33  -6.442   5.302   2.002
   35    HG3  LYS  33           HG1      LYS  33  -4.749   5.607   1.604
   36    HD2  LYS  33           HD2      LYS  33  -5.348   5.864  -0.754
   37    HD3  LYS  33           HD1      LYS  33  -7.036   5.541  -0.365
   38    HE2  LYS  33           HE2      LYS  33  -7.174   7.547   0.945
   39    HE3  LYS  33           HE1      LYS  33  -5.443   7.839   0.766
   40    HZ1  LYS  33           HZ1      LYS  33  -5.705   8.344  -1.499
   41    HZ2  LYS  33           HZ2      LYS  33  -6.984   9.150  -0.736
   42    HZ3  LYS  33           HZ3      LYS  33  -7.270   7.702  -1.564
   43    H    CYS  34           HN       CYS  34  -2.653   3.446   0.161
   44    HA   CYS  34           HA       CYS  34  -0.874   4.636   2.135
   45    HB2  CYS  34           HB2      CYS  34  -0.115   3.012   0.295
   46    HB3  CYS  34           HB1      CYS  34  -0.300   4.372  -0.813
   47    HA   PRO  35           HA       PRO  35  -2.861   8.487   1.026
   48    HB2  PRO  35           HB2      PRO  35  -1.152   9.672   3.085
   49    HB3  PRO  35           HB1      PRO  35  -2.910   9.537   3.032
   50    HG2  PRO  35           HG2      PRO  35  -1.418   8.101   4.757
   51    HG3  PRO  35           HG1      PRO  35  -2.920   7.472   4.049
   52    HD2  PRO  35           HD2      PRO  35  -0.074   6.909   3.275
   53    HD3  PRO  35           HD1      PRO  35  -1.445   5.787   3.424
   54    H    HIS  36           HN       HIS  36   0.577   7.923   1.146
   55    HA   HIS  36           HA       HIS  36   1.157  10.520  -0.036
   56    HB2  HIS  36           HB2      HIS  36   2.587   9.455   1.773
   57    HB3  HIS  36           HB1      HIS  36   3.140   8.320   0.545
   58    HD1  HIS  36           HD1      HIS  36   5.202   9.012  -0.641
   59    HD2  HIS  36           HD2      HIS  36   3.129  12.271   0.901
   60    HE1  HIS  36           HE1      HIS  36   6.638  11.017  -1.112
   61    HE2  HIS  36           HE2      HIS  36   5.254  12.992  -0.387
   62    H    CYS  37           HN       CYS  37   0.312   7.476  -1.110
   63    HA   CYS  37           HA       CYS  37   1.396   8.086  -3.782
   64    HB2  CYS  37           HB2      CYS  37   0.811   5.324  -2.696
   65    HB3  CYS  37           HB1      CYS  37   1.549   5.713  -4.241
   66    H    ASP  38           HN       ASP  38  -0.257   8.827  -4.968
   67    HA   ASP  38           HA       ASP  38  -2.977   8.366  -4.170
   68    HB2  ASP  38           HB2      ASP  38  -1.686   9.964  -6.358
   69    HB3  ASP  38           HB1      ASP  38  -3.431   9.726  -6.331
   70    H    LYS  39           HN       LYS  39  -1.310   6.103  -5.361
   71    HA   LYS  39           HA       LYS  39  -2.614   5.455  -7.831
   72    HB2  LYS  39           HB2      LYS  39  -0.923   3.785  -5.971
   73    HB3  LYS  39           HB1      LYS  39  -1.516   3.237  -7.531
   74    HG2  LYS  39           HG2      LYS  39  -0.258   5.008  -8.640
   75    HG3  LYS  39           HG1      LYS  39   0.339   5.562  -7.075
   76    HD2  LYS  39           HD2      LYS  39   1.989   4.164  -8.229
   77    HD3  LYS  39           HD1      LYS  39   1.444   3.417  -6.726
   78    HE2  LYS  39           HE2      LYS  39  -0.053   1.962  -7.961
   79    HE3  LYS  39           HE1      LYS  39   0.392   2.750  -9.474
   80    HZ1  LYS  39           HZ1      LYS  39   2.666   1.977  -9.150
   81    HZ2  LYS  39           HZ2      LYS  39   1.575   0.681  -9.214
   82    HZ3  LYS  39           HZ3      LYS  39   2.207   1.181  -7.723
   83    H    LYS  40           HN       LYS  40  -4.153   3.875  -8.213
   84    HA   LYS  40           HA       LYS  40  -5.693   3.013  -5.851
   85    HB2  LYS  40           HB2      LYS  40  -6.596   3.356  -8.721
   86    HB3  LYS  40           HB1      LYS  40  -7.603   2.742  -7.418
   87    HG2  LYS  40           HG2      LYS  40  -7.331   4.898  -6.241
   88    HG3  LYS  40           HG1      LYS  40  -6.419   5.503  -7.624
   89    HD2  LYS  40           HD2      LYS  40  -9.264   4.505  -7.724
   90    HD3  LYS  40           HD1      LYS  40  -8.790   6.203  -7.661
   91    HE2  LYS  40           HE2      LYS  40  -7.945   4.284  -9.824
   92    HE3  LYS  40           HE1      LYS  40  -9.338   5.355  -9.946
   93    HZ1  LYS  40           HZ1      LYS  40  -7.957   7.247  -9.900
   94    HZ2  LYS  40           HZ2      LYS  40  -7.214   6.172 -10.983
   95    HZ3  LYS  40           HZ3      LYS  40  -6.592   6.357  -9.422
   96    H    PHE  41           HN       PHE  41  -5.865   0.869  -5.455
   97    HA   PHE  41           HA       PHE  41  -5.395  -1.114  -7.466
   98    HB2  PHE  41           HB2      PHE  41  -3.377  -2.066  -6.195
   99    HB3  PHE  41           HB1      PHE  41  -3.096  -0.659  -7.212
  100    HD1  PHE  41           HD1      PHE  41  -3.720  -1.685  -3.704
  101    HD2  PHE  41           HD2      PHE  41  -2.126   1.268  -6.319
  102    HE1  PHE  41           HE1      PHE  41  -2.742  -0.517  -1.777
  103    HE2  PHE  41           HE2      PHE  41  -1.151   2.450  -4.392
  104    HZ   PHE  41           HZ       PHE  41  -1.472   1.602  -2.142
  105    H    ASN  42           HN       ASN  42  -5.134  -3.335  -6.344
  106    HA   ASN  42           HA       ASN  42  -7.342  -3.772  -4.648
  107    HB2  ASN  42           HB2      ASN  42  -6.561  -5.510  -6.128
  108    HB3  ASN  42           HB1      ASN  42  -4.980  -5.519  -5.359
  109   HD21  ASN  42          HD21      ASN  42  -5.145  -7.720  -4.931
  110   HD22  ASN  42          HD22      ASN  42  -6.189  -8.348  -3.696
  111    H    GLN  43           HN       GLN  43  -7.511  -3.271  -2.591
  112    HA   GLN  43           HA       GLN  43  -5.219  -2.566  -1.021
  113    HB2  GLN  43           HB2      GLN  43  -8.143  -2.754  -0.288
  114    HB3  GLN  43           HB1      GLN  43  -6.892  -2.076   0.746
  115    HG2  GLN  43           HG2      GLN  43  -6.457  -0.336  -0.873
  116    HG3  GLN  43           HG1      GLN  43  -7.638  -1.037  -1.975
  117   HE21  GLN  43          HE21      GLN  43  -8.869   0.804  -2.034
  118   HE22  GLN  43          HE22      GLN  43  -9.836   1.337  -0.701
  119    H    VAL  44           HN       VAL  44  -6.638  -5.497  -1.684
  120    HA   VAL  44           HA       VAL  44  -6.083  -6.667   0.921
  121    HB   VAL  44           HB       VAL  44  -6.923  -8.057  -1.633
  122   HG11  VAL  44          HG11      VAL  44  -5.892  -9.568  -0.035
  123   HG12  VAL  44          HG12      VAL  44  -7.628  -9.868  -0.129
  124   HG13  VAL  44          HG13      VAL  44  -6.961  -8.979   1.240
  125   HG21  VAL  44          HG21      VAL  44  -9.183  -8.064  -0.667
  126   HG22  VAL  44          HG22      VAL  44  -8.601  -6.432  -0.990
  127   HG23  VAL  44          HG23      VAL  44  -8.605  -7.055   0.659
  128    H    GLY  45           HN       GLY  45  -4.973  -7.180  -2.440
  129    HA2  GLY  45           HA2      GLY  45  -2.696  -8.695  -1.427
  130    HA3  GLY  45           HA1      GLY  45  -3.176  -8.532  -3.114
  131    H    ASN  46           HN       ASN  46  -3.097  -6.010  -3.747
  132    HA   ASN  46           HA       ASN  46  -0.337  -5.545  -3.980
  133    HB2  ASN  46           HB2      ASN  46  -2.028  -4.826  -5.655
  134    HB3  ASN  46           HB1      ASN  46  -2.560  -3.575  -4.534
  135   HD21  ASN  46          HD21      ASN  46   0.008  -4.669  -6.602
  136   HD22  ASN  46          HD22      ASN  46   0.866  -3.164  -6.661
  137    H    LEU  47           HN       LEU  47  -2.800  -3.956  -1.980
  138    HA   LEU  47           HA       LEU  47  -1.209  -1.876  -1.004
  139    HB2  LEU  47           HB2      LEU  47  -3.618  -1.935  -0.666
  140    HB3  LEU  47           HB1      LEU  47  -3.455  -3.345   0.379
  141    HG   LEU  47           HG       LEU  47  -2.115  -1.921   1.955
  142   HD11  LEU  47          HD11      LEU  47  -3.103   0.328   0.211
  143   HD12  LEU  47          HD12      LEU  47  -1.428  -0.209   0.344
  144   HD13  LEU  47          HD13      LEU  47  -2.243   0.492   1.742
  145   HD21  LEU  47          HD21      LEU  47  -4.926  -1.020   1.358
  146   HD22  LEU  47          HD22      LEU  47  -4.060  -0.758   2.873
  147   HD23  LEU  47          HD23      LEU  47  -4.462  -2.397   2.359
  148    H    LYS  48           HN       LYS  48  -1.540  -5.204   0.114
  149    HA   LYS  48           HA       LYS  48  -0.088  -4.944   2.502
  150    HB2  LYS  48           HB2      LYS  48  -1.492  -6.899   1.927
  151    HB3  LYS  48           HB1      LYS  48  -0.307  -7.375   0.718
  152    HG2  LYS  48           HG2      LYS  48   1.338  -7.801   2.396
  153    HG3  LYS  48           HG1      LYS  48   0.307  -7.112   3.652
  154    HD2  LYS  48           HD2      LYS  48  -1.341  -8.907   3.231
  155    HD3  LYS  48           HD1      LYS  48  -0.237  -9.610   2.047
  156    HE2  LYS  48           HE2      LYS  48  -0.103 -10.734   4.231
  157    HE3  LYS  48           HE1      LYS  48   1.423  -9.982   3.769
  158    HZ1  LYS  48           HZ1      LYS  48  -0.539  -8.673   5.565
  159    HZ2  LYS  48           HZ2      LYS  48   1.078  -8.230   5.285
  160    HZ3  LYS  48           HZ3      LYS  48   0.722  -9.651   6.133
  161    H    ALA  49           HN       ALA  49   0.951  -5.800  -0.779
  162    HA   ALA  49           HA       ALA  49   3.714  -6.023  -0.084
  163    HB1  ALA  49           HB1      ALA  49   4.108  -6.107  -2.489
  164    HB2  ALA  49           HB2      ALA  49   2.448  -5.590  -2.791
  165    HB3  ALA  49           HB3      ALA  49   2.763  -7.155  -2.040
  166    H    HIS  50           HN       HIS  50   1.614  -3.466  -1.144
  167    HA   HIS  50           HA       HIS  50   3.526  -1.553  -1.905
  168    HB2  HIS  50           HB2      HIS  50   1.046  -1.502  -2.361
  169    HB3  HIS  50           HB1      HIS  50   0.810  -1.034  -0.677
  170    HD1  HIS  50           HD1      HIS  50   1.626   0.331  -4.008
  171    HD2  HIS  50           HD2      HIS  50   1.801   1.567  -0.040
  172    HE1  HIS  50           HE1      HIS  50   1.848   2.849  -4.057
  173    H    LEU  51           HN       LEU  51   1.922  -2.176   1.197
  174    HA   LEU  51           HA       LEU  51   3.322  -0.099   2.575
  175    HB2  LEU  51           HB2      LEU  51   1.848  -2.517   3.632
  176    HB3  LEU  51           HB1      LEU  51   2.453  -1.194   4.625
  177    HG   LEU  51           HG       LEU  51   0.326  -0.970   2.487
  178   HD11  LEU  51          HD11      LEU  51  -1.182  -0.537   4.360
  179   HD12  LEU  51          HD12      LEU  51   0.137  -0.827   5.492
  180   HD13  LEU  51          HD13      LEU  51  -0.455  -2.141   4.475
  181   HD21  LEU  51          HD21      LEU  51   0.053   1.319   3.261
  182   HD22  LEU  51          HD22      LEU  51   1.696   1.057   2.675
  183   HD23  LEU  51          HD23      LEU  51   1.375   1.106   4.408
  184    H    LYS  52           HN       LYS  52   3.884  -3.482   1.935
  185    HA   LYS  52           HA       LYS  52   5.941  -3.901   3.819
  186    HB2  LYS  52           HB2      LYS  52   4.795  -5.772   2.772
  187    HB3  LYS  52           HB1      LYS  52   5.386  -5.286   1.190
  188    HG2  LYS  52           HG2      LYS  52   6.647  -7.172   2.026
  189    HG3  LYS  52           HG1      LYS  52   7.680  -5.747   1.911
  190    HD2  LYS  52           HD2      LYS  52   7.373  -5.360   4.325
  191    HD3  LYS  52           HD1      LYS  52   6.398  -6.829   4.420
  192    HE2  LYS  52           HE2      LYS  52   8.316  -8.140   3.631
  193    HE3  LYS  52           HE1      LYS  52   9.286  -6.672   3.557
  194    HZ1  LYS  52           HZ1      LYS  52   8.097  -7.849   6.013
  195    HZ2  LYS  52           HZ2      LYS  52   9.021  -6.430   5.952
  196    HZ3  LYS  52           HZ3      LYS  52   9.731  -7.920   5.562
  197    H    ILE  53           HN       ILE  53   6.027  -2.922   0.394
  198    HA   ILE  53           HA       ILE  53   8.883  -2.842   0.308
  199    HB   ILE  53           HB       ILE  53   7.401  -3.181  -1.696
  200   HG12  ILE  53          HG12      ILE  53   9.406  -0.919  -1.880
  201   HG13  ILE  53          HG11      ILE  53   9.800  -2.634  -1.890
  202   HG21  ILE  53          HG21      ILE  53   6.532  -1.177  -2.829
  203   HG22  ILE  53          HG22      ILE  53   6.973  -0.210  -1.423
  204   HG23  ILE  53          HG23      ILE  53   5.747  -1.468  -1.278
  205   HD11  ILE  53          HD11      ILE  53   8.579  -2.905  -3.982
  206   HD12  ILE  53          HD12      ILE  53   9.858  -1.699  -4.128
  207   HD13  ILE  53          HD13      ILE  53   8.178  -1.187  -3.970
  208    H    HIS  54           HN       HIS  54   6.517  -0.698   1.512
  209    HA   HIS  54           HA       HIS  54   8.095   1.690   1.354
  210    HB2  HIS  54           HB2      HIS  54   5.550   0.887   2.593
  211    HB3  HIS  54           HB1      HIS  54   6.444   2.103   3.498
  212    HD1  HIS  54           HD1      HIS  54   6.118   4.472   2.737
  213    HD2  HIS  54           HD2      HIS  54   5.062   1.698  -0.169
  214    HE1  HIS  54           HE1      HIS  54   5.066   5.788   0.842
  215    H    ILE  55           HN       ILE  55   7.765  -0.976   3.570
  216    HA   ILE  55           HA       ILE  55   9.467   0.267   5.576
  217    HB   ILE  55           HB       ILE  55   8.310  -2.528   5.517
  218   HG12  ILE  55          HG12      ILE  55   6.536  -0.834   5.525
  219   HG13  ILE  55          HG11      ILE  55   6.615  -1.672   7.078
  220   HG21  ILE  55          HG21      ILE  55   9.515  -0.953   7.792
  221   HG22  ILE  55          HG22      ILE  55  10.259  -2.327   6.970
  222   HG23  ILE  55          HG23      ILE  55   8.786  -2.555   7.913
  223   HD11  ILE  55          HD11      ILE  55   7.760   1.048   6.489
  224   HD12  ILE  55          HD12      ILE  55   7.797   0.218   8.046
  225   HD13  ILE  55          HD13      ILE  55   6.255   0.720   7.350
  226    H    ALA  56           HN       ALA  56   9.525  -2.565   3.435
  227    HA   ALA  56           HA       ALA  56  12.381  -2.921   3.981
  228    HB1  ALA  56           HB1      ALA  56  10.951  -4.890   4.206
  229    HB2  ALA  56           HB2      ALA  56  12.119  -5.098   2.903
  230    HB3  ALA  56           HB3      ALA  56  10.438  -4.717   2.530
  231    H    ASP  57           HN       ASP  57  13.797  -2.080   2.617
  232    HA   ASP  57           HA       ASP  57  13.034  -0.851   0.172
  233    HB2  ASP  57           HB2      ASP  57  15.817  -1.553   1.138
  234    HB3  ASP  57           HB1      ASP  57  15.422  -0.418  -0.147
  235    H    GLY  58           HN       GLY  58  13.152  -1.553  -1.882
  236    HA2  GLY  58           HA2      GLY  58  14.755  -3.610  -2.876
  237    HA3  GLY  58           HA1      GLY  58  13.198  -4.318  -2.430
  Start of MODEL    7
    1    H1   LYS  30           HT1      LYS  30  -9.309  -5.189   7.685
    2    H2   LYS  30           HT2      LYS  30 -10.528  -4.019   7.777
    3    H3   LYS  30           HT3      LYS  30 -10.360  -5.162   9.013
    4    HA   LYS  30           HA       LYS  30  -9.486  -3.093   9.757
    5    HB2  LYS  30           HB2      LYS  30  -7.374  -5.146   9.066
    6    HB3  LYS  30           HB1      LYS  30  -7.104  -3.797  10.164
    7    HG2  LYS  30           HG2      LYS  30  -8.727  -4.621  11.703
    8    HG3  LYS  30           HG1      LYS  30  -9.271  -5.846  10.557
    9    HD2  LYS  30           HD2      LYS  30  -6.478  -5.735  11.672
   10    HD3  LYS  30           HD1      LYS  30  -7.780  -6.681  12.398
   11    HE2  LYS  30           HE2      LYS  30  -8.047  -7.871  10.235
   12    HE3  LYS  30           HE1      LYS  30  -6.653  -6.985   9.618
   13    HZ1  LYS  30           HZ1      LYS  30  -6.647  -8.854  11.928
   14    HZ2  LYS  30           HZ2      LYS  30  -5.312  -7.975  11.376
   15    HZ3  LYS  30           HZ3      LYS  30  -6.006  -9.162  10.390
   16    H    GLU  31           HN       GLU  31  -8.619  -1.161   9.283
   17    HA   GLU  31           HA       GLU  31  -8.006  -0.768   6.447
   18    HB2  GLU  31           HB2      GLU  31  -8.854   1.231   8.550
   19    HB3  GLU  31           HB1      GLU  31  -8.624   1.576   6.841
   20    HG2  GLU  31           HG2      GLU  31 -10.649  -0.345   7.964
   21    HG3  GLU  31           HG1      GLU  31 -10.983   1.309   7.451
   22    H    HIS  32           HN       HIS  32  -6.031  -0.353   5.833
   23    HA   HIS  32           HA       HIS  32  -4.467   1.637   7.165
   24    HB2  HIS  32           HB2      HIS  32  -3.807  -1.193   7.534
   25    HB3  HIS  32           HB1      HIS  32  -2.475  -0.263   6.853
   26    HD1  HIS  32           HD1      HIS  32  -3.916  -1.183  10.015
   27    HD2  HIS  32           HD2      HIS  32  -1.958   2.176   8.522
   28    HE1  HIS  32           HE1      HIS  32  -3.115   0.095  12.034
   29    HE2  HIS  32           HE2      HIS  32  -1.879   2.090  11.111
   30    H    LYS  33           HN       LYS  33  -4.242   2.876   5.427
   31    HA   LYS  33           HA       LYS  33  -3.346   1.583   2.934
   32    HB2  LYS  33           HB2      LYS  33  -4.648   3.212   1.673
   33    HB3  LYS  33           HB1      LYS  33  -5.689   2.315   2.770
   34    HG2  LYS  33           HG2      LYS  33  -5.737   4.169   4.308
   35    HG3  LYS  33           HG1      LYS  33  -4.595   5.070   3.310
   36    HD2  LYS  33           HD2      LYS  33  -6.265   4.993   1.459
   37    HD3  LYS  33           HD1      LYS  33  -7.402   4.245   2.581
   38    HE2  LYS  33           HE2      LYS  33  -7.329   6.193   4.012
   39    HE3  LYS  33           HE1      LYS  33  -6.106   6.938   2.984
   40    HZ1  LYS  33           HZ1      LYS  33  -8.195   7.888   2.440
   41    HZ2  LYS  33           HZ2      LYS  33  -8.932   6.367   2.291
   42    HZ3  LYS  33           HZ3      LYS  33  -7.771   6.858   1.156
   43    H    CYS  34           HN       CYS  34  -2.168   2.991   1.463
   44    HA   CYS  34           HA       CYS  34  -0.508   4.945   2.884
   45    HB2  CYS  34           HB2      CYS  34   0.728   3.188   1.717
   46    HB3  CYS  34           HB1      CYS  34  -0.097   3.581   0.209
   47    HA   PRO  35           HA       PRO  35  -3.065   7.868   0.535
   48    HB2  PRO  35           HB2      PRO  35  -2.210   9.856   2.467
   49    HB3  PRO  35           HB1      PRO  35  -3.819   9.176   2.216
   50    HG2  PRO  35           HG2      PRO  35  -2.327   8.699   4.439
   51    HG3  PRO  35           HG1      PRO  35  -3.528   7.559   3.806
   52    HD2  PRO  35           HD2      PRO  35  -0.547   7.542   3.480
   53    HD3  PRO  35           HD1      PRO  35  -1.650   6.188   3.816
   54    H    HIS  36           HN       HIS  36   0.272   7.762   1.205
   55    HA   HIS  36           HA       HIS  36   0.997  10.271   0.033
   56    HB2  HIS  36           HB2      HIS  36   2.432   9.063   1.670
   57    HB3  HIS  36           HB1      HIS  36   2.720   7.817   0.460
   58    HD1  HIS  36           HD1      HIS  36   3.672  11.303   1.405
   59    HD2  HIS  36           HD2      HIS  36   4.478   8.555  -1.616
   60    HE1  HIS  36           HE1      HIS  36   5.638  12.235   0.144
   61    HE2  HIS  36           HE2      HIS  36   6.190  10.494  -1.591
   62    H    CYS  37           HN       CYS  37   0.773   6.945  -1.115
   63    HA   CYS  37           HA       CYS  37   1.396   7.865  -3.836
   64    HB2  CYS  37           HB2      CYS  37   1.036   4.997  -2.961
   65    HB3  CYS  37           HB1      CYS  37   1.828   5.598  -4.415
   66    H    ASP  38           HN       ASP  38  -0.378   8.546  -4.880
   67    HA   ASP  38           HA       ASP  38  -2.966   7.678  -3.883
   68    HB2  ASP  38           HB2      ASP  38  -3.877   9.581  -5.110
   69    HB3  ASP  38           HB1      ASP  38  -2.539  10.075  -4.079
   70    H    LYS  39           HN       LYS  39  -1.148   6.195  -5.993
   71    HA   LYS  39           HA       LYS  39  -2.996   6.009  -8.195
   72    HB2  LYS  39           HB2      LYS  39  -1.566   4.256  -9.076
   73    HB3  LYS  39           HB1      LYS  39  -0.604   5.642  -8.599
   74    HG2  LYS  39           HG2      LYS  39   0.147   4.502  -6.621
   75    HG3  LYS  39           HG1      LYS  39  -0.929   3.139  -6.956
   76    HD2  LYS  39           HD2      LYS  39   0.277   2.727  -9.058
   77    HD3  LYS  39           HD1      LYS  39   1.360   4.068  -8.691
   78    HE2  LYS  39           HE2      LYS  39   2.129   2.896  -6.685
   79    HE3  LYS  39           HE1      LYS  39   1.039   1.558  -7.049
   80    HZ1  LYS  39           HZ1      LYS  39   3.210   2.471  -8.853
   81    HZ2  LYS  39           HZ2      LYS  39   2.249   1.089  -9.040
   82    HZ3  LYS  39           HZ3      LYS  39   3.366   1.181  -7.764
   83    H    LYS  40           HN       LYS  40  -4.478   4.413  -8.578
   84    HA   LYS  40           HA       LYS  40  -5.438   3.194  -6.125
   85    HB2  LYS  40           HB2      LYS  40  -6.761   3.444  -8.833
   86    HB3  LYS  40           HB1      LYS  40  -7.522   2.775  -7.398
   87    HG2  LYS  40           HG2      LYS  40  -8.341   4.942  -7.493
   88    HG3  LYS  40           HG1      LYS  40  -7.031   5.056  -6.320
   89    HD2  LYS  40           HD2      LYS  40  -5.546   5.909  -8.086
   90    HD3  LYS  40           HD1      LYS  40  -6.880   5.819  -9.238
   91    HE2  LYS  40           HE2      LYS  40  -6.646   8.089  -8.461
   92    HE3  LYS  40           HE1      LYS  40  -8.146   7.412  -7.834
   93    HZ1  LYS  40           HZ1      LYS  40  -5.613   7.564  -6.294
   94    HZ2  LYS  40           HZ2      LYS  40  -7.135   7.098  -5.704
   95    HZ3  LYS  40           HZ3      LYS  40  -6.864   8.703  -6.184
   96    H    PHE  41           HN       PHE  41  -5.633   1.076  -5.736
   97    HA   PHE  41           HA       PHE  41  -5.455  -0.917  -7.777
   98    HB2  PHE  41           HB2      PHE  41  -3.417  -2.037  -6.684
   99    HB3  PHE  41           HB1      PHE  41  -3.124  -0.660  -7.737
  100    HD1  PHE  41           HD1      PHE  41  -3.600  -1.483  -4.124
  101    HD2  PHE  41           HD2      PHE  41  -1.761   1.044  -7.015
  102    HE1  PHE  41           HE1      PHE  41  -2.315  -0.377  -2.342
  103    HE2  PHE  41           HE2      PHE  41  -0.475   2.150  -5.237
  104    HZ   PHE  41           HZ       PHE  41  -0.752   1.440  -2.895
  105    H    ASN  42           HN       ASN  42  -4.808  -3.128  -6.301
  106    HA   ASN  42           HA       ASN  42  -7.201  -3.455  -4.760
  107    HB2  ASN  42           HB2      ASN  42  -6.278  -5.251  -6.179
  108    HB3  ASN  42           HB1      ASN  42  -4.866  -5.343  -5.130
  109   HD21  ASN  42          HD21      ASN  42  -8.273  -5.979  -5.412
  110   HD22  ASN  42          HD22      ASN  42  -8.384  -7.055  -4.051
  111    H    GLN  43           HN       GLN  43  -7.502  -3.247  -2.663
  112    HA   GLN  43           HA       GLN  43  -5.425  -2.211  -0.980
  113    HB2  GLN  43           HB2      GLN  43  -7.646  -1.352  -0.710
  114    HB3  GLN  43           HB1      GLN  43  -8.310  -2.963  -0.493
  115    HG2  GLN  43           HG2      GLN  43  -8.283  -1.980   1.637
  116    HG3  GLN  43           HG1      GLN  43  -6.939  -3.118   1.612
  117   HE21  GLN  43          HE21      GLN  43  -5.811  -2.105   3.222
  118   HE22  GLN  43          HE22      GLN  43  -5.037  -0.576   3.013
  119    H    VAL  44           HN       VAL  44  -7.029  -5.304  -1.357
  120    HA   VAL  44           HA       VAL  44  -6.318  -6.362   1.178
  121    HB   VAL  44           HB       VAL  44  -7.107  -7.854  -1.328
  122   HG11  VAL  44          HG11      VAL  44  -6.033  -9.326   0.280
  123   HG12  VAL  44          HG12      VAL  44  -7.767  -9.649   0.223
  124   HG13  VAL  44          HG13      VAL  44  -7.084  -8.725   1.561
  125   HG21  VAL  44          HG21      VAL  44  -9.359  -7.862  -0.372
  126   HG22  VAL  44          HG22      VAL  44  -8.789  -6.215  -0.638
  127   HG23  VAL  44          HG23      VAL  44  -8.790  -6.896   0.988
  128    H    GLY  45           HN       GLY  45  -5.103  -7.261  -2.067
  129    HA2  GLY  45           HA2      GLY  45  -2.863  -8.615  -0.759
  130    HA3  GLY  45           HA1      GLY  45  -3.316  -8.747  -2.455
  131    H    ASN  46           HN       ASN  46  -3.225  -6.329  -3.479
  132    HA   ASN  46           HA       ASN  46  -0.455  -6.099  -3.889
  133    HB2  ASN  46           HB2      ASN  46  -2.195  -5.606  -5.603
  134    HB3  ASN  46           HB1      ASN  46  -2.592  -4.130  -4.727
  135   HD21  ASN  46          HD21      ASN  46  -1.232  -2.381  -4.852
  136   HD22  ASN  46          HD22      ASN  46   0.073  -2.283  -5.984
  137    H    LEU  47           HN       LEU  47  -2.714  -4.078  -2.047
  138    HA   LEU  47           HA       LEU  47  -0.802  -2.042  -1.561
  139    HB2  LEU  47           HB2      LEU  47  -3.270  -1.725  -1.416
  140    HB3  LEU  47           HB1      LEU  47  -3.257  -2.661   0.077
  141    HG   LEU  47           HG       LEU  47  -1.412  -0.353   0.018
  142   HD11  LEU  47          HD11      LEU  47  -4.401   0.023   0.097
  143   HD12  LEU  47          HD12      LEU  47  -3.305   0.604  -1.156
  144   HD13  LEU  47          HD13      LEU  47  -3.199   1.254   0.480
  145   HD21  LEU  47          HD21      LEU  47  -2.297  -0.079   2.293
  146   HD22  LEU  47          HD22      LEU  47  -1.687  -1.710   2.008
  147   HD23  LEU  47          HD23      LEU  47  -3.425  -1.406   2.002
  148    H    LYS  48           HN       LYS  48  -1.503  -5.085   0.031
  149    HA   LYS  48           HA       LYS  48  -0.105  -4.563   2.437
  150    HB2  LYS  48           HB2      LYS  48  -0.698  -7.106   0.939
  151    HB3  LYS  48           HB1      LYS  48   0.258  -7.109   2.414
  152    HG2  LYS  48           HG2      LYS  48  -2.547  -6.039   2.189
  153    HG3  LYS  48           HG1      LYS  48  -2.118  -7.641   2.788
  154    HD2  LYS  48           HD2      LYS  48  -0.727  -6.525   4.537
  155    HD3  LYS  48           HD1      LYS  48  -1.377  -4.978   3.988
  156    HE2  LYS  48           HE2      LYS  48  -2.612  -5.791   5.925
  157    HE3  LYS  48           HE1      LYS  48  -3.642  -5.752   4.496
  158    HZ1  LYS  48           HZ1      LYS  48  -3.436  -8.102   4.249
  159    HZ2  LYS  48           HZ2      LYS  48  -3.867  -7.800   5.862
  160    HZ3  LYS  48           HZ3      LYS  48  -2.267  -8.196   5.470
  161    H    ALA  49           HN       ALA  49   0.925  -5.864  -0.687
  162    HA   ALA  49           HA       ALA  49   3.670  -6.131  -0.029
  163    HB1  ALA  49           HB1      ALA  49   4.033  -6.270  -2.447
  164    HB2  ALA  49           HB2      ALA  49   2.382  -5.721  -2.731
  165    HB3  ALA  49           HB3      ALA  49   2.673  -7.274  -1.949
  166    H    HIS  50           HN       HIS  50   1.699  -3.502  -1.213
  167    HA   HIS  50           HA       HIS  50   3.739  -1.680  -1.867
  168    HB2  HIS  50           HB2      HIS  50   1.317  -1.468  -2.490
  169    HB3  HIS  50           HB1      HIS  50   0.973  -1.060  -0.810
  170    HD1  HIS  50           HD1      HIS  50   2.400   0.367  -3.964
  171    HD2  HIS  50           HD2      HIS  50   1.707   1.499  -0.017
  172    HE1  HIS  50           HE1      HIS  50   2.651   2.884  -3.888
  173    H    LEU  51           HN       LEU  51   2.021  -2.350   1.156
  174    HA   LEU  51           HA       LEU  51   3.316  -0.355   2.696
  175    HB2  LEU  51           HB2      LEU  51   2.074  -2.978   3.538
  176    HB3  LEU  51           HB1      LEU  51   2.598  -1.720   4.652
  177    HG   LEU  51           HG       LEU  51   0.401  -1.448   2.591
  178   HD11  LEU  51          HD11      LEU  51   0.289  -1.674   5.596
  179   HD12  LEU  51          HD12      LEU  51  -0.229  -2.899   4.438
  180   HD13  LEU  51          HD13      LEU  51  -1.084  -1.360   4.535
  181   HD21  LEU  51          HD21      LEU  51   1.555   0.661   2.952
  182   HD22  LEU  51          HD22      LEU  51   1.381   0.479   4.697
  183   HD23  LEU  51          HD23      LEU  51  -0.047   0.701   3.686
  184    H    LYS  52           HN       LYS  52   4.036  -3.729   1.989
  185    HA   LYS  52           HA       LYS  52   6.283  -4.107   3.584
  186    HB2  LYS  52           HB2      LYS  52   5.214  -5.897   2.269
  187    HB3  LYS  52           HB1      LYS  52   5.753  -5.142   0.781
  188    HG2  LYS  52           HG2      LYS  52   7.724  -6.061   2.846
  189    HG3  LYS  52           HG1      LYS  52   7.035  -7.184   1.674
  190    HD2  LYS  52           HD2      LYS  52   7.845  -5.709  -0.145
  191    HD3  LYS  52           HD1      LYS  52   8.609  -4.683   1.070
  192    HE2  LYS  52           HE2      LYS  52  10.291  -6.126   0.203
  193    HE3  LYS  52           HE1      LYS  52   9.899  -6.692   1.826
  194    HZ1  LYS  52           HZ1      LYS  52   8.444  -8.370   0.796
  195    HZ2  LYS  52           HZ2      LYS  52  10.062  -8.553   0.353
  196    HZ3  LYS  52           HZ3      LYS  52   8.963  -7.868  -0.737
  197    H    ILE  53           HN       ILE  53   5.992  -2.680   0.374
  198    HA   ILE  53           HA       ILE  53   8.656  -2.132  -0.175
  199    HB   ILE  53           HB       ILE  53   6.147  -0.643  -0.938
  200   HG12  ILE  53          HG12      ILE  53   6.259  -2.909  -1.794
  201   HG13  ILE  53          HG11      ILE  53   6.491  -1.769  -3.116
  202   HG21  ILE  53          HG21      ILE  53   8.915  -0.253  -2.057
  203   HG22  ILE  53          HG22      ILE  53   7.996   0.909  -1.100
  204   HG23  ILE  53          HG23      ILE  53   7.431   0.449  -2.706
  205   HD11  ILE  53          HD11      ILE  53   7.998  -3.655  -3.305
  206   HD12  ILE  53          HD12      ILE  53   8.661  -3.304  -1.708
  207   HD13  ILE  53          HD13      ILE  53   8.894  -2.162  -3.029
  208    H    HIS  54           HN       HIS  54   6.362  -0.306   1.805
  209    HA   HIS  54           HA       HIS  54   8.101   1.970   2.003
  210    HB2  HIS  54           HB2      HIS  54   5.437   1.260   3.125
  211    HB3  HIS  54           HB1      HIS  54   6.358   2.548   3.895
  212    HD1  HIS  54           HD1      HIS  54   6.296   4.822   2.774
  213    HD2  HIS  54           HD2      HIS  54   4.828   1.775   0.355
  214    HE1  HIS  54           HE1      HIS  54   5.259   5.946   0.755
  215    H    ILE  55           HN       ILE  55   8.130  -1.012   3.533
  216    HA   ILE  55           HA       ILE  55   9.670   0.161   5.761
  217    HB   ILE  55           HB       ILE  55   8.203  -2.467   5.580
  218   HG12  ILE  55          HG12      ILE  55   7.417  -1.654   7.888
  219   HG13  ILE  55          HG11      ILE  55   8.113  -0.094   7.444
  220   HG21  ILE  55          HG21      ILE  55   9.212  -3.102   7.740
  221   HG22  ILE  55          HG22      ILE  55  10.300  -1.718   7.615
  222   HG23  ILE  55          HG23      ILE  55  10.396  -3.023   6.430
  223   HD11  ILE  55          HD11      ILE  55   6.615   0.016   5.521
  224   HD12  ILE  55          HD12      ILE  55   5.727  -0.142   7.040
  225   HD13  ILE  55          HD13      ILE  55   5.917  -1.538   5.979
  226    H    ALA  56           HN       ALA  56   9.606  -2.636   3.569
  227    HA   ALA  56           HA       ALA  56  12.536  -2.759   3.721
  228    HB1  ALA  56           HB1      ALA  56  10.594  -4.814   2.683
  229    HB2  ALA  56           HB2      ALA  56  11.334  -4.819   4.283
  230    HB3  ALA  56           HB3      ALA  56  12.338  -5.012   2.846
  231    H    ASP  57           HN       ASP  57  13.633  -1.869   2.093
  232    HA   ASP  57           HA       ASP  57  12.294  -1.415  -0.450
  233    HB2  ASP  57           HB2      ASP  57  14.250  -0.107  -1.062
  234    HB3  ASP  57           HB1      ASP  57  13.686   0.385   0.530
  235    H    GLY  58           HN       GLY  58  13.036  -2.250  -2.428
  236    HA2  GLY  58           HA2      GLY  58  15.160  -4.191  -2.500
  237    HA3  GLY  58           HA1      GLY  58  13.548  -4.913  -2.566
  Start of MODEL    8
    1    H1   LYS  30           HT1      LYS  30 -12.513   2.043   8.918
    2    H2   LYS  30           HT2      LYS  30 -12.913   2.109  10.562
    3    H3   LYS  30           HT3      LYS  30 -12.029   0.791   9.957
    4    HA   LYS  30           HA       LYS  30 -11.122   3.600  10.217
    5    HB2  LYS  30           HB2      LYS  30 -10.002   1.024  11.371
    6    HB3  LYS  30           HB1      LYS  30  -9.373   2.640  11.650
    7    HG2  LYS  30           HG2      LYS  30 -10.548   2.151  13.591
    8    HG3  LYS  30           HG1      LYS  30 -11.672   3.147  12.667
    9    HD2  LYS  30           HD2      LYS  30 -12.850   1.150  11.922
   10    HD3  LYS  30           HD1      LYS  30 -11.697   0.128  12.782
   11    HE2  LYS  30           HE2      LYS  30 -13.515   2.162  14.073
   12    HE3  LYS  30           HE1      LYS  30 -13.826   0.429  14.004
   13    HZ1  LYS  30           HZ1      LYS  30 -12.880   0.985  16.119
   14    HZ2  LYS  30           HZ2      LYS  30 -11.570   1.770  15.392
   15    HZ3  LYS  30           HZ3      LYS  30 -11.739   0.090  15.242
   16    H    GLU  31           HN       GLU  31 -10.549   3.970   8.093
   17    HA   GLU  31           HA       GLU  31  -9.269   1.810   6.616
   18    HB2  GLU  31           HB2      GLU  31  -9.908   4.524   5.497
   19    HB3  GLU  31           HB1      GLU  31  -9.789   2.991   4.650
   20    HG2  GLU  31           HG2      GLU  31 -12.012   4.009   6.383
   21    HG3  GLU  31           HG1      GLU  31 -12.068   3.499   4.700
   22    H    HIS  32           HN       HIS  32  -7.147   1.619   6.581
   23    HA   HIS  32           HA       HIS  32  -5.495   4.001   7.021
   24    HB2  HIS  32           HB2      HIS  32  -5.164   1.964   8.475
   25    HB3  HIS  32           HB1      HIS  32  -4.617   1.102   7.043
   26    HD1  HIS  32           HD1      HIS  32  -3.344   2.931   9.832
   27    HD2  HIS  32           HD2      HIS  32  -2.251   2.552   5.832
   28    HE1  HIS  32           HE1      HIS  32  -0.945   3.681   9.707
   29    HE2  HIS  32           HE2      HIS  32  -0.361   3.617   7.252
   30    H    LYS  33           HN       LYS  33  -5.645   4.861   4.951
   31    HA   LYS  33           HA       LYS  33  -4.607   3.321   2.698
   32    HB2  LYS  33           HB2      LYS  33  -5.172   5.323   1.370
   33    HB3  LYS  33           HB1      LYS  33  -6.552   4.762   2.304
   34    HG2  LYS  33           HG2      LYS  33  -6.263   6.518   3.906
   35    HG3  LYS  33           HG1      LYS  33  -4.741   7.003   3.164
   36    HD2  LYS  33           HD2      LYS  33  -6.509   8.534   2.521
   37    HD3  LYS  33           HD1      LYS  33  -5.951   7.627   1.117
   38    HE2  LYS  33           HE2      LYS  33  -8.274   6.581   2.656
   39    HE3  LYS  33           HE1      LYS  33  -8.522   7.980   1.612
   40    HZ1  LYS  33           HZ1      LYS  33  -7.299   5.444   0.661
   41    HZ2  LYS  33           HZ2      LYS  33  -7.842   6.748  -0.276
   42    HZ3  LYS  33           HZ3      LYS  33  -8.957   5.777   0.553
   43    H    CYS  34           HN       CYS  34  -2.867   4.325   1.347
   44    HA   CYS  34           HA       CYS  34  -0.805   5.546   3.003
   45    HB2  CYS  34           HB2      CYS  34  -0.317   3.755   1.242
   46    HB3  CYS  34           HB1      CYS  34  -0.622   5.003   0.036
   47    HA   PRO  35           HA       PRO  35  -2.610   9.477   1.912
   48    HB2  PRO  35           HB2      PRO  35  -0.349  10.565   3.458
   49    HB3  PRO  35           HB1      PRO  35  -2.084  10.735   3.735
   50    HG2  PRO  35           HG2      PRO  35  -0.546   9.217   5.322
   51    HG3  PRO  35           HG1      PRO  35  -2.219   8.769   4.940
   52    HD2  PRO  35           HD2      PRO  35   0.337   7.708   3.797
   53    HD3  PRO  35           HD1      PRO  35  -1.141   6.835   4.256
   54    H    HIS  36           HN       HIS  36   0.771   8.630   1.515
   55    HA   HIS  36           HA       HIS  36   1.378  11.004  -0.006
   56    HB2  HIS  36           HB2      HIS  36   3.027   9.799   1.493
   57    HB3  HIS  36           HB1      HIS  36   3.096   8.535   0.269
   58    HD1  HIS  36           HD1      HIS  36   4.678   8.903  -1.660
   59    HD2  HIS  36           HD2      HIS  36   3.997  12.358   0.553
   60    HE1  HIS  36           HE1      HIS  36   6.264  10.621  -2.581
   61    HE2  HIS  36           HE2      HIS  36   5.681  12.752  -1.368
   62    H    CYS  37           HN       CYS  37   0.197   7.841  -0.731
   63    HA   CYS  37           HA       CYS  37   0.452   8.437  -3.576
   64    HB2  CYS  37           HB2      CYS  37   0.974   5.620  -3.048
   65    HB3  CYS  37           HB1      CYS  37   1.815   6.742  -4.109
   66    H    ASP  38           HN       ASP  38  -1.535   8.344  -4.342
   67    HA   ASP  38           HA       ASP  38  -3.534   6.619  -3.134
   68    HB2  ASP  38           HB2      ASP  38  -3.639   8.719  -5.291
   69    HB3  ASP  38           HB1      ASP  38  -5.011   7.664  -4.970
   70    H    LYS  39           HN       LYS  39  -1.144   6.135  -5.282
   71    HA   LYS  39           HA       LYS  39  -2.301   4.633  -7.336
   72    HB2  LYS  39           HB2      LYS  39  -0.106   3.543  -7.543
   73    HB3  LYS  39           HB1      LYS  39   0.058   5.284  -7.361
   74    HG2  LYS  39           HG2      LYS  39   0.626   4.987  -5.008
   75    HG3  LYS  39           HG1      LYS  39   0.453   3.241  -5.181
   76    HD2  LYS  39           HD2      LYS  39   2.718   3.459  -5.417
   77    HD3  LYS  39           HD1      LYS  39   2.214   3.581  -7.099
   78    HE2  LYS  39           HE2      LYS  39   2.679   5.963  -5.318
   79    HE3  LYS  39           HE1      LYS  39   3.914   5.271  -6.361
   80    HZ1  LYS  39           HZ1      LYS  39   2.840   7.150  -7.411
   81    HZ2  LYS  39           HZ2      LYS  39   1.326   6.411  -7.265
   82    HZ3  LYS  39           HZ3      LYS  39   2.508   5.729  -8.270
   83    H    LYS  40           HN       LYS  40  -3.342   2.739  -7.336
   84    HA   LYS  40           HA       LYS  40  -3.136   1.082  -4.920
   85    HB2  LYS  40           HB2      LYS  40  -5.562   0.544  -5.246
   86    HB3  LYS  40           HB1      LYS  40  -5.229   2.205  -4.778
   87    HG2  LYS  40           HG2      LYS  40  -5.437   2.841  -7.188
   88    HG3  LYS  40           HG1      LYS  40  -5.970   1.189  -7.512
   89    HD2  LYS  40           HD2      LYS  40  -7.895   2.638  -7.263
   90    HD3  LYS  40           HD1      LYS  40  -7.823   1.499  -5.919
   91    HE2  LYS  40           HE2      LYS  40  -8.393   3.673  -5.063
   92    HE3  LYS  40           HE1      LYS  40  -6.758   3.268  -4.540
   93    HZ1  LYS  40           HZ1      LYS  40  -5.883   4.659  -6.315
   94    HZ2  LYS  40           HZ2      LYS  40  -6.907   5.555  -5.305
   95    HZ3  LYS  40           HZ3      LYS  40  -7.457   5.037  -6.825
   96    H    PHE  41           HN       PHE  41  -2.714  -0.959  -5.190
   97    HA   PHE  41           HA       PHE  41  -2.562  -2.103  -7.869
   98    HB2  PHE  41           HB2      PHE  41  -1.810  -3.390  -5.230
   99    HB3  PHE  41           HB1      PHE  41  -1.309  -3.893  -6.838
  100    HD1  PHE  41           HD2      PHE  41   0.139  -2.276  -8.178
  101    HD2  PHE  41           HD1      PHE  41  -0.482  -1.937  -3.981
  102    HE1  PHE  41           HE2      PHE  41   2.169  -0.908  -7.998
  103    HE2  PHE  41           HE1      PHE  41   1.554  -0.565  -3.789
  104    HZ   PHE  41           HZ       PHE  41   2.856  -0.021  -5.751
  105    H    ASN  42           HN       ASN  42  -2.963  -4.839  -6.874
  106    HA   ASN  42           HA       ASN  42  -5.681  -5.253  -7.254
  107    HB2  ASN  42           HB2      ASN  42  -4.261  -7.130  -7.468
  108    HB3  ASN  42           HB1      ASN  42  -3.554  -6.885  -5.877
  109   HD21  ASN  42          HD21      ASN  42  -4.378  -7.960  -4.206
  110   HD22  ASN  42          HD22      ASN  42  -5.820  -8.915  -4.249
  111    H    GLN  43           HN       GLN  43  -7.440  -5.114  -6.010
  112    HA   GLN  43           HA       GLN  43  -7.697  -3.201  -4.184
  113    HB2  GLN  43           HB2      GLN  43  -9.785  -4.354  -3.382
  114    HB3  GLN  43           HB1      GLN  43  -9.637  -4.144  -5.120
  115    HG2  GLN  43           HG2      GLN  43  -8.937  -6.479  -5.335
  116    HG3  GLN  43           HG1      GLN  43  -9.106  -6.686  -3.591
  117   HE21  GLN  43          HE21      GLN  43 -10.761  -6.339  -6.614
  118   HE22  GLN  43          HE22      GLN  43 -12.336  -6.756  -6.031
  119    H    VAL  44           HN       VAL  44  -7.629  -6.587  -2.965
  120    HA   VAL  44           HA       VAL  44  -7.440  -5.556  -0.276
  121    HB   VAL  44           HB       VAL  44  -8.894  -7.443  -0.665
  122   HG11  VAL  44          HG11      VAL  44  -8.021  -9.648  -1.280
  123   HG12  VAL  44          HG12      VAL  44  -6.425  -8.940  -1.523
  124   HG13  VAL  44          HG13      VAL  44  -7.772  -8.456  -2.555
  125   HG21  VAL  44          HG21      VAL  44  -8.126  -8.956   1.082
  126   HG22  VAL  44          HG22      VAL  44  -7.828  -7.277   1.533
  127   HG23  VAL  44          HG23      VAL  44  -6.500  -8.289   0.964
  128    H    GLY  45           HN       GLY  45  -5.257  -6.961  -2.607
  129    HA2  GLY  45           HA2      GLY  45  -3.194  -7.536  -0.658
  130    HA3  GLY  45           HA1      GLY  45  -3.045  -7.665  -2.409
  131    H    ASN  46           HN       ASN  46  -4.239  -4.853  -2.424
  132    HA   ASN  46           HA       ASN  46  -2.105  -3.382  -3.175
  133    HB2  ASN  46           HB2      ASN  46  -4.412  -2.658  -3.476
  134    HB3  ASN  46           HB1      ASN  46  -4.581  -2.385  -1.747
  135   HD21  ASN  46          HD21      ASN  46  -5.080  -0.251  -1.923
  136   HD22  ASN  46          HD22      ASN  46  -3.948   0.952  -2.441
  137    H    LEU  47           HN       LEU  47  -3.550  -3.008   0.083
  138    HA   LEU  47           HA       LEU  47  -1.578  -1.212   0.956
  139    HB2  LEU  47           HB2      LEU  47  -3.830  -1.472   1.962
  140    HB3  LEU  47           HB1      LEU  47  -3.307  -3.002   2.661
  141    HG   LEU  47           HG       LEU  47  -1.595  -1.810   3.973
  142   HD11  LEU  47          HD11      LEU  47  -2.853   0.693   2.858
  143   HD12  LEU  47          HD12      LEU  47  -1.258   0.072   2.432
  144   HD13  LEU  47          HD13      LEU  47  -1.585   0.613   4.080
  145   HD21  LEU  47          HD21      LEU  47  -4.401  -0.756   4.294
  146   HD22  LEU  47          HD22      LEU  47  -3.139  -0.685   5.521
  147   HD23  LEU  47          HD23      LEU  47  -3.756  -2.246   4.981
  148    H    LYS  48           HN       LYS  48  -1.783  -4.719   1.196
  149    HA   LYS  48           HA       LYS  48   0.290  -5.136   3.040
  150    HB2  LYS  48           HB2      LYS  48  -1.394  -6.840   2.218
  151    HB3  LYS  48           HB1      LYS  48  -0.455  -6.961   0.740
  152    HG2  LYS  48           HG2      LYS  48   0.721  -7.521   3.451
  153    HG3  LYS  48           HG1      LYS  48  -0.089  -8.754   2.487
  154    HD2  LYS  48           HD2      LYS  48   1.521  -8.250   0.640
  155    HD3  LYS  48           HD1      LYS  48   2.381  -7.189   1.757
  156    HE2  LYS  48           HE2      LYS  48   3.488  -9.311   1.734
  157    HE3  LYS  48           HE1      LYS  48   2.669  -9.128   3.284
  158    HZ1  LYS  48           HZ1      LYS  48   2.384 -11.345   2.313
  159    HZ2  LYS  48           HZ2      LYS  48   1.603 -10.665   0.973
  160    HZ3  LYS  48           HZ3      LYS  48   0.900 -10.550   2.513
  161    H    ALA  49           HN       ALA  49   0.394  -5.319  -0.524
  162    HA   ALA  49           HA       ALA  49   3.219  -5.540  -0.651
  163    HB1  ALA  49           HB1      ALA  49   2.957  -5.155  -3.036
  164    HB2  ALA  49           HB2      ALA  49   1.302  -4.601  -2.783
  165    HB3  ALA  49           HB3      ALA  49   1.728  -6.282  -2.461
  166    H    HIS  50           HN       HIS  50   0.985  -2.862  -0.653
  167    HA   HIS  50           HA       HIS  50   2.662  -0.813  -1.553
  168    HB2  HIS  50           HB2      HIS  50   0.100  -0.862  -1.095
  169    HB3  HIS  50           HB1      HIS  50   0.548  -0.374   0.543
  170    HD1  HIS  50           HD1      HIS  50  -0.336   1.024  -2.655
  171    HD2  HIS  50           HD2      HIS  50   2.191   2.101   0.466
  172    HE1  HIS  50           HE1      HIS  50   0.075   3.505  -2.904
  173    H    LEU  51           HN       LEU  51   1.991  -1.932   1.769
  174    HA   LEU  51           HA       LEU  51   3.839  -0.062   2.922
  175    HB2  LEU  51           HB2      LEU  51   2.511  -2.511   4.087
  176    HB3  LEU  51           HB1      LEU  51   3.487  -1.372   5.010
  177    HG   LEU  51           HG       LEU  51   0.868  -0.774   3.624
  178   HD11  LEU  51          HD11      LEU  51   0.047  -0.421   5.910
  179   HD12  LEU  51          HD12      LEU  51   1.604  -0.955   6.542
  180   HD13  LEU  51          HD13      LEU  51   0.585  -2.079   5.643
  181   HD21  LEU  51          HD21      LEU  51   2.374   1.144   3.533
  182   HD22  LEU  51          HD22      LEU  51   2.636   1.033   5.273
  183   HD23  LEU  51          HD23      LEU  51   1.039   1.436   4.644
  184    H    LYS  52           HN       LYS  52   3.958  -3.370   1.828
  185    HA   LYS  52           HA       LYS  52   6.387  -4.159   2.978
  186    HB2  LYS  52           HB2      LYS  52   4.907  -5.769   1.956
  187    HB3  LYS  52           HB1      LYS  52   5.047  -4.980   0.395
  188    HG2  LYS  52           HG2      LYS  52   6.323  -7.063   0.512
  189    HG3  LYS  52           HG1      LYS  52   7.354  -5.666   0.210
  190    HD2  LYS  52           HD2      LYS  52   8.117  -5.655   2.480
  191    HD3  LYS  52           HD1      LYS  52   6.928  -6.877   2.938
  192    HE2  LYS  52           HE2      LYS  52   9.300  -7.690   2.608
  193    HE3  LYS  52           HE1      LYS  52   8.048  -8.564   1.729
  194    HZ1  LYS  52           HZ1      LYS  52   9.721  -6.410   0.547
  195    HZ2  LYS  52           HZ2      LYS  52   8.622  -7.409  -0.269
  196    HZ3  LYS  52           HZ3      LYS  52  10.037  -8.069   0.384
  197    H    ILE  53           HN       ILE  53   5.714  -2.689  -0.191
  198    HA   ILE  53           HA       ILE  53   8.491  -2.509  -0.882
  199    HB   ILE  53           HB       ILE  53   6.669  -2.752  -2.570
  200   HG12  ILE  53          HG12      ILE  53   7.595  -1.135  -4.199
  201   HG13  ILE  53          HG11      ILE  53   8.424  -0.303  -2.889
  202   HG21  ILE  53          HG21      ILE  53   5.401  -0.756  -3.249
  203   HG22  ILE  53          HG22      ILE  53   6.073   0.117  -1.872
  204   HG23  ILE  53          HG23      ILE  53   5.019  -1.269  -1.605
  205   HD11  ILE  53          HD11      ILE  53   8.892  -3.150  -3.734
  206   HD12  ILE  53          HD12      ILE  53   9.741  -2.292  -2.450
  207   HD13  ILE  53          HD13      ILE  53   9.921  -1.770  -4.126
  208    H    HIS  54           HN       HIS  54   6.466  -0.655   1.089
  209    HA   HIS  54           HA       HIS  54   7.811   1.861   0.658
  210    HB2  HIS  54           HB2      HIS  54   5.507   0.941   2.178
  211    HB3  HIS  54           HB1      HIS  54   6.517   2.042   3.110
  212    HD1  HIS  54           HD1      HIS  54   6.386   4.518   2.523
  213    HD2  HIS  54           HD2      HIS  54   4.465   2.065  -0.239
  214    HE1  HIS  54           HE1      HIS  54   5.079   6.048   0.984
  215    H    ILE  55           HN       ILE  55   7.767  -0.616   3.192
  216    HA   ILE  55           HA       ILE  55   9.850   0.766   4.667
  217    HB   ILE  55           HB       ILE  55   8.487  -1.862   5.270
  218   HG12  ILE  55          HG12      ILE  55   8.005   0.887   6.446
  219   HG13  ILE  55          HG11      ILE  55   6.960   0.107   5.252
  220   HG21  ILE  55          HG21      ILE  55   9.382  -1.537   7.540
  221   HG22  ILE  55          HG22      ILE  55  10.254  -0.109   6.979
  222   HG23  ILE  55          HG23      ILE  55  10.662  -1.701   6.338
  223   HD11  ILE  55          HD11      ILE  55   6.471  -1.670   6.840
  224   HD12  ILE  55          HD12      ILE  55   6.061  -0.088   7.503
  225   HD13  ILE  55          HD13      ILE  55   7.530  -0.910   8.027
  226    H    ALA  56           HN       ALA  56   9.424  -2.386   3.069
  227    HA   ALA  56           HA       ALA  56  12.225  -3.019   3.497
  228    HB1  ALA  56           HB1      ALA  56  11.669  -5.180   2.477
  229    HB2  ALA  56           HB2      ALA  56  10.040  -4.593   2.141
  230    HB3  ALA  56           HB3      ALA  56  10.582  -4.779   3.808
  231    H    ASP  57           HN       ASP  57  13.774  -3.005   1.992
  232    HA   ASP  57           HA       ASP  57  13.356  -1.428  -0.356
  233    HB2  ASP  57           HB2      ASP  57  15.754  -2.884   0.760
  234    HB3  ASP  57           HB1      ASP  57  15.808  -2.006  -0.765
  235    H    GLY  58           HN       GLY  58  12.398  -2.250  -2.083
  236    HA2  GLY  58           HA2      GLY  58  13.292  -4.892  -3.032
  237    HA3  GLY  58           HA1      GLY  58  11.565  -4.533  -2.915
  Start of MODEL    9
    1    H1   LYS  30           HT1      LYS  30 -15.146   5.378   5.804
    2    H2   LYS  30           HT2      LYS  30 -14.922   5.751   7.442
    3    H3   LYS  30           HT3      LYS  30 -14.723   4.156   6.897
    4    HA   LYS  30           HA       LYS  30 -13.046   6.451   6.074
    5    HB2  LYS  30           HB2      LYS  30 -11.307   5.463   7.479
    6    HB3  LYS  30           HB1      LYS  30 -12.717   5.884   8.439
    7    HG2  LYS  30           HG2      LYS  30 -13.437   3.509   8.324
    8    HG3  LYS  30           HG1      LYS  30 -11.915   3.143   7.507
    9    HD2  LYS  30           HD2      LYS  30 -10.678   3.986   9.450
   10    HD3  LYS  30           HD1      LYS  30 -12.203   4.326  10.270
   11    HE2  LYS  30           HE2      LYS  30 -11.145   1.635   9.425
   12    HE3  LYS  30           HE1      LYS  30 -11.322   2.233  11.073
   13    HZ1  LYS  30           HZ1      LYS  30 -13.465   1.513   9.157
   14    HZ2  LYS  30           HZ2      LYS  30 -13.768   2.392  10.573
   15    HZ3  LYS  30           HZ3      LYS  30 -13.140   0.819  10.668
   16    H    GLU  31           HN       GLU  31 -11.171   5.808   4.848
   17    HA   GLU  31           HA       GLU  31 -11.098   3.083   3.862
   18    HB2  GLU  31           HB2      GLU  31 -12.658   4.363   2.340
   19    HB3  GLU  31           HB1      GLU  31 -11.297   5.387   1.909
   20    HG2  GLU  31           HG2      GLU  31 -11.901   3.469   0.338
   21    HG3  GLU  31           HG1      GLU  31 -10.206   3.682   0.773
   22    H    HIS  32           HN       HIS  32  -9.146   2.873   2.312
   23    HA   HIS  32           HA       HIS  32  -6.970   3.930   3.939
   24    HB2  HIS  32           HB2      HIS  32  -6.990   1.674   1.930
   25    HB3  HIS  32           HB1      HIS  32  -5.658   2.086   3.005
   26    HD1  HIS  32           HD1      HIS  32  -9.027   0.486   2.950
   27    HD2  HIS  32           HD2      HIS  32  -5.994   1.282   5.682
   28    HE1  HIS  32           HE1      HIS  32  -9.593  -0.854   5.000
   29    HE2  HIS  32           HE2      HIS  32  -7.683  -0.452   6.596
   30    H    LYS  33           HN       LYS  33  -5.739   5.501   3.280
   31    HA   LYS  33           HA       LYS  33  -5.092   5.720   0.414
   32    HB2  LYS  33           HB2      LYS  33  -6.443   7.629   0.823
   33    HB3  LYS  33           HB1      LYS  33  -5.720   7.903   2.401
   34    HG2  LYS  33           HG2      LYS  33  -3.614   8.536   1.323
   35    HG3  LYS  33           HG1      LYS  33  -4.357   8.286  -0.257
   36    HD2  LYS  33           HD2      LYS  33  -5.765  10.128  -0.019
   37    HD3  LYS  33           HD1      LYS  33  -5.559  10.178   1.735
   38    HE2  LYS  33           HE2      LYS  33  -4.355  11.995   0.531
   39    HE3  LYS  33           HE1      LYS  33  -3.307  10.974   1.511
   40    HZ1  LYS  33           HZ1      LYS  33  -2.741   9.751  -0.542
   41    HZ2  LYS  33           HZ2      LYS  33  -2.269  11.374  -0.587
   42    HZ3  LYS  33           HZ3      LYS  33  -3.645  10.871  -1.441
   43    H    CYS  34           HN       CYS  34  -2.935   6.083  -0.064
   44    HA   CYS  34           HA       CYS  34  -1.054   5.831   2.145
   45    HB2  CYS  34           HB2      CYS  34  -0.712   4.416   0.151
   46    HB3  CYS  34           HB1      CYS  34  -0.590   5.853  -0.855
   47    HA   PRO  35           HA       PRO  35  -0.431  10.248   2.220
   48    HB2  PRO  35           HB2      PRO  35   1.909  10.251   3.624
   49    HB3  PRO  35           HB1      PRO  35   0.326  10.026   4.373
   50    HG2  PRO  35           HG2      PRO  35   2.360   7.972   3.591
   51    HG3  PRO  35           HG1      PRO  35   1.380   8.071   5.067
   52    HD2  PRO  35           HD2      PRO  35   0.743   6.412   3.044
   53    HD3  PRO  35           HD1      PRO  35  -0.501   7.211   4.028
   54    H    HIS  36           HN       HIS  36   1.701   7.927   0.845
   55    HA   HIS  36           HA       HIS  36   3.302  10.019  -0.441
   56    HB2  HIS  36           HB2      HIS  36   3.679   7.048  -0.153
   57    HB3  HIS  36           HB1      HIS  36   4.600   7.977  -1.327
   58    HD1  HIS  36           HD1      HIS  36   6.601   9.232  -0.499
   59    HD2  HIS  36           HD2      HIS  36   4.256   7.734   2.592
   60    HE1  HIS  36           HE1      HIS  36   7.965   9.526   1.593
   61    HE2  HIS  36           HE2      HIS  36   6.622   8.410   3.406
   62    H    CYS  37           HN       CYS  37   0.908   7.552  -1.145
   63    HA   CYS  37           HA       CYS  37   1.111   8.236  -4.001
   64    HB2  CYS  37           HB2      CYS  37   0.403   5.451  -3.156
   65    HB3  CYS  37           HB1      CYS  37   1.100   6.014  -4.671
   66    H    ASP  38           HN       ASP  38  -0.754   8.527  -5.061
   67    HA   ASP  38           HA       ASP  38  -3.277   8.244  -3.641
   68    HB2  ASP  38           HB2      ASP  38  -4.258   9.372  -5.580
   69    HB3  ASP  38           HB1      ASP  38  -2.863  10.270  -4.997
   70    H    LYS  39           HN       LYS  39  -1.328   6.584  -5.897
   71    HA   LYS  39           HA       LYS  39  -3.428   5.024  -7.071
   72    HB2  LYS  39           HB2      LYS  39  -1.569   3.704  -8.055
   73    HB3  LYS  39           HB1      LYS  39  -1.441   5.426  -8.378
   74    HG2  LYS  39           HG2      LYS  39   0.228   5.650  -6.626
   75    HG3  LYS  39           HG1      LYS  39   0.084   3.931  -6.259
   76    HD2  LYS  39           HD2      LYS  39   0.931   3.340  -8.426
   77    HD3  LYS  39           HD1      LYS  39   0.912   5.026  -8.942
   78    HE2  LYS  39           HE2      LYS  39   2.604   3.897  -6.717
   79    HE3  LYS  39           HE1      LYS  39   3.170   4.264  -8.345
   80    HZ1  LYS  39           HZ1      LYS  39   2.734   6.575  -7.995
   81    HZ2  LYS  39           HZ2      LYS  39   3.664   6.020  -6.686
   82    HZ3  LYS  39           HZ3      LYS  39   2.000   6.275  -6.500
   83    H    LYS  40           HN       LYS  40  -4.011   2.970  -6.630
   84    HA   LYS  40           HA       LYS  40  -2.788   1.653  -4.314
   85    HB2  LYS  40           HB2      LYS  40  -5.175   0.808  -3.831
   86    HB3  LYS  40           HB1      LYS  40  -4.779   2.458  -3.376
   87    HG2  LYS  40           HG2      LYS  40  -5.858   3.251  -5.449
   88    HG3  LYS  40           HG1      LYS  40  -6.319   1.585  -5.812
   89    HD2  LYS  40           HD2      LYS  40  -7.678   1.466  -3.844
   90    HD3  LYS  40           HD1      LYS  40  -7.085   3.028  -3.281
   91    HE2  LYS  40           HE2      LYS  40  -9.338   3.188  -4.242
   92    HE3  LYS  40           HE1      LYS  40  -8.163   4.146  -5.144
   93    HZ1  LYS  40           HZ1      LYS  40  -8.104   2.525  -6.855
   94    HZ2  LYS  40           HZ2      LYS  40  -9.740   2.828  -6.531
   95    HZ3  LYS  40           HZ3      LYS  40  -9.008   1.416  -5.947
   96    H    PHE  41           HN       PHE  41  -3.182  -0.707  -4.296
   97    HA   PHE  41           HA       PHE  41  -2.862  -1.662  -7.048
   98    HB2  PHE  41           HB2      PHE  41  -2.104  -3.036  -4.458
   99    HB3  PHE  41           HB1      PHE  41  -1.667  -3.550  -6.085
  100    HD1  PHE  41           HD2      PHE  41  -0.403  -1.665  -7.481
  101    HD2  PHE  41           HD1      PHE  41  -0.539  -1.902  -3.235
  102    HE1  PHE  41           HE2      PHE  41   1.656  -0.324  -7.343
  103    HE2  PHE  41           HE1      PHE  41   1.517  -0.559  -3.089
  104    HZ   PHE  41           HZ       PHE  41   2.619   0.230  -5.144
  105    H    ASN  42           HN       ASN  42  -3.267  -4.336  -6.723
  106    HA   ASN  42           HA       ASN  42  -5.977  -4.680  -7.155
  107    HB2  ASN  42           HB2      ASN  42  -3.683  -6.467  -6.629
  108    HB3  ASN  42           HB1      ASN  42  -5.274  -7.161  -6.344
  109   HD21  ASN  42          HD21      ASN  42  -3.086  -5.888  -8.717
  110   HD22  ASN  42          HD22      ASN  42  -3.972  -6.433 -10.103
  111    H    GLN  43           HN       GLN  43  -7.639  -5.602  -6.017
  112    HA   GLN  43           HA       GLN  43  -8.211  -4.344  -3.654
  113    HB2  GLN  43           HB2      GLN  43 -10.157  -5.873  -3.508
  114    HB3  GLN  43           HB1      GLN  43  -9.934  -5.160  -5.102
  115    HG2  GLN  43           HG2      GLN  43  -8.864  -7.240  -5.858
  116    HG3  GLN  43           HG1      GLN  43  -9.163  -7.948  -4.271
  117   HE21  GLN  43          HE21      GLN  43 -10.572  -6.916  -7.264
  118   HE22  GLN  43          HE22      GLN  43 -12.113  -7.678  -7.031
  119    H    VAL  44           HN       VAL  44  -6.760  -7.539  -3.995
  120    HA   VAL  44           HA       VAL  44  -7.141  -8.098  -1.163
  121    HB   VAL  44           HB       VAL  44  -5.668  -9.740  -3.232
  122   HG11  VAL  44          HG11      VAL  44  -5.932 -11.581  -1.655
  123   HG12  VAL  44          HG12      VAL  44  -6.730 -10.501  -0.512
  124   HG13  VAL  44          HG13      VAL  44  -5.032 -10.254  -0.920
  125   HG21  VAL  44          HG21      VAL  44  -7.983  -9.478  -3.887
  126   HG22  VAL  44          HG22      VAL  44  -8.519  -9.934  -2.270
  127   HG23  VAL  44          HG23      VAL  44  -7.711 -11.118  -3.296
  128    H    GLY  45           HN       GLY  45  -4.378  -7.913  -3.391
  129    HA2  GLY  45           HA2      GLY  45  -2.435  -8.055  -1.313
  130    HA3  GLY  45           HA1      GLY  45  -2.130  -7.693  -3.012
  131    H    ASN  46           HN       ASN  46  -4.299  -5.450  -2.391
  132    HA   ASN  46           HA       ASN  46  -2.736  -3.372  -3.008
  133    HB2  ASN  46           HB2      ASN  46  -5.167  -3.211  -2.909
  134    HB3  ASN  46           HB1      ASN  46  -5.111  -3.206  -1.150
  135   HD21  ASN  46          HD21      ASN  46  -6.178  -1.207  -1.111
  136   HD22  ASN  46          HD22      ASN  46  -5.352   0.261  -1.490
  137    H    LEU  47           HN       LEU  47  -3.735  -3.660   0.448
  138    HA   LEU  47           HA       LEU  47  -1.724  -1.696   1.084
  139    HB2  LEU  47           HB2      LEU  47  -3.676  -3.188   2.824
  140    HB3  LEU  47           HB1      LEU  47  -2.488  -2.060   3.461
  141    HG   LEU  47           HG       LEU  47  -4.364  -0.757   3.335
  142   HD11  LEU  47          HD11      LEU  47  -2.541   0.346   2.174
  143   HD12  LEU  47          HD12      LEU  47  -4.100   0.813   1.498
  144   HD13  LEU  47          HD13      LEU  47  -3.081  -0.347   0.645
  145   HD21  LEU  47          HD21      LEU  47  -6.003  -0.785   1.534
  146   HD22  LEU  47          HD22      LEU  47  -5.808  -2.387   2.245
  147   HD23  LEU  47          HD23      LEU  47  -5.062  -2.012   0.690
  148    H    LYS  48           HN       LYS  48  -2.052  -5.145   1.328
  149    HA   LYS  48           HA       LYS  48  -0.007  -5.630   3.194
  150    HB2  LYS  48           HB2      LYS  48  -0.967  -7.336   0.886
  151    HB3  LYS  48           HB1      LYS  48   0.086  -7.906   2.174
  152    HG2  LYS  48           HG2      LYS  48  -1.645  -7.517   3.811
  153    HG3  LYS  48           HG1      LYS  48  -2.699  -6.839   2.571
  154    HD2  LYS  48           HD2      LYS  48  -3.321  -9.140   3.051
  155    HD3  LYS  48           HD1      LYS  48  -2.702  -9.001   1.405
  156    HE2  LYS  48           HE2      LYS  48  -1.827 -10.989   2.499
  157    HE3  LYS  48           HE1      LYS  48  -0.536  -9.847   2.140
  158    HZ1  LYS  48           HZ1      LYS  48  -1.845 -10.017   4.798
  159    HZ2  LYS  48           HZ2      LYS  48  -0.399  -9.218   4.401
  160    HZ3  LYS  48           HZ3      LYS  48  -0.465 -10.911   4.390
  161    H    ALA  49           HN       ALA  49   0.072  -5.492  -0.350
  162    HA   ALA  49           HA       ALA  49   2.936  -5.735  -0.447
  163    HB1  ALA  49           HB1      ALA  49   1.522  -6.513  -2.293
  164    HB2  ALA  49           HB2      ALA  49   2.688  -5.306  -2.834
  165    HB3  ALA  49           HB3      ALA  49   0.999  -4.856  -2.593
  166    H    HIS  50           HN       HIS  50   0.594  -3.160  -0.327
  167    HA   HIS  50           HA       HIS  50   2.208  -1.043  -1.233
  168    HB2  HIS  50           HB2      HIS  50  -0.372  -1.177  -0.715
  169    HB3  HIS  50           HB1      HIS  50   0.122  -0.592   0.882
  170    HD1  HIS  50           HD1      HIS  50  -1.037   0.665  -2.224
  171    HD2  HIS  50           HD2      HIS  50   1.891   1.836   0.483
  172    HE1  HIS  50           HE1      HIS  50  -0.539   3.092  -2.735
  173    H    LEU  51           HN       LEU  51   1.552  -2.228   2.071
  174    HA   LEU  51           HA       LEU  51   3.316  -0.294   3.242
  175    HB2  LEU  51           HB2      LEU  51   2.059  -2.797   4.359
  176    HB3  LEU  51           HB1      LEU  51   3.013  -1.669   5.314
  177    HG   LEU  51           HG       LEU  51   0.414  -1.027   3.910
  178   HD11  LEU  51          HD11      LEU  51  -0.502  -0.863   6.172
  179   HD12  LEU  51          HD12      LEU  51   1.042  -1.400   6.835
  180   HD13  LEU  51          HD13      LEU  51   0.090  -2.488   5.825
  181   HD21  LEU  51          HD21      LEU  51   0.545   1.097   5.119
  182   HD22  LEU  51          HD22      LEU  51   1.899   0.900   4.006
  183   HD23  LEU  51          HD23      LEU  51   2.135   0.647   5.735
  184    H    LYS  52           HN       LYS  52   3.599  -3.602   2.144
  185    HA   LYS  52           HA       LYS  52   6.074  -4.129   3.435
  186    HB2  LYS  52           HB2      LYS  52   4.398  -5.839   2.572
  187    HB3  LYS  52           HB1      LYS  52   5.031  -5.517   0.966
  188    HG2  LYS  52           HG2      LYS  52   6.946  -6.257   3.116
  189    HG3  LYS  52           HG1      LYS  52   5.921  -7.518   2.433
  190    HD2  LYS  52           HD2      LYS  52   7.430  -5.706   0.604
  191    HD3  LYS  52           HD1      LYS  52   8.292  -7.005   1.426
  192    HE2  LYS  52           HE2      LYS  52   7.554  -7.728  -0.774
  193    HE3  LYS  52           HE1      LYS  52   6.717  -8.634   0.485
  194    HZ1  LYS  52           HZ1      LYS  52   5.229  -7.936  -1.311
  195    HZ2  LYS  52           HZ2      LYS  52   5.591  -6.312  -0.996
  196    HZ3  LYS  52           HZ3      LYS  52   4.778  -7.247   0.171
  197    H    ILE  53           HN       ILE  53   5.190  -2.723   0.329
  198    HA   ILE  53           HA       ILE  53   7.939  -2.772  -0.594
  199    HB   ILE  53           HB       ILE  53   5.924  -2.921  -2.136
  200   HG12  ILE  53          HG12      ILE  53   6.992  -1.539  -3.903
  201   HG13  ILE  53          HG11      ILE  53   8.011  -0.797  -2.671
  202   HG21  ILE  53          HG21      ILE  53   4.956  -0.782  -2.888
  203   HG22  ILE  53          HG22      ILE  53   5.813   0.038  -1.583
  204   HG23  ILE  53          HG23      ILE  53   4.566  -1.150  -1.208
  205   HD11  ILE  53          HD11      ILE  53   7.984  -3.704  -3.445
  206   HD12  ILE  53          HD12      ILE  53   8.981  -2.991  -2.175
  207   HD13  ILE  53          HD13      ILE  53   9.219  -2.517  -3.859
  208    H    HIS  54           HN       HIS  54   5.966  -0.691   1.288
  209    HA   HIS  54           HA       HIS  54   7.633   1.629   0.858
  210    HB2  HIS  54           HB2      HIS  54   5.184   1.060   2.425
  211    HB3  HIS  54           HB1      HIS  54   6.247   2.315   3.060
  212    HD1  HIS  54           HD1      HIS  54   6.299   4.555   1.821
  213    HD2  HIS  54           HD2      HIS  54   4.071   1.624  -0.127
  214    HE1  HIS  54           HE1      HIS  54   5.070   5.717  -0.071
  215    H    ILE  55           HN       ILE  55   7.389  -1.014   3.134
  216    HA   ILE  55           HA       ILE  55   9.597   0.079   4.691
  217    HB   ILE  55           HB       ILE  55   9.458  -1.949   6.049
  218   HG12  ILE  55          HG12      ILE  55   7.220  -2.779   4.185
  219   HG13  ILE  55          HG11      ILE  55   8.820  -3.524   4.249
  220   HG21  ILE  55          HG21      ILE  55   7.240  -1.585   7.005
  221   HG22  ILE  55          HG22      ILE  55   6.756  -0.706   5.556
  222   HG23  ILE  55          HG23      ILE  55   8.021  -0.057   6.599
  223   HD11  ILE  55          HD11      ILE  55   7.187  -4.873   5.417
  224   HD12  ILE  55          HD12      ILE  55   6.773  -3.509   6.457
  225   HD13  ILE  55          HD13      ILE  55   8.378  -4.233   6.549
  226    H    ALA  56           HN       ALA  56   9.259  -1.425   1.803
  227    HA   ALA  56           HA       ALA  56  11.610  -3.100   1.930
  228    HB1  ALA  56           HB1      ALA  56  11.240  -3.448  -0.461
  229    HB2  ALA  56           HB2      ALA  56   9.964  -2.231  -0.445
  230    HB3  ALA  56           HB3      ALA  56   9.763  -3.731   0.461
  231    H    ASP  57           HN       ASP  57  13.598  -2.404   1.667
  232    HA   ASP  57           HA       ASP  57  13.986   0.289   0.541
  233    HB2  ASP  57           HB2      ASP  57  14.640   0.005   2.927
  234    HB3  ASP  57           HB1      ASP  57  15.810  -1.213   2.428
  235    H    GLY  58           HN       GLY  58  14.595   0.128  -1.520
  236    HA2  GLY  58           HA2      GLY  58  16.196  -0.245  -3.186
  237    HA3  GLY  58           HA1      GLY  58  16.988  -1.417  -2.127
  Start of MODEL   10
    1    H1   LYS  30           HT1      LYS  30  -7.760   4.285  10.734
    2    H2   LYS  30           HT2      LYS  30  -7.279   5.757  10.042
    3    H3   LYS  30           HT3      LYS  30  -6.988   4.300   9.223
    4    HA   LYS  30           HA       LYS  30  -9.336   3.921   8.962
    5    HB2  LYS  30           HB2      LYS  30 -10.089   5.099  10.977
    6    HB3  LYS  30           HB1      LYS  30  -9.599   6.636  10.278
    7    HG2  LYS  30           HG2      LYS  30 -11.939   6.494  10.013
    8    HG3  LYS  30           HG1      LYS  30 -11.244   6.187   8.421
    9    HD2  LYS  30           HD2      LYS  30 -11.440   3.723   8.944
   10    HD3  LYS  30           HD1      LYS  30 -12.388   4.185  10.360
   11    HE2  LYS  30           HE2      LYS  30 -13.048   4.573   7.454
   12    HE3  LYS  30           HE1      LYS  30 -13.967   3.700   8.680
   13    HZ1  LYS  30           HZ1      LYS  30 -14.269   5.903   9.807
   14    HZ2  LYS  30           HZ2      LYS  30 -15.059   5.746   8.316
   15    HZ3  LYS  30           HZ3      LYS  30 -13.620   6.634   8.415
   16    H    GLU  31           HN       GLU  31  -9.207   3.973   6.828
   17    HA   GLU  31           HA       GLU  31  -9.210   4.736   4.693
   18    HB2  GLU  31           HB2      GLU  31 -10.080   7.337   5.977
   19    HB3  GLU  31           HB1      GLU  31 -10.250   6.918   4.274
   20    HG2  GLU  31           HG2      GLU  31 -11.812   5.207   4.759
   21    HG3  GLU  31           HG1      GLU  31 -11.490   5.311   6.487
   22    H    HIS  32           HN       HIS  32  -6.725   4.603   5.689
   23    HA   HIS  32           HA       HIS  32  -5.381   7.121   5.089
   24    HB2  HIS  32           HB2      HIS  32  -4.559   4.577   6.416
   25    HB3  HIS  32           HB1      HIS  32  -3.315   5.576   5.671
   26    HD1  HIS  32           HD1      HIS  32  -2.892   5.367   8.521
   27    HD2  HIS  32           HD2      HIS  32  -5.612   8.116   6.983
   28    HE1  HIS  32           HE1      HIS  32  -3.168   7.122  10.300
   29    HE2  HIS  32           HE2      HIS  32  -4.699   8.852   9.289
   30    H    LYS  33           HN       LYS  33  -3.803   7.345   3.552
   31    HA   LYS  33           HA       LYS  33  -3.525   5.188   1.569
   32    HB2  LYS  33           HB2      LYS  33  -3.422   6.822  -0.211
   33    HB3  LYS  33           HB1      LYS  33  -4.911   7.073   0.687
   34    HG2  LYS  33           HG2      LYS  33  -3.945   8.965   1.837
   35    HG3  LYS  33           HG1      LYS  33  -2.392   8.680   1.052
   36    HD2  LYS  33           HD2      LYS  33  -3.491  10.463  -0.103
   37    HD3  LYS  33           HD1      LYS  33  -3.522   9.040  -1.145
   38    HE2  LYS  33           HE2      LYS  33  -5.667  10.178  -1.177
   39    HE3  LYS  33           HE1      LYS  33  -5.817   8.579  -0.450
   40    HZ1  LYS  33           HZ1      LYS  33  -5.477  11.045   1.163
   41    HZ2  LYS  33           HZ2      LYS  33  -5.972   9.512   1.696
   42    HZ3  LYS  33           HZ3      LYS  33  -6.999  10.444   0.720
   43    H    CYS  34           HN       CYS  34  -1.425   5.440   0.320
   44    HA   CYS  34           HA       CYS  34   0.762   5.613   2.049
   45    HB2  CYS  34           HB2      CYS  34   1.224   6.185  -0.823
   46    HB3  CYS  34           HB1      CYS  34   2.014   5.023   0.236
   47    HA   PRO  35           HA       PRO  35   0.986   9.904   2.932
   48    HB2  PRO  35           HB2      PRO  35   3.818  10.015   2.989
   49    HB3  PRO  35           HB1      PRO  35   2.728   9.789   4.357
   50    HG2  PRO  35           HG2      PRO  35   4.245   7.773   2.790
   51    HG3  PRO  35           HG1      PRO  35   3.765   7.754   4.497
   52    HD2  PRO  35           HD2      PRO  35   2.532   6.220   2.687
   53    HD3  PRO  35           HD1      PRO  35   1.628   6.980   4.016
   54    H    HIS  36           HN       HIS  36   3.517   8.866   0.621
   55    HA   HIS  36           HA       HIS  36   3.234  11.458  -0.727
   56    HB2  HIS  36           HB2      HIS  36   5.487  10.500   0.132
   57    HB3  HIS  36           HB1      HIS  36   5.406   9.459  -1.286
   58    HD1  HIS  36           HD1      HIS  36   6.487  10.379  -3.299
   59    HD2  HIS  36           HD2      HIS  36   5.292  13.372  -0.669
   60    HE1  HIS  36           HE1      HIS  36   7.323  12.537  -4.298
   61    HE2  HIS  36           HE2      HIS  36   6.614  14.336  -2.673
   62    H    CYS  37           HN       CYS  37   2.077   8.386  -0.994
   63    HA   CYS  37           HA       CYS  37   2.008   8.457  -3.939
   64    HB2  CYS  37           HB2      CYS  37   3.390   6.638  -3.426
   65    HB3  CYS  37           HB1      CYS  37   2.427   6.175  -2.031
   66    H    ASP  38           HN       ASP  38   0.035   9.002  -4.566
   67    HA   ASP  38           HA       ASP  38  -2.248   8.567  -2.843
   68    HB2  ASP  38           HB2      ASP  38  -3.469   9.930  -4.455
   69    HB3  ASP  38           HB1      ASP  38  -1.943  10.704  -4.040
   70    H    LYS  39           HN       LYS  39  -0.738   6.562  -4.913
   71    HA   LYS  39           HA       LYS  39  -3.236   5.502  -6.032
   72    HB2  LYS  39           HB2      LYS  39  -1.751   4.286  -7.654
   73    HB3  LYS  39           HB1      LYS  39  -1.764   6.036  -7.803
   74    HG2  LYS  39           HG2      LYS  39   0.352   6.025  -6.410
   75    HG3  LYS  39           HG1      LYS  39   0.390   4.280  -6.675
   76    HD2  LYS  39           HD2      LYS  39   0.393   4.648  -9.093
   77    HD3  LYS  39           HD1      LYS  39   0.348   6.393  -8.829
   78    HE2  LYS  39           HE2      LYS  39   2.504   6.182  -7.586
   79    HE3  LYS  39           HE1      LYS  39   2.555   4.486  -8.063
   80    HZ1  LYS  39           HZ1      LYS  39   2.450   5.265 -10.408
   81    HZ2  LYS  39           HZ2      LYS  39   3.864   5.722  -9.588
   82    HZ3  LYS  39           HZ3      LYS  39   2.633   6.857  -9.846
   83    H    LYS  40           HN       LYS  40  -3.756   3.377  -5.931
   84    HA   LYS  40           HA       LYS  40  -2.267   1.537  -4.253
   85    HB2  LYS  40           HB2      LYS  40  -3.285   2.672  -2.476
   86    HB3  LYS  40           HB1      LYS  40  -4.751   2.981  -3.387
   87    HG2  LYS  40           HG2      LYS  40  -5.410   0.655  -3.167
   88    HG3  LYS  40           HG1      LYS  40  -3.908   0.297  -2.312
   89    HD2  LYS  40           HD2      LYS  40  -5.903   0.622  -0.830
   90    HD3  LYS  40           HD1      LYS  40  -4.539   1.678  -0.469
   91    HE2  LYS  40           HE2      LYS  40  -6.565   2.969  -0.369
   92    HE3  LYS  40           HE1      LYS  40  -5.637   3.471  -1.781
   93    HZ1  LYS  40           HZ1      LYS  40  -7.837   3.296  -2.502
   94    HZ2  LYS  40           HZ2      LYS  40  -8.101   1.832  -1.692
   95    HZ3  LYS  40           HZ3      LYS  40  -7.108   1.870  -3.067
   96    H    PHE  41           HN       PHE  41  -2.983  -0.612  -4.532
   97    HA   PHE  41           HA       PHE  41  -4.788  -0.959  -6.822
   98    HB2  PHE  41           HB2      PHE  41  -2.899  -3.013  -5.664
   99    HB3  PHE  41           HB1      PHE  41  -3.708  -3.060  -7.225
  100    HD1  PHE  41           HD2      PHE  41  -3.116  -1.185  -8.881
  101    HD2  PHE  41           HD1      PHE  41  -0.731  -2.196  -5.504
  102    HE1  PHE  41           HE2      PHE  41  -1.182  -0.112  -9.937
  103    HE2  PHE  41           HE1      PHE  41   1.216  -1.118  -6.557
  104    HZ   PHE  41           HZ       PHE  41   1.042  -0.120  -8.735
  105    H    ASN  42           HN       ASN  42  -5.290  -3.692  -6.459
  106    HA   ASN  42           HA       ASN  42  -7.564  -3.760  -4.859
  107    HB2  ASN  42           HB2      ASN  42  -5.812  -5.943  -5.973
  108    HB3  ASN  42           HB1      ASN  42  -7.254  -6.304  -5.027
  109   HD21  ASN  42          HD21      ASN  42  -6.527  -6.726  -7.897
  110   HD22  ASN  42          HD22      ASN  42  -7.832  -6.019  -8.783
  111    H    GLN  43           HN       GLN  43  -7.991  -5.009  -2.912
  112    HA   GLN  43           HA       GLN  43  -6.011  -4.089  -0.995
  113    HB2  GLN  43           HB2      GLN  43  -8.856  -4.982  -0.535
  114    HB3  GLN  43           HB1      GLN  43  -7.822  -4.151   0.621
  115    HG2  GLN  43           HG2      GLN  43  -7.744  -2.203  -0.879
  116    HG3  GLN  43           HG1      GLN  43  -8.826  -3.035  -1.993
  117   HE21  GLN  43          HE21      GLN  43  -8.560  -1.395   1.049
  118   HE22  GLN  43          HE22      GLN  43 -10.254  -1.237   1.346
  119    H    VAL  44           HN       VAL  44  -7.228  -7.128  -2.160
  120    HA   VAL  44           HA       VAL  44  -6.813  -8.607   0.237
  121    HB   VAL  44           HB       VAL  44  -6.900  -9.633  -2.607
  122   HG11  VAL  44          HG11      VAL  44  -5.836 -11.226  -1.097
  123   HG12  VAL  44          HG12      VAL  44  -7.422 -11.803  -1.611
  124   HG13  VAL  44          HG13      VAL  44  -7.211 -11.119   0.003
  125   HG21  VAL  44          HG21      VAL  44  -9.066  -9.440  -0.519
  126   HG22  VAL  44          HG22      VAL  44  -9.228 -10.213  -2.096
  127   HG23  VAL  44          HG23      VAL  44  -8.945  -8.475  -1.990
  128    H    GLY  45           HN       GLY  45  -4.994  -9.036  -2.810
  129    HA2  GLY  45           HA2      GLY  45  -2.695  -9.876  -1.206
  130    HA3  GLY  45           HA1      GLY  45  -2.893 -10.110  -2.941
  131    H    ASN  46           HN       ASN  46  -3.420  -7.660  -3.862
  132    HA   ASN  46           HA       ASN  46  -0.860  -6.702  -4.304
  133    HB2  ASN  46           HB2      ASN  46  -3.537  -5.376  -4.729
  134    HB3  ASN  46           HB1      ASN  46  -2.022  -4.685  -5.292
  135   HD21  ASN  46          HD21      ASN  46  -0.826  -7.196  -6.003
  136   HD22  ASN  46          HD22      ASN  46  -1.639  -7.751  -7.427
  137    H    LEU  47           HN       LEU  47  -3.401  -5.192  -2.316
  138    HA   LEU  47           HA       LEU  47  -1.960  -2.916  -1.627
  139    HB2  LEU  47           HB2      LEU  47  -4.351  -3.078  -1.294
  140    HB3  LEU  47           HB1      LEU  47  -4.130  -4.343  -0.092
  141    HG   LEU  47           HG       LEU  47  -3.015  -2.726   1.395
  142   HD11  LEU  47          HD11      LEU  47  -3.025  -0.360   0.877
  143   HD12  LEU  47          HD12      LEU  47  -3.762  -0.681  -0.692
  144   HD13  LEU  47          HD13      LEU  47  -2.125  -1.244  -0.356
  145   HD21  LEU  47          HD21      LEU  47  -5.719  -1.834   0.401
  146   HD22  LEU  47          HD22      LEU  47  -5.011  -1.436   1.967
  147   HD23  LEU  47          HD23      LEU  47  -5.420  -3.109   1.580
  148    H    LYS  48           HN       LYS  48  -2.050  -6.074  -0.017
  149    HA   LYS  48           HA       LYS  48  -0.725  -5.242   2.333
  150    HB2  LYS  48           HB2      LYS  48  -0.611  -8.013   1.141
  151    HB3  LYS  48           HB1      LYS  48  -0.407  -7.566   2.830
  152    HG2  LYS  48           HG2      LYS  48  -2.802  -6.709   2.720
  153    HG3  LYS  48           HG1      LYS  48  -2.918  -7.583   1.192
  154    HD2  LYS  48           HD2      LYS  48  -3.710  -9.130   2.730
  155    HD3  LYS  48           HD1      LYS  48  -2.018  -9.596   2.540
  156    HE2  LYS  48           HE2      LYS  48  -2.526  -9.618   4.871
  157    HE3  LYS  48           HE1      LYS  48  -1.493  -8.223   4.555
  158    HZ1  LYS  48           HZ1      LYS  48  -4.373  -8.287   5.180
  159    HZ2  LYS  48           HZ2      LYS  48  -3.722  -6.975   4.330
  160    HZ3  LYS  48           HZ3      LYS  48  -3.147  -7.349   5.882
  161    H    ALA  49           HN       ALA  49   0.431  -6.434  -0.770
  162    HA   ALA  49           HA       ALA  49   3.201  -6.402   0.045
  163    HB1  ALA  49           HB1      ALA  49   1.994  -6.632  -2.711
  164    HB2  ALA  49           HB2      ALA  49   2.412  -7.979  -1.656
  165    HB3  ALA  49           HB3      ALA  49   3.680  -6.931  -2.290
  166    H    HIS  50           HN       HIS  50   0.933  -4.283  -1.514
  167    HA   HIS  50           HA       HIS  50   2.764  -2.394  -2.550
  168    HB2  HIS  50           HB2      HIS  50   0.357  -2.628  -3.216
  169    HB3  HIS  50           HB1      HIS  50  -0.090  -1.911  -1.665
  170    HD1  HIS  50           HD1      HIS  50   1.980  -0.971  -4.739
  171    HD2  HIS  50           HD2      HIS  50  -0.351   0.754  -1.751
  172    HE1  HIS  50           HE1      HIS  50   1.784   1.484  -5.317
  173    H    LEU  51           HN       LEU  51   0.990  -2.589   0.520
  174    HA   LEU  51           HA       LEU  51   2.046  -0.200   1.611
  175    HB2  LEU  51           HB2      LEU  51   1.001  -2.692   2.962
  176    HB3  LEU  51           HB1      LEU  51   1.393  -1.199   3.808
  177    HG   LEU  51           HG       LEU  51  -0.755  -1.524   1.704
  178   HD11  LEU  51          HD11      LEU  51  -1.340  -2.607   3.804
  179   HD12  LEU  51          HD12      LEU  51  -2.299  -1.145   3.565
  180   HD13  LEU  51          HD13      LEU  51  -0.940  -1.135   4.689
  181   HD21  LEU  51          HD21      LEU  51   0.005   0.863   3.384
  182   HD22  LEU  51          HD22      LEU  51  -1.387   0.762   2.306
  183   HD23  LEU  51          HD23      LEU  51   0.247   0.698   1.645
  184    H    LYS  52           HN       LYS  52   3.165  -3.512   1.483
  185    HA   LYS  52           HA       LYS  52   5.282  -3.274   3.326
  186    HB2  LYS  52           HB2      LYS  52   4.480  -5.450   2.658
  187    HB3  LYS  52           HB1      LYS  52   4.917  -5.141   0.982
  188    HG2  LYS  52           HG2      LYS  52   7.265  -5.134   1.552
  189    HG3  LYS  52           HG1      LYS  52   6.874  -5.319   3.264
  190    HD2  LYS  52           HD2      LYS  52   6.084  -7.306   1.140
  191    HD3  LYS  52           HD1      LYS  52   7.566  -7.431   2.090
  192    HE2  LYS  52           HE2      LYS  52   6.246  -7.527   4.144
  193    HE3  LYS  52           HE1      LYS  52   4.760  -7.375   3.207
  194    HZ1  LYS  52           HZ1      LYS  52   6.695  -9.594   2.837
  195    HZ2  LYS  52           HZ2      LYS  52   5.118  -9.478   2.216
  196    HZ3  LYS  52           HZ3      LYS  52   5.361  -9.687   3.884
  197    H    ILE  53           HN       ILE  53   5.200  -2.892  -0.223
  198    HA   ILE  53           HA       ILE  53   7.991  -2.476  -0.459
  199    HB   ILE  53           HB       ILE  53   6.585  -3.166  -2.365
  200   HG12  ILE  53          HG12      ILE  53   7.610  -1.671  -4.064
  201   HG13  ILE  53          HG11      ILE  53   8.100  -0.585  -2.769
  202   HG21  ILE  53          HG21      ILE  53   4.634  -1.788  -1.974
  203   HG22  ILE  53          HG22      ILE  53   5.274  -1.492  -3.591
  204   HG23  ILE  53          HG23      ILE  53   5.573  -0.331  -2.297
  205   HD11  ILE  53          HD11      ILE  53   9.003  -3.429  -3.140
  206   HD12  ILE  53          HD12      ILE  53   9.469  -2.374  -1.806
  207   HD13  ILE  53          HD13      ILE  53   9.950  -1.977  -3.457
  208    H    HIS  54           HN       HIS  54   5.422  -0.382   0.503
  209    HA   HIS  54           HA       HIS  54   6.895   2.044  -0.038
  210    HB2  HIS  54           HB2      HIS  54   4.287   1.487   1.359
  211    HB3  HIS  54           HB1      HIS  54   5.029   3.081   1.398
  212    HD1  HIS  54           HD1      HIS  54   5.789   3.699  -1.394
  213    HD2  HIS  54           HD2      HIS  54   2.401   1.455  -0.515
  214    HE1  HIS  54           HE1      HIS  54   4.222   3.955  -3.370
  215    H    ILE  55           HN       ILE  55   6.236  -0.021   2.751
  216    HA   ILE  55           HA       ILE  55   7.565   1.821   4.544
  217    HB   ILE  55           HB       ILE  55   7.181   0.156   6.301
  218   HG12  ILE  55          HG12      ILE  55   5.943  -1.514   4.095
  219   HG13  ILE  55          HG11      ILE  55   7.452  -1.878   4.936
  220   HG21  ILE  55          HG21      ILE  55   4.766   0.700   4.578
  221   HG22  ILE  55          HG22      ILE  55   5.447   1.774   5.803
  222   HG23  ILE  55          HG23      ILE  55   4.726   0.235   6.278
  223   HD11  ILE  55          HD11      ILE  55   4.702  -1.790   6.160
  224   HD12  ILE  55          HD12      ILE  55   6.201  -2.110   7.034
  225   HD13  ILE  55          HD13      ILE  55   5.646  -3.233   5.792
  226    H    ALA  56           HN       ALA  56   8.406  -0.882   2.601
  227    HA   ALA  56           HA       ALA  56  10.834  -1.497   4.035
  228    HB1  ALA  56           HB1      ALA  56   9.879  -2.428   1.327
  229    HB2  ALA  56           HB2      ALA  56   9.635  -3.268   2.860
  230    HB3  ALA  56           HB3      ALA  56  11.264  -3.067   2.214
  231    H    ASP  57           HN       ASP  57  12.933  -1.502   2.832
  232    HA   ASP  57           HA       ASP  57  13.200   1.046   1.385
  233    HB2  ASP  57           HB2      ASP  57  15.566   1.020   2.047
  234    HB3  ASP  57           HB1      ASP  57  14.515   0.935   3.454
  235    H    GLY  58           HN       GLY  58  14.132   1.120  -0.598
  236    HA2  GLY  58           HA2      GLY  58  15.517  -1.126  -1.729
  237    HA3  GLY  58           HA1      GLY  58  13.879  -0.933  -2.368
  Start of MODEL   11
    1    H1   LYS  30           HT1      LYS  30  -3.298   3.863  14.678
    2    H2   LYS  30           HT2      LYS  30  -3.443   4.629  13.170
    3    H3   LYS  30           HT3      LYS  30  -2.113   3.627  13.485
    4    HA   LYS  30           HA       LYS  30  -3.593   1.723  13.704
    5    HB2  LYS  30           HB2      LYS  30  -5.600   3.039  14.336
    6    HB3  LYS  30           HB1      LYS  30  -5.687   3.661  12.694
    7    HG2  LYS  30           HG2      LYS  30  -5.962   1.323  11.890
    8    HG3  LYS  30           HG1      LYS  30  -6.028   0.803  13.575
    9    HD2  LYS  30           HD2      LYS  30  -7.990   2.238  13.929
   10    HD3  LYS  30           HD1      LYS  30  -7.932   2.728  12.233
   11    HE2  LYS  30           HE2      LYS  30  -8.205   0.351  11.588
   12    HE3  LYS  30           HE1      LYS  30  -8.386  -0.056  13.294
   13    HZ1  LYS  30           HZ1      LYS  30 -10.330   1.445  13.357
   14    HZ2  LYS  30           HZ2      LYS  30 -10.533   0.140  12.296
   15    HZ3  LYS  30           HZ3      LYS  30 -10.184   1.677  11.682
   16    H    GLU  31           HN       GLU  31  -2.736   0.592  12.137
   17    HA   GLU  31           HA       GLU  31  -2.377  -0.299  10.084
   18    HB2  GLU  31           HB2      GLU  31  -4.530   1.637   9.215
   19    HB3  GLU  31           HB1      GLU  31  -3.909   0.314   8.239
   20    HG2  GLU  31           HG2      GLU  31  -4.731  -1.292   9.865
   21    HG3  GLU  31           HG1      GLU  31  -5.324   0.021  10.880
   22    H    HIS  32           HN       HIS  32  -2.165   0.606   7.578
   23    HA   HIS  32           HA       HIS  32  -0.465   3.000   7.695
   24    HB2  HIS  32           HB2      HIS  32   0.166   0.335   6.458
   25    HB3  HIS  32           HB1      HIS  32   0.889   1.810   5.826
   26    HD1  HIS  32           HD1      HIS  32   1.596  -0.796   8.143
   27    HD2  HIS  32           HD2      HIS  32   2.170   3.323   8.111
   28    HE1  HIS  32           HE1      HIS  32   3.391  -0.342   9.851
   29    HE2  HIS  32           HE2      HIS  32   3.538   2.170   9.974
   30    H    LYS  33           HN       LYS  33  -0.593   4.369   5.990
   31    HA   LYS  33           HA       LYS  33  -2.578   3.740   3.912
   32    HB2  LYS  33           HB2      LYS  33  -3.491   6.036   4.171
   33    HB3  LYS  33           HB1      LYS  33  -3.739   5.032   5.593
   34    HG2  LYS  33           HG2      LYS  33  -1.777   6.110   6.642
   35    HG3  LYS  33           HG1      LYS  33  -1.665   7.182   5.244
   36    HD2  LYS  33           HD2      LYS  33  -3.898   8.041   5.702
   37    HD3  LYS  33           HD1      LYS  33  -4.058   6.933   7.067
   38    HE2  LYS  33           HE2      LYS  33  -2.084   9.197   6.793
   39    HE3  LYS  33           HE1      LYS  33  -3.479   9.137   7.871
   40    HZ1  LYS  33           HZ1      LYS  33  -1.013   7.492   8.016
   41    HZ2  LYS  33           HZ2      LYS  33  -2.406   7.157   8.926
   42    HZ3  LYS  33           HZ3      LYS  33  -1.577   8.620   9.153
   43    H    CYS  34           HN       CYS  34  -2.514   5.397   2.137
   44    HA   CYS  34           HA       CYS  34   0.271   5.721   1.363
   45    HB2  CYS  34           HB2      CYS  34  -2.334   5.801  -0.149
   46    HB3  CYS  34           HB1      CYS  34  -0.783   6.180  -0.895
   47    HA   PRO  35           HA       PRO  35  -0.227  10.141   2.208
   48    HB2  PRO  35           HB2      PRO  35   2.678  10.202   2.112
   49    HB3  PRO  35           HB1      PRO  35   1.609  10.502   3.484
   50    HG2  PRO  35           HG2      PRO  35   3.213   8.320   3.327
   51    HG3  PRO  35           HG1      PRO  35   1.654   8.308   4.172
   52    HD2  PRO  35           HD2      PRO  35   2.321   7.320   1.416
   53    HD3  PRO  35           HD1      PRO  35   1.330   6.551   2.676
   54    H    HIS  36           HN       HIS  36   2.674   9.312   0.251
   55    HA   HIS  36           HA       HIS  36   1.760  11.332  -1.676
   56    HB2  HIS  36           HB2      HIS  36   3.940  11.820  -2.201
   57    HB3  HIS  36           HB1      HIS  36   4.157  11.275  -0.548
   58    HD1  HIS  36           HD1      HIS  36   4.878  10.337  -4.091
   59    HD2  HIS  36           HD2      HIS  36   5.616   8.882  -0.266
   60    HE1  HIS  36           HE1      HIS  36   6.598   8.526  -4.376
   61    HE2  HIS  36           HE2      HIS  36   6.919   7.560  -2.073
   62    H    CYS  37           HN       CYS  37   2.373   7.953  -1.337
   63    HA   CYS  37           HA       CYS  37   2.321   7.385  -4.162
   64    HB2  CYS  37           HB2      CYS  37   2.084   4.984  -3.231
   65    HB3  CYS  37           HB1      CYS  37   3.587   5.849  -2.921
   66    H    ASP  38           HN       ASP  38   0.357   8.411  -4.734
   67    HA   ASP  38           HA       ASP  38  -2.030   8.114  -3.247
   68    HB2  ASP  38           HB2      ASP  38  -1.311  10.033  -4.784
   69    HB3  ASP  38           HB1      ASP  38  -1.881   9.028  -6.112
   70    H    LYS  39           HN       LYS  39  -0.613   6.107  -5.615
   71    HA   LYS  39           HA       LYS  39  -2.803   5.183  -7.048
   72    HB2  LYS  39           HB2      LYS  39  -0.247   3.803  -6.274
   73    HB3  LYS  39           HB1      LYS  39  -1.464   3.027  -7.276
   74    HG2  LYS  39           HG2      LYS  39  -0.205   3.871  -8.934
   75    HG3  LYS  39           HG1      LYS  39  -1.184   5.305  -8.633
   76    HD2  LYS  39           HD2      LYS  39   0.533   6.290  -7.305
   77    HD3  LYS  39           HD1      LYS  39   1.478   4.797  -7.321
   78    HE2  LYS  39           HE2      LYS  39   0.862   6.583  -9.673
   79    HE3  LYS  39           HE1      LYS  39   2.428   6.364  -8.893
   80    HZ1  LYS  39           HZ1      LYS  39   2.374   5.064 -10.880
   81    HZ2  LYS  39           HZ2      LYS  39   0.907   4.337 -10.448
   82    HZ3  LYS  39           HZ3      LYS  39   2.315   3.989  -9.568
   83    H    LYS  40           HN       LYS  40  -4.510   4.043  -6.577
   84    HA   LYS  40           HA       LYS  40  -4.701   2.628  -4.025
   85    HB2  LYS  40           HB2      LYS  40  -6.802   3.224  -6.121
   86    HB3  LYS  40           HB1      LYS  40  -7.103   2.437  -4.581
   87    HG2  LYS  40           HG2      LYS  40  -6.479   4.457  -3.392
   88    HG3  LYS  40           HG1      LYS  40  -6.075   5.247  -4.918
   89    HD2  LYS  40           HD2      LYS  40  -8.809   4.211  -4.170
   90    HD3  LYS  40           HD1      LYS  40  -8.300   5.897  -4.064
   91    HE2  LYS  40           HE2      LYS  40  -7.892   5.919  -6.478
   92    HE3  LYS  40           HE1      LYS  40  -8.403   4.236  -6.581
   93    HZ1  LYS  40           HZ1      LYS  40 -10.130   5.906  -7.196
   94    HZ2  LYS  40           HZ2      LYS  40 -10.146   6.414  -5.580
   95    HZ3  LYS  40           HZ3      LYS  40 -10.599   4.828  -5.974
   96    H    PHE  41           HN       PHE  41  -4.467   0.486  -3.934
   97    HA   PHE  41           HA       PHE  41  -4.730  -1.052  -6.430
   98    HB2  PHE  41           HB2      PHE  41  -2.868  -1.491  -4.091
   99    HB3  PHE  41           HB1      PHE  41  -3.115  -2.665  -5.378
  100    HD1  PHE  41           HD2      PHE  41  -2.413  -2.125  -7.690
  101    HD2  PHE  41           HD1      PHE  41  -1.477   0.392  -4.390
  102    HE1  PHE  41           HE2      PHE  41  -0.675  -1.021  -9.030
  103    HE2  PHE  41           HE1      PHE  41   0.261   1.510  -5.729
  104    HZ   PHE  41           HZ       PHE  41   0.676   0.789  -8.048
  105    H    ASN  42           HN       ASN  42  -5.136  -3.449  -5.913
  106    HA   ASN  42           HA       ASN  42  -7.568  -3.710  -4.525
  107    HB2  ASN  42           HB2      ASN  42  -5.600  -5.857  -5.360
  108    HB3  ASN  42           HB1      ASN  42  -7.240  -6.162  -4.796
  109   HD21  ASN  42          HD21      ASN  42  -5.260  -5.238  -7.445
  110   HD22  ASN  42          HD22      ASN  42  -6.532  -5.093  -8.614
  111    H    GLN  43           HN       GLN  43  -7.991  -3.944  -2.441
  112    HA   GLN  43           HA       GLN  43  -5.945  -3.374  -0.603
  113    HB2  GLN  43           HB2      GLN  43  -8.762  -4.300  -0.061
  114    HB3  GLN  43           HB1      GLN  43  -7.691  -3.526   1.100
  115    HG2  GLN  43           HG2      GLN  43  -7.640  -1.527  -0.380
  116    HG3  GLN  43           HG1      GLN  43  -8.842  -2.314  -1.400
  117   HE21  GLN  43          HE21      GLN  43  -8.233  -0.748   1.622
  118   HE22  GLN  43          HE22      GLN  43  -9.885  -0.545   2.088
  119    H    VAL  44           HN       VAL  44  -7.290  -6.427  -1.627
  120    HA   VAL  44           HA       VAL  44  -6.460  -7.878   0.697
  121    HB   VAL  44           HB       VAL  44  -7.160  -8.908  -2.056
  122   HG11  VAL  44          HG11      VAL  44  -6.909 -10.413   0.550
  123   HG12  VAL  44          HG12      VAL  44  -5.774 -10.493  -0.797
  124   HG13  VAL  44          HG13      VAL  44  -7.423 -11.084  -1.000
  125   HG21  VAL  44          HG21      VAL  44  -8.802  -8.734   0.470
  126   HG22  VAL  44          HG22      VAL  44  -9.316  -9.471  -1.048
  127   HG23  VAL  44          HG23      VAL  44  -9.003  -7.737  -0.971
  128    H    GLY  45           HN       GLY  45  -5.266  -8.245  -2.662
  129    HA2  GLY  45           HA2      GLY  45  -2.819  -9.387  -1.561
  130    HA3  GLY  45           HA1      GLY  45  -3.325  -9.432  -3.242
  131    H    ASN  46           HN       ASN  46  -3.545  -7.020  -4.116
  132    HA   ASN  46           HA       ASN  46  -0.931  -6.213  -4.560
  133    HB2  ASN  46           HB2      ASN  46  -3.530  -4.733  -4.935
  134    HB3  ASN  46           HB1      ASN  46  -1.982  -4.060  -5.432
  135   HD21  ASN  46          HD21      ASN  46  -0.900  -6.640  -6.244
  136   HD22  ASN  46          HD22      ASN  46  -1.689  -7.037  -7.729
  137    H    LEU  47           HN       LEU  47  -3.310  -4.822  -2.320
  138    HA   LEU  47           HA       LEU  47  -1.759  -2.595  -1.589
  139    HB2  LEU  47           HB2      LEU  47  -4.180  -2.789  -1.179
  140    HB3  LEU  47           HB1      LEU  47  -3.864  -4.020   0.038
  141    HG   LEU  47           HG       LEU  47  -2.617  -2.338   1.370
  142   HD11  LEU  47          HD11      LEU  47  -2.789   0.016   0.808
  143   HD12  LEU  47          HD12      LEU  47  -3.641  -0.385  -0.683
  144   HD13  LEU  47          HD13      LEU  47  -1.958  -0.868  -0.472
  145   HD21  LEU  47          HD21      LEU  47  -4.571  -1.105   2.133
  146   HD22  LEU  47          HD22      LEU  47  -4.978  -2.792   1.814
  147   HD23  LEU  47          HD23      LEU  47  -5.435  -1.539   0.660
  148    H    LYS  48           HN       LYS  48  -1.755  -5.918  -0.404
  149    HA   LYS  48           HA       LYS  48  -0.252  -5.301   1.950
  150    HB2  LYS  48           HB2      LYS  48  -0.672  -7.932   0.527
  151    HB3  LYS  48           HB1      LYS  48   0.155  -7.759   2.068
  152    HG2  LYS  48           HG2      LYS  48  -2.737  -7.233   1.458
  153    HG3  LYS  48           HG1      LYS  48  -2.055  -8.437   2.551
  154    HD2  LYS  48           HD2      LYS  48  -1.196  -6.607   3.972
  155    HD3  LYS  48           HD1      LYS  48  -1.976  -5.441   2.903
  156    HE2  LYS  48           HE2      LYS  48  -3.320  -7.553   4.587
  157    HE3  LYS  48           HE1      LYS  48  -3.365  -5.811   4.840
  158    HZ1  LYS  48           HZ1      LYS  48  -5.350  -6.182   3.793
  159    HZ2  LYS  48           HZ2      LYS  48  -4.750  -7.435   2.820
  160    HZ3  LYS  48           HZ3      LYS  48  -4.376  -5.824   2.453
  161    H    ALA  49           HN       ALA  49   0.543  -6.241  -1.334
  162    HA   ALA  49           HA       ALA  49   3.364  -6.435  -0.835
  163    HB1  ALA  49           HB1      ALA  49   3.572  -6.547  -3.272
  164    HB2  ALA  49           HB2      ALA  49   1.866  -6.134  -3.437
  165    HB3  ALA  49           HB3      ALA  49   2.336  -7.657  -2.682
  166    H    HIS  50           HN       HIS  50   1.097  -3.949  -1.621
  167    HA   HIS  50           HA       HIS  50   3.025  -2.006  -2.438
  168    HB2  HIS  50           HB2      HIS  50   0.651  -1.907  -3.135
  169    HB3  HIS  50           HB1      HIS  50   0.187  -1.597  -1.458
  170    HD1  HIS  50           HD1      HIS  50   2.006   0.027  -4.358
  171    HD2  HIS  50           HD2      HIS  50   0.435   0.990  -0.627
  172    HE1  HIS  50           HE1      HIS  50   2.119   2.548  -4.164
  173    H    LEU  51           HN       LEU  51   1.355  -2.757   0.604
  174    HA   LEU  51           HA       LEU  51   2.599  -0.665   2.078
  175    HB2  LEU  51           HB2      LEU  51   1.409  -3.287   2.992
  176    HB3  LEU  51           HB1      LEU  51   1.941  -2.010   4.077
  177    HG   LEU  51           HG       LEU  51  -0.289  -1.779   2.046
  178   HD11  LEU  51          HD11      LEU  51  -1.741  -1.637   4.022
  179   HD12  LEU  51          HD12      LEU  51  -0.350  -1.973   5.053
  180   HD13  LEU  51          HD13      LEU  51  -0.917  -3.192   3.912
  181   HD21  LEU  51          HD21      LEU  51   0.708   0.179   4.113
  182   HD22  LEU  51          HD22      LEU  51  -0.732   0.380   3.117
  183   HD23  LEU  51          HD23      LEU  51   0.861   0.341   2.363
  184    H    LYS  52           HN       LYS  52   3.587  -3.743   0.965
  185    HA   LYS  52           HA       LYS  52   5.748  -4.229   2.715
  186    HB2  LYS  52           HB2      LYS  52   4.707  -5.893   1.176
  187    HB3  LYS  52           HB1      LYS  52   5.443  -5.051  -0.177
  188    HG2  LYS  52           HG2      LYS  52   7.669  -5.534   0.788
  189    HG3  LYS  52           HG1      LYS  52   6.873  -6.482   2.049
  190    HD2  LYS  52           HD2      LYS  52   5.865  -7.899   0.289
  191    HD3  LYS  52           HD1      LYS  52   6.771  -6.992  -0.922
  192    HE2  LYS  52           HE2      LYS  52   8.865  -7.678   0.209
  193    HE3  LYS  52           HE1      LYS  52   7.906  -8.674   1.305
  194    HZ1  LYS  52           HZ1      LYS  52   8.109  -8.979  -1.643
  195    HZ2  LYS  52           HZ2      LYS  52   7.071  -9.878  -0.655
  196    HZ3  LYS  52           HZ3      LYS  52   8.752 -10.027  -0.469
  197    H    ILE  53           HN       ILE  53   5.478  -2.445  -0.351
  198    HA   ILE  53           HA       ILE  53   8.284  -1.794  -0.347
  199    HB   ILE  53           HB       ILE  53   7.864  -0.397  -2.280
  200   HG12  ILE  53          HG12      ILE  53   4.930  -1.022  -1.883
  201   HG13  ILE  53          HG11      ILE  53   5.686   0.539  -1.582
  202   HG21  ILE  53          HG21      ILE  53   6.388  -3.019  -2.452
  203   HG22  ILE  53          HG22      ILE  53   8.131  -2.795  -2.607
  204   HG23  ILE  53          HG23      ILE  53   7.042  -2.110  -3.814
  205   HD11  ILE  53          HD11      ILE  53   4.514   0.506  -3.709
  206   HD12  ILE  53          HD12      ILE  53   5.512  -0.844  -4.250
  207   HD13  ILE  53          HD13      ILE  53   6.248   0.729  -3.942
  208    H    HIS  54           HN       HIS  54   5.441  -0.465   1.062
  209    HA   HIS  54           HA       HIS  54   6.259   2.171   1.563
  210    HB2  HIS  54           HB2      HIS  54   4.522   0.208   3.008
  211    HB3  HIS  54           HB1      HIS  54   5.035   1.644   3.874
  212    HD1  HIS  54           HD1      HIS  54   3.276   3.372   3.844
  213    HD2  HIS  54           HD2      HIS  54   3.272   1.104   0.345
  214    HE1  HIS  54           HE1      HIS  54   1.315   4.182   2.462
  215    H    ILE  55           HN       ILE  55   6.890  -0.838   3.317
  216    HA   ILE  55           HA       ILE  55   8.682   0.554   5.154
  217    HB   ILE  55           HB       ILE  55   8.735  -1.593   6.390
  218   HG12  ILE  55          HG12      ILE  55   6.699  -2.468   4.323
  219   HG13  ILE  55          HG11      ILE  55   8.340  -3.095   4.475
  220   HG21  ILE  55          HG21      ILE  55   5.994  -0.484   5.803
  221   HG22  ILE  55          HG22      ILE  55   7.139   0.121   6.998
  222   HG23  ILE  55          HG23      ILE  55   6.415  -1.474   7.202
  223   HD11  ILE  55          HD11      ILE  55   6.721  -4.620   5.434
  224   HD12  ILE  55          HD12      ILE  55   6.150  -3.355   6.522
  225   HD13  ILE  55          HD13      ILE  55   7.791  -3.981   6.680
  226    H    ALA  56           HN       ALA  56   9.167  -0.423   2.213
  227    HA   ALA  56           HA       ALA  56  11.178  -2.398   2.310
  228    HB1  ALA  56           HB1      ALA  56   9.976  -1.867   0.250
  229    HB2  ALA  56           HB2      ALA  56  11.717  -1.702   0.028
  230    HB3  ALA  56           HB3      ALA  56  10.714  -0.265   0.225
  231    H    ASP  57           HN       ASP  57  13.330  -2.275   2.609
  232    HA   ASP  57           HA       ASP  57  14.319   0.223   3.718
  233    HB2  ASP  57           HB2      ASP  57  14.639  -1.895   4.956
  234    HB3  ASP  57           HB1      ASP  57  15.606  -2.516   3.623
  235    H    GLY  58           HN       GLY  58  15.978   1.416   2.894
  236    HA2  GLY  58           HA2      GLY  58  17.973   1.564   1.502
  237    HA3  GLY  58           HA1      GLY  58  17.176   0.476   0.362
  Start of MODEL   12
    1    H1   LYS  30           HT1      LYS  30  -2.373   0.020  15.940
    2    H2   LYS  30           HT2      LYS  30  -0.972   0.429  15.075
    3    H3   LYS  30           HT3      LYS  30  -0.984  -0.953  16.055
    4    HA   LYS  30           HA       LYS  30  -1.156  -1.535  13.733
    5    HB2  LYS  30           HB2      LYS  30  -3.187  -2.925  13.886
    6    HB3  LYS  30           HB1      LYS  30  -2.228  -2.999  15.357
    7    HG2  LYS  30           HG2      LYS  30  -3.786  -1.299  16.347
    8    HG3  LYS  30           HG1      LYS  30  -4.796  -1.494  14.913
    9    HD2  LYS  30           HD2      LYS  30  -3.985  -3.764  16.726
   10    HD3  LYS  30           HD1      LYS  30  -5.497  -2.872  16.886
   11    HE2  LYS  30           HE2      LYS  30  -4.733  -4.156  14.288
   12    HE3  LYS  30           HE1      LYS  30  -5.484  -5.097  15.574
   13    HZ1  LYS  30           HZ1      LYS  30  -7.370  -3.610  15.541
   14    HZ2  LYS  30           HZ2      LYS  30  -7.112  -4.246  13.991
   15    HZ3  LYS  30           HZ3      LYS  30  -6.649  -2.651  14.342
   16    H    GLU  31           HN       GLU  31  -2.620  -1.661  11.858
   17    HA   GLU  31           HA       GLU  31  -3.839  -0.746  10.192
   18    HB2  GLU  31           HB2      GLU  31  -5.208   0.705  12.459
   19    HB3  GLU  31           HB1      GLU  31  -5.779   0.696  10.795
   20    HG2  GLU  31           HG2      GLU  31  -6.244  -1.613  10.861
   21    HG3  GLU  31           HG1      GLU  31  -5.356  -1.822  12.369
   22    H    HIS  32           HN       HIS  32  -1.323   0.493  11.019
   23    HA   HIS  32           HA       HIS  32  -1.779   3.293  10.277
   24    HB2  HIS  32           HB2      HIS  32  -0.189   2.684  12.152
   25    HB3  HIS  32           HB1      HIS  32   0.863   1.973  10.932
   26    HD1  HIS  32           HD1      HIS  32   2.536   3.518   9.909
   27    HD2  HIS  32           HD2      HIS  32  -0.621   5.570  11.681
   28    HE1  HIS  32           HE1      HIS  32   3.156   5.953   9.796
   29    HE2  HIS  32           HE2      HIS  32   1.324   7.154  11.041
   30    H    LYS  33           HN       LYS  33  -2.397   3.039   8.164
   31    HA   LYS  33           HA       LYS  33  -0.416   1.909   6.302
   32    HB2  LYS  33           HB2      LYS  33  -2.241   1.683   4.713
   33    HB3  LYS  33           HB1      LYS  33  -2.710   0.928   6.232
   34    HG2  LYS  33           HG2      LYS  33  -4.029   2.875   6.824
   35    HG3  LYS  33           HG1      LYS  33  -3.522   3.688   5.344
   36    HD2  LYS  33           HD2      LYS  33  -4.588   1.847   4.050
   37    HD3  LYS  33           HD1      LYS  33  -5.209   1.202   5.572
   38    HE2  LYS  33           HE2      LYS  33  -6.389   3.302   5.979
   39    HE3  LYS  33           HE1      LYS  33  -5.767   3.953   4.464
   40    HZ1  LYS  33           HZ1      LYS  33  -7.912   3.212   3.977
   41    HZ2  LYS  33           HZ2      LYS  33  -7.730   1.780   4.867
   42    HZ3  LYS  33           HZ3      LYS  33  -6.915   1.970   3.393
   43    H    CYS  34           HN       CYS  34  -0.238   3.104   4.197
   44    HA   CYS  34           HA       CYS  34  -0.104   5.957   4.655
   45    HB2  CYS  34           HB2      CYS  34   0.921   6.075   2.440
   46    HB3  CYS  34           HB1      CYS  34   1.691   4.805   3.383
   47    HA   PRO  35           HA       PRO  35  -3.818   7.019   2.268
   48    HB2  PRO  35           HB2      PRO  35  -2.870   8.758   0.381
   49    HB3  PRO  35           HB1      PRO  35  -3.177   9.220   2.057
   50    HG2  PRO  35           HG2      PRO  35  -0.590   8.440   0.755
   51    HG3  PRO  35           HG1      PRO  35  -0.920   9.787   1.863
   52    HD2  PRO  35           HD2      PRO  35   0.221   7.530   2.726
   53    HD3  PRO  35           HD1      PRO  35  -0.962   8.399   3.728
   54    H    HIS  36           HN       HIS  36  -4.005   7.555  -0.501
   55    HA   HIS  36           HA       HIS  36  -3.567   4.894  -1.536
   56    HB2  HIS  36           HB2      HIS  36  -4.697   7.358  -2.876
   57    HB3  HIS  36           HB1      HIS  36  -4.607   5.766  -3.627
   58    HD1  HIS  36           HD1      HIS  36  -6.350   4.024  -2.922
   59    HD2  HIS  36           HD2      HIS  36  -6.606   7.595  -0.804
   60    HE1  HIS  36           HE1      HIS  36  -8.532   3.922  -1.674
   61    HE2  HIS  36           HE2      HIS  36  -8.561   6.001  -0.251
   62    H    CYS  37           HN       CYS  37  -1.997   7.926  -1.604
   63    HA   CYS  37           HA       CYS  37  -0.057   8.689  -2.464
   64    HB2  CYS  37           HB2      CYS  37   0.442   5.731  -2.848
   65    HB3  CYS  37           HB1      CYS  37   1.651   6.966  -3.180
   66    H    ASP  38           HN       ASP  38   1.448   8.188  -4.642
   67    HA   ASP  38           HA       ASP  38  -0.205   8.966  -6.808
   68    HB2  ASP  38           HB2      ASP  38   2.046   9.743  -6.781
   69    HB3  ASP  38           HB1      ASP  38   2.683   8.109  -6.643
   70    H    LYS  39           HN       LYS  39   1.582   5.962  -6.159
   71    HA   LYS  39           HA       LYS  39   0.104   4.600  -8.279
   72    HB2  LYS  39           HB2      LYS  39   2.417   3.676  -6.556
   73    HB3  LYS  39           HB1      LYS  39   1.681   2.730  -7.845
   74    HG2  LYS  39           HG2      LYS  39   2.401   4.290  -9.497
   75    HG3  LYS  39           HG1      LYS  39   2.959   5.417  -8.261
   76    HD2  LYS  39           HD2      LYS  39   4.851   4.257  -9.199
   77    HD3  LYS  39           HD1      LYS  39   4.615   3.743  -7.529
   78    HE2  LYS  39           HE2      LYS  39   3.593   1.693  -8.251
   79    HE3  LYS  39           HE1      LYS  39   3.617   2.221  -9.931
   80    HZ1  LYS  39           HZ1      LYS  39   6.006   2.171  -9.910
   81    HZ2  LYS  39           HZ2      LYS  39   5.419   0.664  -9.401
   82    HZ3  LYS  39           HZ3      LYS  39   6.034   1.763  -8.265
   83    H    LYS  40           HN       LYS  40  -1.869   4.003  -7.604
   84    HA   LYS  40           HA       LYS  40  -2.239   3.218  -4.806
   85    HB2  LYS  40           HB2      LYS  40  -4.640   3.548  -5.271
   86    HB3  LYS  40           HB1      LYS  40  -3.688   4.982  -5.623
   87    HG2  LYS  40           HG2      LYS  40  -3.670   4.253  -8.023
   88    HG3  LYS  40           HG1      LYS  40  -4.856   3.026  -7.579
   89    HD2  LYS  40           HD2      LYS  40  -6.392   4.742  -6.826
   90    HD3  LYS  40           HD1      LYS  40  -5.193   5.994  -7.169
   91    HE2  LYS  40           HE2      LYS  40  -5.216   5.233  -9.553
   92    HE3  LYS  40           HE1      LYS  40  -6.580   4.191  -9.142
   93    HZ1  LYS  40           HZ1      LYS  40  -7.833   6.143  -8.485
   94    HZ2  LYS  40           HZ2      LYS  40  -7.309   6.284 -10.091
   95    HZ3  LYS  40           HZ3      LYS  40  -6.516   7.146  -8.861
   96    H    PHE  41           HN       PHE  41  -3.559   1.393  -4.267
   97    HA   PHE  41           HA       PHE  41  -3.863  -0.684  -6.292
   98    HB2  PHE  41           HB2      PHE  41  -2.184  -0.988  -3.791
   99    HB3  PHE  41           HB1      PHE  41  -2.733  -2.338  -4.773
  100    HD1  PHE  41           HD2      PHE  41  -1.992  -2.426  -7.195
  101    HD2  PHE  41           HD1      PHE  41  -0.221   0.144  -4.311
  102    HE1  PHE  41           HE2      PHE  41  -0.013  -2.202  -8.628
  103    HE2  PHE  41           HE1      PHE  41   1.769   0.378  -5.738
  104    HZ   PHE  41           HZ       PHE  41   1.898  -0.811  -7.874
  105    H    ASN  42           HN       ASN  42  -4.973  -2.644  -5.285
  106    HA   ASN  42           HA       ASN  42  -7.141  -1.754  -3.590
  107    HB2  ASN  42           HB2      ASN  42  -6.553  -4.377  -4.959
  108    HB3  ASN  42           HB1      ASN  42  -7.925  -4.160  -3.879
  109   HD21  ASN  42          HD21      ASN  42  -9.654  -2.897  -4.529
  110   HD22  ASN  42          HD22      ASN  42  -9.864  -2.381  -6.164
  111    H    GLN  43           HN       GLN  43  -7.672  -2.678  -1.548
  112    HA   GLN  43           HA       GLN  43  -5.250  -2.670  -0.013
  113    HB2  GLN  43           HB2      GLN  43  -8.099  -2.845   0.960
  114    HB3  GLN  43           HB1      GLN  43  -6.688  -2.419   1.921
  115    HG2  GLN  43           HG2      GLN  43  -6.395  -0.488   0.252
  116    HG3  GLN  43           HG1      GLN  43  -8.062  -0.834  -0.213
  117   HE21  GLN  43          HE21      GLN  43  -9.715  -0.545   1.330
  118   HE22  GLN  43          HE22      GLN  43  -9.482   0.461   2.724
  119    H    VAL  44           HN       VAL  44  -6.987  -5.230  -1.307
  120    HA   VAL  44           HA       VAL  44  -6.854  -6.942   1.003
  121    HB   VAL  44           HB       VAL  44  -7.332  -7.743  -1.869
  122   HG11  VAL  44          HG11      VAL  44  -7.970  -9.153   0.718
  123   HG12  VAL  44          HG12      VAL  44  -6.731  -9.614  -0.450
  124   HG13  VAL  44          HG13      VAL  44  -8.434  -9.702  -0.893
  125   HG21  VAL  44          HG21      VAL  44  -9.712  -7.629  -1.354
  126   HG22  VAL  44          HG22      VAL  44  -8.946  -6.054  -1.148
  127   HG23  VAL  44          HG23      VAL  44  -9.343  -7.033   0.265
  128    H    GLY  45           HN       GLY  45  -5.465  -7.563  -2.217
  129    HA2  GLY  45           HA2      GLY  45  -3.178  -8.842  -0.903
  130    HA3  GLY  45           HA1      GLY  45  -3.599  -8.963  -2.609
  131    H    ASN  46           HN       ASN  46  -3.883  -6.251  -3.166
  132    HA   ASN  46           HA       ASN  46  -1.198  -5.861  -3.970
  133    HB2  ASN  46           HB2      ASN  46  -3.473  -3.890  -4.221
  134    HB3  ASN  46           HB1      ASN  46  -2.014  -3.960  -5.203
  135   HD21  ASN  46          HD21      ASN  46  -1.800  -5.616  -6.740
  136   HD22  ASN  46          HD22      ASN  46  -3.188  -6.482  -7.320
  137    H    LEU  47           HN       LEU  47  -3.262  -4.180  -1.612
  138    HA   LEU  47           HA       LEU  47  -1.465  -2.072  -1.087
  139    HB2  LEU  47           HB2      LEU  47  -3.832  -2.009  -0.430
  140    HB3  LEU  47           HB1      LEU  47  -3.535  -3.276   0.755
  141    HG   LEU  47           HG       LEU  47  -1.929  -1.704   1.892
  142   HD11  LEU  47          HD11      LEU  47  -2.122   0.681   1.389
  143   HD12  LEU  47          HD12      LEU  47  -3.166   0.303   0.020
  144   HD13  LEU  47          HD13      LEU  47  -1.483  -0.225   0.014
  145   HD21  LEU  47          HD21      LEU  47  -4.218  -2.078   2.696
  146   HD22  LEU  47          HD22      LEU  47  -4.779  -0.753   1.675
  147   HD23  LEU  47          HD23      LEU  47  -3.666  -0.432   3.005
  148    H    LYS  48           HN       LYS  48  -1.697  -5.331   0.173
  149    HA   LYS  48           HA       LYS  48   0.078  -4.982   2.350
  150    HB2  LYS  48           HB2      LYS  48  -1.464  -6.939   2.016
  151    HB3  LYS  48           HB1      LYS  48  -0.381  -7.514   0.756
  152    HG2  LYS  48           HG2      LYS  48   1.406  -7.785   2.359
  153    HG3  LYS  48           HG1      LYS  48   0.400  -7.090   3.635
  154    HD2  LYS  48           HD2      LYS  48  -1.208  -8.945   3.319
  155    HD3  LYS  48           HD1      LYS  48  -0.108  -9.660   2.136
  156    HE2  LYS  48           HE2      LYS  48   1.604  -9.904   3.832
  157    HE3  LYS  48           HE1      LYS  48   0.580  -9.092   5.018
  158    HZ1  LYS  48           HZ1      LYS  48   0.032 -11.703   3.715
  159    HZ2  LYS  48           HZ2      LYS  48  -1.033 -10.907   4.762
  160    HZ3  LYS  48           HZ3      LYS  48   0.467 -11.456   5.333
  161    H    ALA  49           HN       ALA  49   0.514  -5.643  -1.063
  162    HA   ALA  49           HA       ALA  49   3.376  -5.930  -0.886
  163    HB1  ALA  49           HB1      ALA  49   2.101  -6.997  -2.686
  164    HB2  ALA  49           HB2      ALA  49   3.313  -5.887  -3.329
  165    HB3  ALA  49           HB3      ALA  49   1.615  -5.410  -3.284
  166    H    HIS  50           HN       HIS  50   1.078  -3.371  -1.483
  167    HA   HIS  50           HA       HIS  50   2.843  -1.360  -2.356
  168    HB2  HIS  50           HB2      HIS  50   0.412  -1.215  -2.623
  169    HB3  HIS  50           HB1      HIS  50   0.210  -1.152  -0.872
  170    HD1  HIS  50           HD1      HIS  50   0.621   0.988  -3.795
  171    HD2  HIS  50           HD2      HIS  50   1.253   1.291   0.294
  172    HE1  HIS  50           HE1      HIS  50   0.750   3.452  -3.291
  173    H    LEU  51           HN       LEU  51   1.666  -2.215   0.892
  174    HA   LEU  51           HA       LEU  51   3.196  -0.171   2.175
  175    HB2  LEU  51           HB2      LEU  51   1.887  -2.652   3.295
  176    HB3  LEU  51           HB1      LEU  51   2.611  -1.374   4.268
  177    HG   LEU  51           HG       LEU  51   0.215  -1.080   2.446
  178   HD11  LEU  51          HD11      LEU  51  -0.291  -2.306   4.482
  179   HD12  LEU  51          HD12      LEU  51  -1.012  -0.698   4.533
  180   HD13  LEU  51          HD13      LEU  51   0.455  -1.035   5.450
  181   HD21  LEU  51          HD21      LEU  51   1.606   0.951   2.503
  182   HD22  LEU  51          HD22      LEU  51   1.507   0.956   4.264
  183   HD23  LEU  51          HD23      LEU  51   0.049   1.192   3.300
  184    H    LYS  52           HN       LYS  52   3.780  -3.407   1.143
  185    HA   LYS  52           HA       LYS  52   6.041  -4.041   2.659
  186    HB2  LYS  52           HB2      LYS  52   4.980  -5.727   1.305
  187    HB3  LYS  52           HB1      LYS  52   5.280  -4.809  -0.162
  188    HG2  LYS  52           HG2      LYS  52   6.807  -6.673  -0.004
  189    HG3  LYS  52           HG1      LYS  52   7.691  -5.152   0.124
  190    HD2  LYS  52           HD2      LYS  52   7.740  -5.403   2.568
  191    HD3  LYS  52           HD1      LYS  52   6.880  -6.936   2.420
  192    HE2  LYS  52           HE2      LYS  52   9.617  -6.293   1.336
  193    HE3  LYS  52           HE1      LYS  52   9.247  -7.342   2.703
  194    HZ1  LYS  52           HZ1      LYS  52   9.571  -8.800   0.953
  195    HZ2  LYS  52           HZ2      LYS  52   8.778  -7.816  -0.173
  196    HZ3  LYS  52           HZ3      LYS  52   7.884  -8.655   0.994
  197    H    ILE  53           HN       ILE  53   5.782  -2.413  -0.501
  198    HA   ILE  53           HA       ILE  53   8.603  -2.012  -0.710
  199    HB   ILE  53           HB       ILE  53   8.146  -0.688  -2.677
  200   HG12  ILE  53          HG12      ILE  53   5.219  -0.881  -1.922
  201   HG13  ILE  53          HG11      ILE  53   6.206   0.572  -1.800
  202   HG21  ILE  53          HG21      ILE  53   6.345  -3.096  -2.491
  203   HG22  ILE  53          HG22      ILE  53   8.059  -3.094  -2.913
  204   HG23  ILE  53          HG23      ILE  53   6.883  -2.335  -3.988
  205   HD11  ILE  53          HD11      ILE  53   4.816   0.629  -3.785
  206   HD12  ILE  53          HD12      ILE  53   5.521  -0.891  -4.339
  207   HD13  ILE  53          HD13      ILE  53   6.524   0.554  -4.222
  208    H    HIS  54           HN       HIS  54   6.111  -0.379   0.921
  209    HA   HIS  54           HA       HIS  54   7.297   2.224   1.032
  210    HB2  HIS  54           HB2      HIS  54   4.963   0.890   2.174
  211    HB3  HIS  54           HB1      HIS  54   5.746   1.976   3.314
  212    HD1  HIS  54           HD1      HIS  54   5.301   4.452   3.031
  213    HD2  HIS  54           HD2      HIS  54   4.045   2.177  -0.214
  214    HE1  HIS  54           HE1      HIS  54   3.912   5.991   1.571
  215    H    ILE  55           HN       ILE  55   7.125  -0.516   3.295
  216    HA   ILE  55           HA       ILE  55   8.914   0.799   5.149
  217    HB   ILE  55           HB       ILE  55   7.813  -2.014   5.245
  218   HG12  ILE  55          HG12      ILE  55   6.791   0.510   6.574
  219   HG13  ILE  55          HG11      ILE  55   6.033  -0.294   5.196
  220   HG21  ILE  55          HG21      ILE  55   9.769  -1.722   6.644
  221   HG22  ILE  55          HG22      ILE  55   8.323  -1.863   7.646
  222   HG23  ILE  55          HG23      ILE  55   9.059  -0.284   7.376
  223   HD11  ILE  55          HD11      ILE  55   6.377  -1.460   7.952
  224   HD12  ILE  55          HD12      ILE  55   5.624  -2.263   6.575
  225   HD13  ILE  55          HD13      ILE  55   4.885  -0.819   7.264
  226    H    ALA  56           HN       ALA  56   9.001  -2.073   3.062
  227    HA   ALA  56           HA       ALA  56  11.872  -2.335   3.599
  228    HB1  ALA  56           HB1      ALA  56   9.985  -4.248   2.230
  229    HB2  ALA  56           HB2      ALA  56  10.509  -4.345   3.910
  230    HB3  ALA  56           HB3      ALA  56  11.680  -4.552   2.606
  231    H    ASP  57           HN       ASP  57  13.244  -1.501   2.199
  232    HA   ASP  57           HA       ASP  57  12.290  -0.784  -0.470
  233    HB2  ASP  57           HB2      ASP  57  14.799   0.016   1.021
  234    HB3  ASP  57           HB1      ASP  57  14.394   0.549  -0.606
  235    H    GLY  58           HN       GLY  58  13.444  -1.343  -2.340
  236    HA2  GLY  58           HA2      GLY  58  15.572  -3.308  -2.140
  237    HA3  GLY  58           HA1      GLY  58  14.046  -3.906  -2.796
  Start of MODEL   13
    1    H1   LYS  30           HT1      LYS  30  -8.255   4.855  11.255
    2    H2   LYS  30           HT2      LYS  30  -9.533   4.277  12.212
    3    H3   LYS  30           HT3      LYS  30  -9.844   4.927  10.675
    4    HA   LYS  30           HA       LYS  30  -8.231   2.495  11.168
    5    HB2  LYS  30           HB2      LYS  30 -10.169   1.251  10.302
    6    HB3  LYS  30           HB1      LYS  30 -10.554   2.095  11.792
    7    HG2  LYS  30           HG2      LYS  30 -11.726   3.811  10.562
    8    HG3  LYS  30           HG1      LYS  30 -11.259   3.069   9.031
    9    HD2  LYS  30           HD2      LYS  30 -12.516   1.048   9.646
   10    HD3  LYS  30           HD1      LYS  30 -12.996   1.820  11.158
   11    HE2  LYS  30           HE2      LYS  30 -14.207   3.524   9.960
   12    HE3  LYS  30           HE1      LYS  30 -13.635   2.895   8.414
   13    HZ1  LYS  30           HZ1      LYS  30 -15.900   2.180   8.906
   14    HZ2  LYS  30           HZ2      LYS  30 -15.370   1.432  10.335
   15    HZ3  LYS  30           HZ3      LYS  30 -14.842   0.855   8.827
   16    H    GLU  31           HN       GLU  31  -7.466   1.499   9.322
   17    HA   GLU  31           HA       GLU  31  -6.685   1.293   7.211
   18    HB2  GLU  31           HB2      GLU  31  -9.329   2.600   6.537
   19    HB3  GLU  31           HB1      GLU  31  -8.271   1.810   5.371
   20    HG2  GLU  31           HG2      GLU  31  -8.556  -0.306   6.448
   21    HG3  GLU  31           HG1      GLU  31  -9.450   0.434   7.773
   22    H    HIS  32           HN       HIS  32  -4.914   2.619   7.412
   23    HA   HIS  32           HA       HIS  32  -5.149   5.469   6.982
   24    HB2  HIS  32           HB2      HIS  32  -2.820   5.604   7.502
   25    HB3  HIS  32           HB1      HIS  32  -3.518   4.427   8.607
   26    HD1  HIS  32           HD1      HIS  32  -0.674   4.902   6.508
   27    HD2  HIS  32           HD2      HIS  32  -3.059   1.640   7.520
   28    HE1  HIS  32           HE1      HIS  32   0.692   2.854   5.961
   29    HE2  HIS  32           HE2      HIS  32  -0.702   0.904   6.744
   30    H    LYS  33           HN       LYS  33  -3.693   6.549   5.404
   31    HA   LYS  33           HA       LYS  33  -4.024   5.221   2.800
   32    HB2  LYS  33           HB2      LYS  33  -4.099   7.470   1.861
   33    HB3  LYS  33           HB1      LYS  33  -5.273   7.336   3.165
   34    HG2  LYS  33           HG2      LYS  33  -3.670   8.437   4.681
   35    HG3  LYS  33           HG1      LYS  33  -2.555   8.625   3.329
   36    HD2  LYS  33           HD2      LYS  33  -3.725  10.691   3.644
   37    HD3  LYS  33           HD1      LYS  33  -4.303   9.944   2.155
   38    HE2  LYS  33           HE2      LYS  33  -6.322   9.261   3.166
   39    HE3  LYS  33           HE1      LYS  33  -5.714   9.593   4.787
   40    HZ1  LYS  33           HZ1      LYS  33  -5.724  11.930   4.315
   41    HZ2  LYS  33           HZ2      LYS  33  -7.262  11.298   3.977
   42    HZ3  LYS  33           HZ3      LYS  33  -6.195  11.660   2.708
   43    H    CYS  34           HN       CYS  34  -2.378   5.530   1.179
   44    HA   CYS  34           HA       CYS  34   0.317   5.686   2.167
   45    HB2  CYS  34           HB2      CYS  34  -0.997   4.965  -0.330
   46    HB3  CYS  34           HB1      CYS  34   0.435   5.949  -0.599
   47    HA   PRO  35           HA       PRO  35   0.442  10.049   2.560
   48    HB2  PRO  35           HB2      PRO  35   3.195  10.252   1.947
   49    HB3  PRO  35           HB1      PRO  35   2.462  10.128   3.545
   50    HG2  PRO  35           HG2      PRO  35   3.673   8.014   1.848
   51    HG3  PRO  35           HG1      PRO  35   3.626   8.155   3.614
   52    HD2  PRO  35           HD2      PRO  35   2.076   6.402   2.326
   53    HD3  PRO  35           HD1      PRO  35   1.475   7.282   3.749
   54    H    HIS  36           HN       HIS  36   2.642   9.024  -0.079
   55    HA   HIS  36           HA       HIS  36   1.782  11.403  -1.554
   56    HB2  HIS  36           HB2      HIS  36   3.794  11.112  -2.915
   57    HB3  HIS  36           HB1      HIS  36   4.193  11.176  -1.205
   58    HD1  HIS  36           HD1      HIS  36   4.057   8.778  -4.119
   59    HD2  HIS  36           HD2      HIS  36   5.431   8.912  -0.193
   60    HE1  HIS  36           HE1      HIS  36   5.495   6.735  -3.828
   61    HE2  HIS  36           HE2      HIS  36   6.489   6.958  -1.521
   62    H    CYS  37           HN       CYS  37   1.056   8.151  -1.497
   63    HA   CYS  37           HA       CYS  37   0.908   7.823  -4.382
   64    HB2  CYS  37           HB2      CYS  37  -0.038   5.884  -2.280
   65    HB3  CYS  37           HB1      CYS  37   0.375   5.546  -3.956
   66    H    ASP  38           HN       ASP  38  -0.760   8.669  -5.398
   67    HA   ASP  38           HA       ASP  38  -3.270   9.160  -4.041
   68    HB2  ASP  38           HB2      ASP  38  -3.899  10.396  -6.011
   69    HB3  ASP  38           HB1      ASP  38  -2.236  10.815  -5.616
   70    H    LYS  39           HN       LYS  39  -1.949   6.886  -6.304
   71    HA   LYS  39           HA       LYS  39  -4.411   6.052  -7.443
   72    HB2  LYS  39           HB2      LYS  39  -3.128   4.188  -8.388
   73    HB3  LYS  39           HB1      LYS  39  -2.321   5.729  -8.638
   74    HG2  LYS  39           HG2      LYS  39  -0.797   5.247  -6.801
   75    HG3  LYS  39           HG1      LYS  39  -1.623   3.715  -6.510
   76    HD2  LYS  39           HD2      LYS  39  -0.222   4.475  -9.070
   77    HD3  LYS  39           HD1      LYS  39   0.460   3.446  -7.810
   78    HE2  LYS  39           HE2      LYS  39  -1.341   1.834  -8.139
   79    HE3  LYS  39           HE1      LYS  39  -2.053   2.867  -9.381
   80    HZ1  LYS  39           HZ1      LYS  39   0.671   1.687  -9.537
   81    HZ2  LYS  39           HZ2      LYS  39  -0.133   2.552 -10.756
   82    HZ3  LYS  39           HZ3      LYS  39  -0.705   1.022 -10.278
   83    H    LYS  40           HN       LYS  40  -5.633   4.239  -7.077
   84    HA   LYS  40           HA       LYS  40  -5.170   2.878  -4.501
   85    HB2  LYS  40           HB2      LYS  40  -7.856   3.673  -5.652
   86    HB3  LYS  40           HB1      LYS  40  -7.563   2.920  -4.089
   87    HG2  LYS  40           HG2      LYS  40  -6.513   4.881  -3.248
   88    HG3  LYS  40           HG1      LYS  40  -6.491   5.629  -4.845
   89    HD2  LYS  40           HD2      LYS  40  -8.976   5.608  -4.822
   90    HD3  LYS  40           HD1      LYS  40  -8.911   4.998  -3.167
   91    HE2  LYS  40           HE2      LYS  40  -9.257   7.420  -3.229
   92    HE3  LYS  40           HE1      LYS  40  -7.737   6.993  -2.447
   93    HZ1  LYS  40           HZ1      LYS  40  -6.573   7.537  -4.501
   94    HZ2  LYS  40           HZ2      LYS  40  -7.461   8.866  -3.944
   95    HZ3  LYS  40           HZ3      LYS  40  -8.037   7.948  -5.251
   96    H    PHE  41           HN       PHE  41  -5.724   0.665  -4.450
   97    HA   PHE  41           HA       PHE  41  -6.941  -0.625  -6.685
   98    HB2  PHE  41           HB2      PHE  41  -4.906  -2.033  -7.242
   99    HB3  PHE  41           HB1      PHE  41  -4.859  -0.366  -7.799
  100    HD1  PHE  41           HD1      PHE  41  -3.449  -2.804  -5.471
  101    HD2  PHE  41           HD2      PHE  41  -3.301   1.222  -6.839
  102    HE1  PHE  41           HE1      PHE  41  -1.291  -2.500  -4.327
  103    HE2  PHE  41           HE2      PHE  41  -1.145   1.533  -5.700
  104    HZ   PHE  41           HZ       PHE  41  -0.111  -0.321  -4.486
  105    H    ASN  42           HN       ASN  42  -6.142  -3.168  -6.443
  106    HA   ASN  42           HA       ASN  42  -7.552  -4.174  -4.311
  107    HB2  ASN  42           HB2      ASN  42  -7.045  -5.598  -6.160
  108    HB3  ASN  42           HB1      ASN  42  -5.313  -5.409  -5.913
  109   HD21  ASN  42          HD21      ASN  42  -8.239  -6.875  -4.694
  110   HD22  ASN  42          HD22      ASN  42  -7.456  -8.119  -3.770
  111    H    GLN  43           HN       GLN  43  -7.236  -4.415  -2.222
  112    HA   GLN  43           HA       GLN  43  -4.726  -3.473  -1.103
  113    HB2  GLN  43           HB2      GLN  43  -6.841  -2.586  -0.254
  114    HB3  GLN  43           HB1      GLN  43  -7.348  -4.203   0.206
  115    HG2  GLN  43           HG2      GLN  43  -5.586  -4.325   1.850
  116    HG3  GLN  43           HG1      GLN  43  -4.973  -2.749   1.346
  117   HE21  GLN  43          HE21      GLN  43  -7.656  -1.669   0.960
  118   HE22  GLN  43          HE22      GLN  43  -8.298  -1.381   2.543
  119    H    VAL  44           HN       VAL  44  -6.746  -6.361  -1.055
  120    HA   VAL  44           HA       VAL  44  -5.555  -7.770   0.996
  121    HB   VAL  44           HB       VAL  44  -6.683  -8.948  -1.546
  122   HG11  VAL  44          HG11      VAL  44  -7.147 -10.920  -0.194
  123   HG12  VAL  44          HG12      VAL  44  -6.383 -10.156   1.201
  124   HG13  VAL  44          HG13      VAL  44  -5.418 -10.562  -0.220
  125   HG21  VAL  44          HG21      VAL  44  -8.800  -9.073  -0.330
  126   HG22  VAL  44          HG22      VAL  44  -8.253  -7.406  -0.495
  127   HG23  VAL  44          HG23      VAL  44  -8.065  -8.246   1.043
  128    H    GLY  45           HN       GLY  45  -4.789  -8.150  -2.482
  129    HA2  GLY  45           HA2      GLY  45  -2.389  -9.631  -1.721
  130    HA3  GLY  45           HA1      GLY  45  -3.041  -9.460  -3.350
  131    H    ASN  46           HN       ASN  46  -3.130  -6.878  -3.873
  132    HA   ASN  46           HA       ASN  46  -0.343  -6.496  -4.386
  133    HB2  ASN  46           HB2      ASN  46  -2.779  -4.930  -5.232
  134    HB3  ASN  46           HB1      ASN  46  -1.139  -4.511  -5.724
  135   HD21  ASN  46          HD21      ASN  46  -3.374  -5.319  -7.382
  136   HD22  ASN  46          HD22      ASN  46  -2.865  -6.751  -8.217
  137    H    LEU  47           HN       LEU  47  -2.784  -4.458  -2.738
  138    HA   LEU  47           HA       LEU  47  -0.982  -2.360  -2.227
  139    HB2  LEU  47           HB2      LEU  47  -3.437  -2.116  -2.140
  140    HB3  LEU  47           HB1      LEU  47  -3.458  -3.062  -0.653
  141    HG   LEU  47           HG       LEU  47  -2.142  -1.320   0.475
  142   HD11  LEU  47          HD11      LEU  47  -1.755   0.834  -0.617
  143   HD12  LEU  47          HD12      LEU  47  -2.405   0.186  -2.127
  144   HD13  LEU  47          HD13      LEU  47  -0.912  -0.473  -1.454
  145   HD21  LEU  47          HD21      LEU  47  -4.611  -0.291  -0.917
  146   HD22  LEU  47          HD22      LEU  47  -3.883   0.401   0.532
  147   HD23  LEU  47          HD23      LEU  47  -4.568  -1.224   0.581
  148    H    LYS  48           HN       LYS  48  -1.847  -5.185  -0.247
  149    HA   LYS  48           HA       LYS  48  -0.378  -4.420   2.031
  150    HB2  LYS  48           HB2      LYS  48  -1.209  -7.111   0.973
  151    HB3  LYS  48           HB1      LYS  48  -0.281  -6.944   2.457
  152    HG2  LYS  48           HG2      LYS  48  -2.046  -5.615   3.450
  153    HG3  LYS  48           HG1      LYS  48  -2.967  -5.679   1.945
  154    HD2  LYS  48           HD2      LYS  48  -3.822  -7.306   3.539
  155    HD3  LYS  48           HD1      LYS  48  -3.112  -8.118   2.144
  156    HE2  LYS  48           HE2      LYS  48  -0.989  -8.301   3.537
  157    HE3  LYS  48           HE1      LYS  48  -1.982  -7.824   4.913
  158    HZ1  LYS  48           HZ1      LYS  48  -1.868 -10.198   4.819
  159    HZ2  LYS  48           HZ2      LYS  48  -2.350 -10.216   3.198
  160    HZ3  LYS  48           HZ3      LYS  48  -3.445  -9.734   4.399
  161    H    ALA  49           HN       ALA  49   0.566  -6.215  -0.870
  162    HA   ALA  49           HA       ALA  49   3.243  -6.711  -0.041
  163    HB1  ALA  49           HB1      ALA  49   2.172  -8.010  -1.816
  164    HB2  ALA  49           HB2      ALA  49   3.662  -7.260  -2.389
  165    HB3  ALA  49           HB3      ALA  49   2.099  -6.571  -2.832
  166    H    HIS  50           HN       HIS  50   1.623  -4.091  -1.670
  167    HA   HIS  50           HA       HIS  50   3.940  -2.631  -2.422
  168    HB2  HIS  50           HB2      HIS  50   1.805  -2.244  -3.519
  169    HB3  HIS  50           HB1      HIS  50   1.069  -1.760  -1.986
  170    HD1  HIS  50           HD1      HIS  50   3.473  -0.515  -4.633
  171    HD2  HIS  50           HD2      HIS  50   1.472   0.830  -1.242
  172    HE1  HIS  50           HE1      HIS  50   3.777   1.996  -4.571
  173    H    LEU  51           HN       LEU  51   1.881  -2.688   0.438
  174    HA   LEU  51           HA       LEU  51   3.126  -0.549   1.797
  175    HB2  LEU  51           HB2      LEU  51   1.740  -2.999   2.899
  176    HB3  LEU  51           HB1      LEU  51   2.207  -1.597   3.856
  177    HG   LEU  51           HG       LEU  51   0.217  -1.568   1.580
  178   HD11  LEU  51          HD11      LEU  51  -1.464  -1.270   3.308
  179   HD12  LEU  51          HD12      LEU  51  -0.228  -1.405   4.558
  180   HD13  LEU  51          HD13      LEU  51  -0.602  -2.791   3.537
  181   HD21  LEU  51          HD21      LEU  51   1.386   0.549   1.816
  182   HD22  LEU  51          HD22      LEU  51   1.026   0.574   3.543
  183   HD23  LEU  51          HD23      LEU  51  -0.284   0.696   2.366
  184    H    LYS  52           HN       LYS  52   3.973  -3.901   1.341
  185    HA   LYS  52           HA       LYS  52   5.929  -4.151   3.339
  186    HB2  LYS  52           HB2      LYS  52   5.879  -5.451   0.606
  187    HB3  LYS  52           HB1      LYS  52   6.870  -5.963   1.963
  188    HG2  LYS  52           HG2      LYS  52   3.860  -5.975   1.919
  189    HG3  LYS  52           HG1      LYS  52   4.890  -7.377   1.631
  190    HD2  LYS  52           HD2      LYS  52   5.838  -7.118   3.887
  191    HD3  LYS  52           HD1      LYS  52   4.748  -5.757   4.174
  192    HE2  LYS  52           HE2      LYS  52   2.826  -7.229   3.830
  193    HE3  LYS  52           HE1      LYS  52   3.914  -8.584   3.542
  194    HZ1  LYS  52           HZ1      LYS  52   3.081  -8.613   5.795
  195    HZ2  LYS  52           HZ2      LYS  52   3.675  -7.050   6.075
  196    HZ3  LYS  52           HZ3      LYS  52   4.754  -8.333   5.802
  197    H    ILE  53           HN       ILE  53   6.193  -3.121  -0.065
  198    HA   ILE  53           HA       ILE  53   9.009  -2.704   0.114
  199    HB   ILE  53           HB       ILE  53   7.802  -3.201  -2.025
  200   HG12  ILE  53          HG12      ILE  53   9.489  -0.687  -2.040
  201   HG13  ILE  53          HG11      ILE  53  10.119  -2.330  -1.980
  202   HG21  ILE  53          HG21      ILE  53   5.910  -1.699  -1.763
  203   HG22  ILE  53          HG22      ILE  53   6.780  -1.352  -3.254
  204   HG23  ILE  53          HG23      ILE  53   6.988  -0.306  -1.851
  205   HD11  ILE  53          HD11      ILE  53   9.149  -2.774  -4.177
  206   HD12  ILE  53          HD12      ILE  53  10.266  -1.408  -4.220
  207   HD13  ILE  53          HD13      ILE  53   8.524  -1.124  -4.230
  208    H    HIS  54           HN       HIS  54   6.353  -0.859   1.147
  209    HA   HIS  54           HA       HIS  54   7.690   1.696   1.042
  210    HB2  HIS  54           HB2      HIS  54   5.081   0.702   2.045
  211    HB3  HIS  54           HB1      HIS  54   5.735   2.130   2.835
  212    HD1  HIS  54           HD1      HIS  54   6.138   4.257   1.233
  213    HD2  HIS  54           HD2      HIS  54   3.916   1.120  -0.361
  214    HE1  HIS  54           HE1      HIS  54   4.914   5.188  -0.781
  215    H    ILE  55           HN       ILE  55   7.063  -0.786   3.487
  216    HA   ILE  55           HA       ILE  55   8.361   0.846   5.523
  217    HB   ILE  55           HB       ILE  55   7.731  -0.934   7.104
  218   HG12  ILE  55          HG12      ILE  55   6.419  -2.234   4.701
  219   HG13  ILE  55          HG11      ILE  55   7.856  -2.839   5.533
  220   HG21  ILE  55          HG21      ILE  55   5.297  -0.585   6.964
  221   HG22  ILE  55          HG22      ILE  55   5.499   0.059   5.336
  222   HG23  ILE  55          HG23      ILE  55   6.205   0.903   6.712
  223   HD11  ILE  55          HD11      ILE  55   5.851  -4.057   6.182
  224   HD12  ILE  55          HD12      ILE  55   5.112  -2.559   6.745
  225   HD13  ILE  55          HD13      ILE  55   6.547  -3.194   7.552
  226    H    ALA  56           HN       ALA  56   9.067  -1.880   3.500
  227    HA   ALA  56           HA       ALA  56  11.427  -2.572   5.073
  228    HB1  ALA  56           HB1      ALA  56  11.648  -4.477   3.578
  229    HB2  ALA  56           HB2      ALA  56  10.341  -3.860   2.571
  230    HB3  ALA  56           HB3      ALA  56  10.007  -4.388   4.218
  231    H    ASP  57           HN       ASP  57  13.510  -2.734   4.081
  232    HA   ASP  57           HA       ASP  57  14.017  -0.517   2.271
  233    HB2  ASP  57           HB2      ASP  57  15.807  -2.329   3.884
  234    HB3  ASP  57           HB1      ASP  57  16.450  -1.212   2.685
  235    H    GLY  58           HN       GLY  58  13.768  -0.904   0.174
  236    HA2  GLY  58           HA2      GLY  58  14.850  -3.438  -0.882
  237    HA3  GLY  58           HA1      GLY  58  13.489  -2.581  -1.604
  Start of MODEL   14
    1    H1   LYS  30           HT1      LYS  30   5.608   0.809  13.946
    2    H2   LYS  30           HT2      LYS  30   6.006   2.021  15.052
    3    H3   LYS  30           HT3      LYS  30   7.044   1.691  13.748
    4    HA   LYS  30           HA       LYS  30   4.322   2.850  13.623
    5    HB2  LYS  30           HB2      LYS  30   7.005   3.997  12.818
    6    HB3  LYS  30           HB1      LYS  30   5.453   4.818  12.735
    7    HG2  LYS  30           HG2      LYS  30   5.276   4.751  15.166
    8    HG3  LYS  30           HG1      LYS  30   6.825   3.908  15.260
    9    HD2  LYS  30           HD2      LYS  30   7.896   5.854  14.155
   10    HD3  LYS  30           HD1      LYS  30   6.346   6.692  14.190
   11    HE2  LYS  30           HE2      LYS  30   7.890   5.731  16.597
   12    HE3  LYS  30           HE1      LYS  30   7.796   7.397  16.033
   13    HZ1  LYS  30           HZ1      LYS  30   5.328   7.203  16.351
   14    HZ2  LYS  30           HZ2      LYS  30   6.247   7.180  17.773
   15    HZ3  LYS  30           HZ3      LYS  30   5.613   5.734  17.154
   16    H    GLU  31           HN       GLU  31   3.257   1.953  11.989
   17    HA   GLU  31           HA       GLU  31   4.609   0.767   9.745
   18    HB2  GLU  31           HB2      GLU  31   1.675   1.242  10.295
   19    HB3  GLU  31           HB1      GLU  31   2.294   0.348   8.914
   20    HG2  GLU  31           HG2      GLU  31   3.276  -1.306  10.384
   21    HG3  GLU  31           HG1      GLU  31   2.742  -0.392  11.794
   22    H    HIS  32           HN       HIS  32   4.738   1.510   7.678
   23    HA   HIS  32           HA       HIS  32   4.258   4.386   7.351
   24    HB2  HIS  32           HB2      HIS  32   6.575   3.316   7.024
   25    HB3  HIS  32           HB1      HIS  32   5.918   2.629   5.543
   26    HD1  HIS  32           HD1      HIS  32   7.608   5.551   6.819
   27    HD2  HIS  32           HD2      HIS  32   4.985   4.756   3.688
   28    HE1  HIS  32           HE1      HIS  32   7.860   7.469   5.218
   29    HE2  HIS  32           HE2      HIS  32   6.167   7.048   3.410
   30    H    LYS  33           HN       LYS  33   2.208   4.598   6.635
   31    HA   LYS  33           HA       LYS  33   1.102   2.785   4.657
   32    HB2  LYS  33           HB2      LYS  33  -0.976   3.966   4.962
   33    HB3  LYS  33           HB1      LYS  33  -0.269   3.695   6.549
   34    HG2  LYS  33           HG2      LYS  33   0.507   5.988   6.628
   35    HG3  LYS  33           HG1      LYS  33  -0.115   6.273   5.001
   36    HD2  LYS  33           HD2      LYS  33  -1.773   5.513   7.407
   37    HD3  LYS  33           HD1      LYS  33  -1.623   7.140   6.743
   38    HE2  LYS  33           HE2      LYS  33  -2.705   4.758   5.238
   39    HE3  LYS  33           HE1      LYS  33  -3.698   5.963   6.050
   40    HZ1  LYS  33           HZ1      LYS  33  -3.543   6.450   3.710
   41    HZ2  LYS  33           HZ2      LYS  33  -1.852   6.468   3.772
   42    HZ3  LYS  33           HZ3      LYS  33  -2.737   7.660   4.581
   43    H    CYS  34           HN       CYS  34   0.016   3.682   2.708
   44    HA   CYS  34           HA       CYS  34   1.696   5.282   1.118
   45    HB2  CYS  34           HB2      CYS  34  -1.169   4.394   0.839
   46    HB3  CYS  34           HB1      CYS  34  -0.398   5.415  -0.369
   47    HA   PRO  35           HA       PRO  35   0.071   9.209   2.644
   48    HB2  PRO  35           HB2      PRO  35   2.498  10.502   2.128
   49    HB3  PRO  35           HB1      PRO  35   2.006   9.788   3.664
   50    HG2  PRO  35           HG2      PRO  35   4.108   8.915   1.982
   51    HG3  PRO  35           HG1      PRO  35   3.464   8.081   3.406
   52    HD2  PRO  35           HD2      PRO  35   2.888   7.625   0.518
   53    HD3  PRO  35           HD1      PRO  35   2.911   6.465   1.865
   54    H    HIS  36           HN       HIS  36   2.512   9.566   0.087
   55    HA   HIS  36           HA       HIS  36   0.916  11.528  -1.271
   56    HB2  HIS  36           HB2      HIS  36   2.792  11.825  -2.732
   57    HB3  HIS  36           HB1      HIS  36   3.431  11.622  -1.108
   58    HD1  HIS  36           HD1      HIS  36   5.229   9.882  -0.838
   59    HD2  HIS  36           HD2      HIS  36   3.089   9.423  -4.382
   60    HE1  HIS  36           HE1      HIS  36   6.382   8.041  -2.106
   61    HE2  HIS  36           HE2      HIS  36   5.206   7.938  -4.331
   62    H    CYS  37           HN       CYS  37   0.987   8.201  -1.293
   63    HA   CYS  37           HA       CYS  37   0.699   7.733  -4.096
   64    HB2  CYS  37           HB2      CYS  37  -0.139   5.841  -1.915
   65    HB3  CYS  37           HB1      CYS  37   0.482   5.460  -3.518
   66    H    ASP  38           HN       ASP  38  -1.045   8.356  -5.179
   67    HA   ASP  38           HA       ASP  38  -3.673   8.334  -3.861
   68    HB2  ASP  38           HB2      ASP  38  -4.440   9.717  -5.703
   69    HB3  ASP  38           HB1      ASP  38  -2.961  10.406  -5.047
   70    H    LYS  39           HN       LYS  39  -1.851   6.231  -5.454
   71    HA   LYS  39           HA       LYS  39  -3.464   5.469  -7.660
   72    HB2  LYS  39           HB2      LYS  39  -1.359   3.789  -6.310
   73    HB3  LYS  39           HB1      LYS  39  -1.913   3.690  -7.979
   74    HG2  LYS  39           HG2      LYS  39  -1.065   6.126  -8.156
   75    HG3  LYS  39           HG1      LYS  39  -0.152   5.737  -6.696
   76    HD2  LYS  39           HD2      LYS  39   1.256   5.332  -8.591
   77    HD3  LYS  39           HD1      LYS  39   0.795   3.772  -7.911
   78    HE2  LYS  39           HE2      LYS  39   0.675   3.815 -10.378
   79    HE3  LYS  39           HE1      LYS  39  -0.877   3.467  -9.615
   80    HZ1  LYS  39           HZ1      LYS  39  -1.591   5.705  -9.999
   81    HZ2  LYS  39           HZ2      LYS  39  -1.022   5.078 -11.466
   82    HZ3  LYS  39           HZ3      LYS  39  -0.063   6.160 -10.576
   83    H    LYS  40           HN       LYS  40  -5.182   4.244  -7.727
   84    HA   LYS  40           HA       LYS  40  -5.920   2.709  -5.335
   85    HB2  LYS  40           HB2      LYS  40  -7.432   4.570  -6.200
   86    HB3  LYS  40           HB1      LYS  40  -7.753   3.539  -7.585
   87    HG2  LYS  40           HG2      LYS  40  -9.503   3.409  -5.865
   88    HG3  LYS  40           HG1      LYS  40  -8.726   1.853  -6.164
   89    HD2  LYS  40           HD2      LYS  40  -7.538   1.929  -4.147
   90    HD3  LYS  40           HD1      LYS  40  -7.792   3.664  -3.962
   91    HE2  LYS  40           HE2      LYS  40  -9.154   2.286  -2.413
   92    HE3  LYS  40           HE1      LYS  40 -10.110   3.334  -3.457
   93    HZ1  LYS  40           HZ1      LYS  40 -10.747   1.513  -4.786
   94    HZ2  LYS  40           HZ2      LYS  40 -10.951   1.006  -3.181
   95    HZ3  LYS  40           HZ3      LYS  40  -9.610   0.477  -4.075
   96    H    PHE  41           HN       PHE  41  -5.871   0.586  -5.443
   97    HA   PHE  41           HA       PHE  41  -6.439  -0.866  -7.856
   98    HB2  PHE  41           HB2      PHE  41  -4.170  -2.121  -7.622
   99    HB3  PHE  41           HB1      PHE  41  -4.204  -0.575  -8.462
  100    HD1  PHE  41           HD1      PHE  41  -3.738  -1.866  -4.976
  101    HD2  PHE  41           HD2      PHE  41  -2.549   0.919  -7.968
  102    HE1  PHE  41           HE1      PHE  41  -1.997  -0.997  -3.471
  103    HE2  PHE  41           HE2      PHE  41  -0.807   1.793  -6.467
  104    HZ   PHE  41           HZ       PHE  41  -0.531   0.836  -4.218
  105    H    ASN  42           HN       ASN  42  -5.325  -3.310  -7.126
  106    HA   ASN  42           HA       ASN  42  -7.197  -4.316  -5.319
  107    HB2  ASN  42           HB2      ASN  42  -4.542  -5.522  -6.131
  108    HB3  ASN  42           HB1      ASN  42  -5.849  -6.388  -5.332
  109   HD21  ASN  42          HD21      ASN  42  -6.240  -7.836  -6.910
  110   HD22  ASN  42          HD22      ASN  42  -6.849  -7.423  -8.474
  111    H    GLN  43           HN       GLN  43  -7.338  -4.103  -3.222
  112    HA   GLN  43           HA       GLN  43  -5.109  -2.972  -1.755
  113    HB2  GLN  43           HB2      GLN  43  -7.958  -3.515  -0.914
  114    HB3  GLN  43           HB1      GLN  43  -6.766  -2.646   0.044
  115    HG2  GLN  43           HG2      GLN  43  -6.648  -0.898  -1.609
  116    HG3  GLN  43           HG1      GLN  43  -7.734  -1.790  -2.673
  117   HE21  GLN  43          HE21      GLN  43  -9.418  -2.674  -0.453
  118   HE22  GLN  43          HE22      GLN  43 -10.351  -1.297   0.011
  119    H    VAL  44           HN       VAL  44  -7.063  -5.920  -1.693
  120    HA   VAL  44           HA       VAL  44  -6.219  -6.820   0.819
  121    HB   VAL  44           HB       VAL  44  -6.914  -9.121  -0.009
  122   HG11  VAL  44          HG11      VAL  44  -8.407  -7.656   1.233
  123   HG12  VAL  44          HG12      VAL  44  -9.293  -8.524  -0.020
  124   HG13  VAL  44          HG13      VAL  44  -8.863  -6.831  -0.259
  125   HG21  VAL  44          HG21      VAL  44  -7.710  -7.524  -2.445
  126   HG22  VAL  44          HG22      VAL  44  -8.199  -9.183  -2.103
  127   HG23  VAL  44          HG23      VAL  44  -6.500  -8.806  -2.391
  128    H    GLY  45           HN       GLY  45  -4.963  -7.812  -2.391
  129    HA2  GLY  45           HA2      GLY  45  -2.764  -9.166  -1.021
  130    HA3  GLY  45           HA1      GLY  45  -3.136  -9.257  -2.745
  131    H    ASN  46           HN       ASN  46  -3.070  -6.819  -3.687
  132    HA   ASN  46           HA       ASN  46  -0.280  -6.487  -3.924
  133    HB2  ASN  46           HB2      ASN  46  -1.840  -6.099  -5.791
  134    HB3  ASN  46           HB1      ASN  46  -2.469  -4.679  -4.962
  135   HD21  ASN  46          HD21      ASN  46  -1.249  -2.804  -4.920
  136   HD22  ASN  46          HD22      ASN  46   0.166  -2.582  -5.894
  137    H    LEU  47           HN       LEU  47  -2.753  -4.430  -2.392
  138    HA   LEU  47           HA       LEU  47  -1.033  -2.274  -1.865
  139    HB2  LEU  47           HB2      LEU  47  -3.479  -2.090  -1.784
  140    HB3  LEU  47           HB1      LEU  47  -3.504  -3.092  -0.338
  141    HG   LEU  47           HG       LEU  47  -2.218  -1.349   0.866
  142   HD11  LEU  47          HD11      LEU  47  -2.591   0.230  -1.681
  143   HD12  LEU  47          HD12      LEU  47  -1.062  -0.337  -1.012
  144   HD13  LEU  47          HD13      LEU  47  -2.001   0.883  -0.152
  145   HD21  LEU  47          HD21      LEU  47  -4.066   0.252   1.050
  146   HD22  LEU  47          HD22      LEU  47  -4.650  -1.411   1.009
  147   HD23  LEU  47          HD23      LEU  47  -4.775  -0.396  -0.428
  148    H    LYS  48           HN       LYS  48  -1.666  -5.235  -0.071
  149    HA   LYS  48           HA       LYS  48  -0.298  -4.516   2.288
  150    HB2  LYS  48           HB2      LYS  48  -0.852  -7.181   1.002
  151    HB3  LYS  48           HB1      LYS  48   0.091  -7.052   2.481
  152    HG2  LYS  48           HG2      LYS  48  -1.838  -5.881   3.530
  153    HG3  LYS  48           HG1      LYS  48  -2.773  -6.216   2.069
  154    HD2  LYS  48           HD2      LYS  48  -3.221  -7.878   3.800
  155    HD3  LYS  48           HD1      LYS  48  -2.426  -8.614   2.406
  156    HE2  LYS  48           HE2      LYS  48  -1.447  -9.481   4.425
  157    HE3  LYS  48           HE1      LYS  48  -0.272  -8.460   3.599
  158    HZ1  LYS  48           HZ1      LYS  48  -1.964  -7.562   5.871
  159    HZ2  LYS  48           HZ2      LYS  48  -0.696  -6.699   5.147
  160    HZ3  LYS  48           HZ3      LYS  48  -0.367  -8.106   6.028
  161    H    ALA  49           HN       ALA  49   0.833  -6.150  -0.660
  162    HA   ALA  49           HA       ALA  49   3.540  -6.325   0.134
  163    HB1  ALA  49           HB1      ALA  49   2.600  -7.659  -1.690
  164    HB2  ALA  49           HB2      ALA  49   4.014  -6.743  -2.217
  165    HB3  ALA  49           HB3      ALA  49   2.395  -6.192  -2.649
  166    H    HIS  50           HN       HIS  50   1.616  -3.799  -1.217
  167    HA   HIS  50           HA       HIS  50   3.736  -2.079  -2.032
  168    HB2  HIS  50           HB2      HIS  50   1.386  -2.011  -2.903
  169    HB3  HIS  50           HB1      HIS  50   0.866  -1.390  -1.334
  170    HD1  HIS  50           HD1      HIS  50   1.838  -0.247  -4.607
  171    HD2  HIS  50           HD2      HIS  50   2.230   1.149  -0.717
  172    HE1  HIS  50           HE1      HIS  50   2.258   2.241  -4.789
  173    H    LEU  51           HN       LEU  51   1.864  -2.511   0.932
  174    HA   LEU  51           HA       LEU  51   3.072  -0.318   2.309
  175    HB2  LEU  51           HB2      LEU  51   1.696  -2.796   3.368
  176    HB3  LEU  51           HB1      LEU  51   2.185  -1.425   4.357
  177    HG   LEU  51           HG       LEU  51   0.132  -1.367   2.143
  178   HD11  LEU  51          HD11      LEU  51  -1.465  -0.986   3.960
  179   HD12  LEU  51          HD12      LEU  51  -0.171  -1.213   5.137
  180   HD13  LEU  51          HD13      LEU  51  -0.663  -2.551   4.098
  181   HD21  LEU  51          HD21      LEU  51   1.342   0.744   2.307
  182   HD22  LEU  51          HD22      LEU  51   1.017   0.806   4.040
  183   HD23  LEU  51          HD23      LEU  51  -0.314   0.918   2.888
  184    H    LYS  52           HN       LYS  52   3.830  -3.683   1.796
  185    HA   LYS  52           HA       LYS  52   5.841  -4.021   3.709
  186    HB2  LYS  52           HB2      LYS  52   5.491  -5.269   0.983
  187    HB3  LYS  52           HB1      LYS  52   6.725  -5.773   2.127
  188    HG2  LYS  52           HG2      LYS  52   3.759  -5.854   2.630
  189    HG3  LYS  52           HG1      LYS  52   4.756  -7.230   2.155
  190    HD2  LYS  52           HD2      LYS  52   5.097  -5.601   4.674
  191    HD3  LYS  52           HD1      LYS  52   4.332  -7.188   4.574
  192    HE2  LYS  52           HE2      LYS  52   6.447  -8.121   3.715
  193    HE3  LYS  52           HE1      LYS  52   7.199  -6.540   3.901
  194    HZ1  LYS  52           HZ1      LYS  52   6.758  -6.660   6.283
  195    HZ2  LYS  52           HZ2      LYS  52   7.708  -7.968   5.769
  196    HZ3  LYS  52           HZ3      LYS  52   6.060  -8.192   6.091
  197    H    ILE  53           HN       ILE  53   6.047  -2.861   0.351
  198    HA   ILE  53           HA       ILE  53   8.869  -2.534   0.424
  199    HB   ILE  53           HB       ILE  53   7.933  -2.816  -1.725
  200   HG12  ILE  53          HG12      ILE  53   8.623   0.117  -1.509
  201   HG13  ILE  53          HG11      ILE  53   9.808  -1.186  -1.576
  202   HG21  ILE  53          HG21      ILE  53   5.664  -2.101  -1.283
  203   HG22  ILE  53          HG22      ILE  53   6.291  -1.293  -2.720
  204   HG23  ILE  53          HG23      ILE  53   6.191  -0.421  -1.191
  205   HD11  ILE  53          HD11      ILE  53   9.016  -1.790  -3.802
  206   HD12  ILE  53          HD12      ILE  53   9.543  -0.109  -3.735
  207   HD13  ILE  53          HD13      ILE  53   7.823  -0.494  -3.730
  208    H    HIS  54           HN       HIS  54   6.210  -0.515   1.430
  209    HA   HIS  54           HA       HIS  54   7.654   1.925   1.553
  210    HB2  HIS  54           HB2      HIS  54   5.134   0.911   2.741
  211    HB3  HIS  54           HB1      HIS  54   5.894   2.285   3.531
  212    HD1  HIS  54           HD1      HIS  54   6.708   4.115   1.302
  213    HD2  HIS  54           HD2      HIS  54   3.214   1.847   1.174
  214    HE1  HIS  54           HE1      HIS  54   5.107   5.331  -0.259
  215    H    ILE  55           HN       ILE  55   7.444  -0.836   3.678
  216    HA   ILE  55           HA       ILE  55   8.925   0.564   5.774
  217    HB   ILE  55           HB       ILE  55   7.833  -2.258   5.740
  218   HG12  ILE  55          HG12      ILE  55   6.777   0.240   7.094
  219   HG13  ILE  55          HG11      ILE  55   6.077  -0.518   5.660
  220   HG21  ILE  55          HG21      ILE  55   8.231  -2.202   8.167
  221   HG22  ILE  55          HG22      ILE  55   8.997  -0.623   7.992
  222   HG23  ILE  55          HG23      ILE  55   9.726  -2.043   7.244
  223   HD11  ILE  55          HD11      ILE  55   6.272  -1.757   8.398
  224   HD12  ILE  55          HD12      ILE  55   5.570  -2.515   6.969
  225   HD13  ILE  55          HD13      ILE  55   4.822  -1.075   7.662
  226    H    ALA  56           HN       ALA  56   9.213  -2.361   3.771
  227    HA   ALA  56           HA       ALA  56  12.073  -2.496   4.408
  228    HB1  ALA  56           HB1      ALA  56  10.768  -4.553   4.701
  229    HB2  ALA  56           HB2      ALA  56  12.000  -4.737   3.453
  230    HB3  ALA  56           HB3      ALA  56  10.313  -4.502   2.999
  231    H    ASP  57           HN       ASP  57  13.462  -1.653   3.024
  232    HA   ASP  57           HA       ASP  57  12.509  -0.804   0.407
  233    HB2  ASP  57           HB2      ASP  57  14.575   0.515   0.323
  234    HB3  ASP  57           HB1      ASP  57  13.687   0.821   1.814
  235    H    GLY  58           HN       GLY  58  13.553  -1.296  -1.525
  236    HA2  GLY  58           HA2      GLY  58  15.786  -2.645  -2.125
  237    HA3  GLY  58           HA1      GLY  58  14.731  -3.944  -1.561
  Start of MODEL   15
    1    H1   LYS  30           HT1      LYS  30  -4.768  -5.148  10.711
    2    H2   LYS  30           HT2      LYS  30  -3.288  -4.943   9.909
    3    H3   LYS  30           HT3      LYS  30  -4.619  -5.599   9.086
    4    HA   LYS  30           HA       LYS  30  -4.291  -3.314   8.438
    5    HB2  LYS  30           HB2      LYS  30  -6.571  -4.295   8.566
    6    HB3  LYS  30           HB1      LYS  30  -6.714  -3.698  10.212
    7    HG2  LYS  30           HG2      LYS  30  -6.660  -1.423   9.452
    8    HG3  LYS  30           HG1      LYS  30  -6.318  -1.944   7.800
    9    HD2  LYS  30           HD2      LYS  30  -8.481  -3.146   7.775
   10    HD3  LYS  30           HD1      LYS  30  -8.827  -2.503   9.378
   11    HE2  LYS  30           HE2      LYS  30  -8.906  -0.274   8.558
   12    HE3  LYS  30           HE1      LYS  30  -8.242  -0.759   6.998
   13    HZ1  LYS  30           HZ1      LYS  30 -10.246  -2.050   6.589
   14    HZ2  LYS  30           HZ2      LYS  30 -10.622  -0.416   6.849
   15    HZ3  LYS  30           HZ3      LYS  30 -10.894  -1.556   8.078
   16    H    GLU  31           HN       GLU  31  -2.926  -1.807   9.148
   17    HA   GLU  31           HA       GLU  31  -3.205  -0.857  11.921
   18    HB2  GLU  31           HB2      GLU  31  -1.049  -1.865  11.609
   19    HB3  GLU  31           HB1      GLU  31  -0.792  -0.996  10.105
   20    HG2  GLU  31           HG2      GLU  31   0.557  -0.059  11.871
   21    HG3  GLU  31           HG1      GLU  31  -0.652   1.105  11.337
   22    H    HIS  32           HN       HIS  32  -1.566   0.570   9.120
   23    HA   HIS  32           HA       HIS  32  -3.461   2.782   9.101
   24    HB2  HIS  32           HB2      HIS  32  -0.564   2.996   9.849
   25    HB3  HIS  32           HB1      HIS  32  -1.339   4.327   8.996
   26    HD1  HIS  32           HD1      HIS  32  -1.185   2.662  12.334
   27    HD2  HIS  32           HD2      HIS  32  -3.327   5.692  10.470
   28    HE1  HIS  32           HE1      HIS  32  -2.344   3.903  14.180
   29    HE2  HIS  32           HE2      HIS  32  -3.701   5.683  13.026
   30    H    LYS  33           HN       LYS  33  -3.572   3.848   7.156
   31    HA   LYS  33           HA       LYS  33  -2.401   2.378   4.930
   32    HB2  LYS  33           HB2      LYS  33  -4.039   3.508   3.553
   33    HB3  LYS  33           HB1      LYS  33  -4.837   2.838   4.965
   34    HG2  LYS  33           HG2      LYS  33  -4.846   5.049   6.011
   35    HG3  LYS  33           HG1      LYS  33  -4.046   5.717   4.587
   36    HD2  LYS  33           HD2      LYS  33  -6.383   6.183   4.406
   37    HD3  LYS  33           HD1      LYS  33  -5.985   4.936   3.221
   38    HE2  LYS  33           HE2      LYS  33  -8.047   4.344   4.297
   39    HE3  LYS  33           HE1      LYS  33  -6.791   3.227   4.828
   40    HZ1  LYS  33           HZ1      LYS  33  -6.598   4.435   6.889
   41    HZ2  LYS  33           HZ2      LYS  33  -8.220   4.006   6.648
   42    HZ3  LYS  33           HZ3      LYS  33  -7.715   5.598   6.365
   43    H    CYS  34           HN       CYS  34  -1.367   3.455   3.176
   44    HA   CYS  34           HA       CYS  34  -0.071   5.979   3.916
   45    HB2  CYS  34           HB2      CYS  34   1.428   4.156   3.227
   46    HB3  CYS  34           HB1      CYS  34   0.568   4.014   1.697
   47    HA   PRO  35           HA       PRO  35  -3.033   7.555   0.852
   48    HB2  PRO  35           HB2      PRO  35  -3.222   9.994   2.272
   49    HB3  PRO  35           HB1      PRO  35  -4.370   8.658   2.304
   50    HG2  PRO  35           HG2      PRO  35  -2.791   9.512   4.447
   51    HG3  PRO  35           HG1      PRO  35  -3.657   7.971   4.344
   52    HD2  PRO  35           HD2      PRO  35  -0.774   8.569   3.850
   53    HD3  PRO  35           HD1      PRO  35  -1.531   7.115   4.540
   54    H    HIS  36           HN       HIS  36   0.057   8.336   1.731
   55    HA   HIS  36           HA       HIS  36   0.377  10.887   0.493
   56    HB2  HIS  36           HB2      HIS  36   1.808  10.012   2.340
   57    HB3  HIS  36           HB1      HIS  36   2.489   8.847   1.213
   58    HD1  HIS  36           HD1      HIS  36   2.452  12.520   2.006
   59    HD2  HIS  36           HD2      HIS  36   4.446   9.852  -0.485
   60    HE1  HIS  36           HE1      HIS  36   4.397  13.799   1.056
   61    HE2  HIS  36           HE2      HIS  36   5.709  12.094  -0.252
   62    H    CYS  37           HN       CYS  37   0.424   7.624  -0.638
   63    HA   CYS  37           HA       CYS  37   1.477   8.553  -3.227
   64    HB2  CYS  37           HB2      CYS  37   1.283   5.674  -2.351
   65    HB3  CYS  37           HB1      CYS  37   2.198   6.335  -3.704
   66    H    ASP  38           HN       ASP  38   0.417   7.804  -5.128
   67    HA   ASP  38           HA       ASP  38  -2.440   7.280  -4.671
   68    HB2  ASP  38           HB2      ASP  38  -1.739   9.350  -5.942
   69    HB3  ASP  38           HB1      ASP  38  -1.149   8.283  -7.211
   70    H    LYS  39           HN       LYS  39  -0.098   5.382  -4.771
   71    HA   LYS  39           HA       LYS  39  -0.538   3.805  -7.120
   72    HB2  LYS  39           HB2      LYS  39   0.916   3.084  -4.575
   73    HB3  LYS  39           HB1      LYS  39   0.931   2.149  -6.063
   74    HG2  LYS  39           HG2      LYS  39   2.085   4.871  -5.597
   75    HG3  LYS  39           HG1      LYS  39   2.939   3.382  -5.990
   76    HD2  LYS  39           HD2      LYS  39   0.969   4.764  -7.800
   77    HD3  LYS  39           HD1      LYS  39   2.720   4.939  -7.910
   78    HE2  LYS  39           HE2      LYS  39   2.990   2.641  -8.484
   79    HE3  LYS  39           HE1      LYS  39   1.304   2.286  -8.100
   80    HZ1  LYS  39           HZ1      LYS  39   1.815   2.513 -10.520
   81    HZ2  LYS  39           HZ2      LYS  39   2.116   4.162 -10.252
   82    HZ3  LYS  39           HZ3      LYS  39   0.576   3.520  -9.958
   83    H    LYS  40           HN       LYS  40  -1.853   2.199  -7.415
   84    HA   LYS  40           HA       LYS  40  -3.450   1.206  -5.159
   85    HB2  LYS  40           HB2      LYS  40  -4.761   2.957  -6.280
   86    HB3  LYS  40           HB1      LYS  40  -4.559   2.132  -7.820
   87    HG2  LYS  40           HG2      LYS  40  -6.737   1.643  -7.007
   88    HG3  LYS  40           HG1      LYS  40  -5.765   0.179  -6.854
   89    HD2  LYS  40           HD2      LYS  40  -6.953   0.329  -4.835
   90    HD3  LYS  40           HD1      LYS  40  -5.335   0.921  -4.448
   91    HE2  LYS  40           HE2      LYS  40  -6.908   2.401  -3.430
   92    HE3  LYS  40           HE1      LYS  40  -6.200   3.245  -4.807
   93    HZ1  LYS  40           HZ1      LYS  40  -8.152   2.707  -6.111
   94    HZ2  LYS  40           HZ2      LYS  40  -8.604   3.538  -4.705
   95    HZ3  LYS  40           HZ3      LYS  40  -8.828   1.861  -4.806
   96    H    PHE  41           HN       PHE  41  -3.712  -0.930  -5.156
   97    HA   PHE  41           HA       PHE  41  -3.088  -2.424  -7.621
   98    HB2  PHE  41           HB2      PHE  41  -2.420  -3.268  -4.789
   99    HB3  PHE  41           HB1      PHE  41  -2.027  -4.148  -6.262
  100    HD1  PHE  41           HD2      PHE  41  -0.388  -3.147  -7.874
  101    HD2  PHE  41           HD1      PHE  41  -1.013  -1.570  -3.968
  102    HE1  PHE  41           HE2      PHE  41   1.764  -1.961  -8.010
  103    HE2  PHE  41           HE1      PHE  41   1.137  -0.381  -4.100
  104    HZ   PHE  41           HZ       PHE  41   2.529  -0.577  -6.125
  105    H    ASN  42           HN       ASN  42  -3.710  -4.959  -6.774
  106    HA   ASN  42           HA       ASN  42  -6.511  -5.084  -6.939
  107    HB2  ASN  42           HB2      ASN  42  -4.830  -6.895  -7.529
  108    HB3  ASN  42           HB1      ASN  42  -4.699  -7.226  -5.810
  109   HD21  ASN  42          HD21      ASN  42  -5.637  -8.850  -8.112
  110   HD22  ASN  42          HD22      ASN  42  -7.207  -9.408  -7.654
  111    H    GLN  43           HN       GLN  43  -8.077  -5.648  -5.379
  112    HA   GLN  43           HA       GLN  43  -8.277  -4.094  -3.186
  113    HB2  GLN  43           HB2      GLN  43  -9.430  -6.876  -3.397
  114    HB3  GLN  43           HB1      GLN  43 -10.034  -5.578  -2.377
  115    HG2  GLN  43           HG2      GLN  43 -10.663  -4.293  -4.306
  116    HG3  GLN  43           HG1      GLN  43  -9.929  -5.485  -5.379
  117   HE21  GLN  43          HE21      GLN  43 -11.751  -6.344  -2.518
  118   HE22  GLN  43          HE22      GLN  43 -13.096  -7.041  -3.361
  119    H    VAL  44           HN       VAL  44  -7.089  -7.450  -3.093
  120    HA   VAL  44           HA       VAL  44  -6.834  -7.370  -0.226
  121    HB   VAL  44           HB       VAL  44  -5.911  -9.673  -0.474
  122   HG11  VAL  44          HG11      VAL  44  -8.024 -10.675  -1.185
  123   HG12  VAL  44          HG12      VAL  44  -8.519  -9.139  -1.896
  124   HG13  VAL  44          HG13      VAL  44  -8.298  -9.273  -0.151
  125   HG21  VAL  44          HG21      VAL  44  -6.450  -9.185  -3.403
  126   HG22  VAL  44          HG22      VAL  44  -6.089 -10.753  -2.680
  127   HG23  VAL  44          HG23      VAL  44  -4.877  -9.473  -2.657
  128    H    GLY  45           HN       GLY  45  -4.646  -7.087  -2.953
  129    HA2  GLY  45           HA2      GLY  45  -2.310  -7.320  -1.217
  130    HA3  GLY  45           HA1      GLY  45  -2.295  -7.186  -2.974
  131    H    ASN  46           HN       ASN  46  -4.304  -4.884  -2.466
  132    HA   ASN  46           HA       ASN  46  -2.715  -2.868  -3.339
  133    HB2  ASN  46           HB2      ASN  46  -5.157  -2.763  -3.355
  134    HB3  ASN  46           HB1      ASN  46  -5.175  -2.584  -1.603
  135   HD21  ASN  46          HD21      ASN  46  -6.125  -0.607  -1.533
  136   HD22  ASN  46          HD22      ASN  46  -5.385   0.830  -2.130
  137    H    LEU  47           HN       LEU  47  -3.947  -2.804   0.019
  138    HA   LEU  47           HA       LEU  47  -2.086  -0.722   0.652
  139    HB2  LEU  47           HB2      LEU  47  -4.414  -0.944   1.590
  140    HB3  LEU  47           HB1      LEU  47  -3.818  -2.280   2.570
  141    HG   LEU  47           HG       LEU  47  -2.228  -0.757   3.672
  142   HD11  LEU  47          HD11      LEU  47  -1.920   0.825   1.837
  143   HD12  LEU  47          HD12      LEU  47  -2.390   1.652   3.322
  144   HD13  LEU  47          HD13      LEU  47  -3.576   1.394   2.042
  145   HD21  LEU  47          HD21      LEU  47  -3.883   0.549   4.941
  146   HD22  LEU  47          HD22      LEU  47  -4.387  -1.124   4.702
  147   HD23  LEU  47          HD23      LEU  47  -5.100   0.159   3.724
  148    H    LYS  48           HN       LYS  48  -2.200  -4.147   1.031
  149    HA   LYS  48           HA       LYS  48  -0.311  -4.420   3.111
  150    HB2  LYS  48           HB2      LYS  48  -1.901  -6.187   2.367
  151    HB3  LYS  48           HB1      LYS  48  -0.963  -6.366   0.893
  152    HG2  LYS  48           HG2      LYS  48   0.971  -7.072   2.197
  153    HG3  LYS  48           HG1      LYS  48   0.037  -6.881   3.683
  154    HD2  LYS  48           HD2      LYS  48  -1.568  -8.566   2.855
  155    HD3  LYS  48           HD1      LYS  48  -0.557  -8.792   1.425
  156    HE2  LYS  48           HE2      LYS  48   1.302  -9.496   2.873
  157    HE3  LYS  48           HE1      LYS  48   0.260  -9.301   4.283
  158    HZ1  LYS  48           HZ1      LYS  48  -0.235 -11.177   2.033
  159    HZ2  LYS  48           HZ2      LYS  48  -1.189 -11.015   3.426
  160    HZ3  LYS  48           HZ3      LYS  48   0.395 -11.612   3.546
  161    H    ALA  49           HN       ALA  49   0.012  -4.696  -0.430
  162    HA   ALA  49           HA       ALA  49   2.850  -4.977  -0.353
  163    HB1  ALA  49           HB1      ALA  49   1.483  -5.818  -2.217
  164    HB2  ALA  49           HB2      ALA  49   2.761  -4.733  -2.763
  165    HB3  ALA  49           HB3      ALA  49   1.097  -4.157  -2.667
  166    H    HIS  50           HN       HIS  50   0.659  -2.289  -0.427
  167    HA   HIS  50           HA       HIS  50   2.389  -0.281  -1.344
  168    HB2  HIS  50           HB2      HIS  50  -0.133  -0.139  -0.949
  169    HB3  HIS  50           HB1      HIS  50   0.248   0.116   0.752
  170    HD1  HIS  50           HD1      HIS  50  -0.723   2.053  -1.976
  171    HD2  HIS  50           HD2      HIS  50   2.378   2.380   0.775
  172    HE1  HIS  50           HE1      HIS  50  -0.026   4.482  -1.982
  173    H    LEU  51           HN       LEU  51   1.633  -1.323   1.986
  174    HA   LEU  51           HA       LEU  51   3.655   0.345   3.130
  175    HB2  LEU  51           HB2      LEU  51   1.851  -1.799   4.156
  176    HB3  LEU  51           HB1      LEU  51   3.250  -1.345   5.123
  177    HG   LEU  51           HG       LEU  51   2.433   0.998   5.154
  178   HD11  LEU  51          HD11      LEU  51  -0.013  -0.144   3.815
  179   HD12  LEU  51          HD12      LEU  51   1.144   0.971   3.087
  180   HD13  LEU  51          HD13      LEU  51   0.153   1.494   4.451
  181   HD21  LEU  51          HD21      LEU  51   0.460  -1.050   6.154
  182   HD22  LEU  51          HD22      LEU  51   0.607   0.611   6.726
  183   HD23  LEU  51          HD23      LEU  51   1.927  -0.531   6.985
  184    H    LYS  52           HN       LYS  52   3.499  -2.971   2.034
  185    HA   LYS  52           HA       LYS  52   5.873  -3.941   3.165
  186    HB2  LYS  52           HB2      LYS  52   4.064  -5.276   2.016
  187    HB3  LYS  52           HB1      LYS  52   4.713  -4.716   0.484
  188    HG2  LYS  52           HG2      LYS  52   6.824  -5.824   0.950
  189    HG3  LYS  52           HG1      LYS  52   6.208  -6.356   2.517
  190    HD2  LYS  52           HD2      LYS  52   4.418  -7.595   1.360
  191    HD3  LYS  52           HD1      LYS  52   5.106  -7.103  -0.187
  192    HE2  LYS  52           HE2      LYS  52   5.827  -9.345   0.330
  193    HE3  LYS  52           HE1      LYS  52   7.203  -8.248   0.412
  194    HZ1  LYS  52           HZ1      LYS  52   7.155  -9.843   2.251
  195    HZ2  LYS  52           HZ2      LYS  52   5.668  -9.214   2.767
  196    HZ3  LYS  52           HZ3      LYS  52   7.055  -8.244   2.805
  197    H    ILE  53           HN       ILE  53   5.262  -2.184   0.159
  198    HA   ILE  53           HA       ILE  53   7.959  -2.346  -0.772
  199    HB   ILE  53           HB       ILE  53   5.601  -1.784  -1.974
  200   HG12  ILE  53          HG12      ILE  53   7.693  -2.525  -3.058
  201   HG13  ILE  53          HG11      ILE  53   6.858  -1.283  -3.980
  202   HG21  ILE  53          HG21      ILE  53   5.590   0.516  -2.769
  203   HG22  ILE  53          HG22      ILE  53   6.970   0.887  -1.734
  204   HG23  ILE  53          HG23      ILE  53   5.423   0.442  -1.013
  205   HD11  ILE  53          HD11      ILE  53   8.449   0.385  -3.127
  206   HD12  ILE  53          HD12      ILE  53   9.243  -0.915  -4.015
  207   HD13  ILE  53          HD13      ILE  53   9.293  -0.893  -2.252
  208    H    HIS  54           HN       HIS  54   6.282  -0.303   1.447
  209    HA   HIS  54           HA       HIS  54   8.193   1.850   1.346
  210    HB2  HIS  54           HB2      HIS  54   5.797   1.207   2.988
  211    HB3  HIS  54           HB1      HIS  54   7.005   2.259   3.717
  212    HD1  HIS  54           HD1      HIS  54   6.730   4.685   3.208
  213    HD2  HIS  54           HD2      HIS  54   4.904   2.266   0.355
  214    HE1  HIS  54           HE1      HIS  54   5.548   6.240   1.597
  215    H    ILE  55           HN       ILE  55   7.652  -1.017   3.295
  216    HA   ILE  55           HA       ILE  55   9.746  -0.449   5.161
  217    HB   ILE  55           HB       ILE  55   8.369  -3.071   4.546
  218   HG12  ILE  55          HG12      ILE  55   7.864  -1.070   6.766
  219   HG13  ILE  55          HG11      ILE  55   6.845  -1.291   5.340
  220   HG21  ILE  55          HG21      ILE  55  10.514  -3.438   5.628
  221   HG22  ILE  55          HG22      ILE  55   9.194  -3.800   6.741
  222   HG23  ILE  55          HG23      ILE  55  10.090  -2.291   6.899
  223   HD11  ILE  55          HD11      ILE  55   7.368  -3.361   7.462
  224   HD12  ILE  55          HD12      ILE  55   6.330  -3.561   6.052
  225   HD13  ILE  55          HD13      ILE  55   5.907  -2.388   7.298
  226    H    ALA  56           HN       ALA  56   9.449  -2.390   2.227
  227    HA   ALA  56           HA       ALA  56  12.183  -3.363   2.474
  228    HB1  ALA  56           HB1      ALA  56  10.444  -4.895   1.708
  229    HB2  ALA  56           HB2      ALA  56  11.668  -4.654   0.461
  230    HB3  ALA  56           HB3      ALA  56  10.111  -3.839   0.337
  231    H    ASP  57           HN       ASP  57  13.616  -3.225   0.540
  232    HA   ASP  57           HA       ASP  57  13.461  -0.560  -0.668
  233    HB2  ASP  57           HB2      ASP  57  15.817  -0.795  -1.182
  234    HB3  ASP  57           HB1      ASP  57  15.565  -1.191   0.512
  235    H    GLY  58           HN       GLY  58  13.539  -0.278  -2.881
  236    HA2  GLY  58           HA2      GLY  58  13.985  -1.833  -4.975
  237    HA3  GLY  58           HA1      GLY  58  12.479  -2.546  -4.382
  Start of MODEL   16
    1    H1   LYS  30           HT1      LYS  30  -4.413  -4.302   6.982
    2    H2   LYS  30           HT2      LYS  30  -5.650  -4.170   8.132
    3    H3   LYS  30           HT3      LYS  30  -4.030  -4.159   8.632
    4    HA   LYS  30           HA       LYS  30  -4.816  -1.950   8.727
    5    HB2  LYS  30           HB2      LYS  30  -3.140  -2.387   6.244
    6    HB3  LYS  30           HB1      LYS  30  -3.327  -0.848   7.077
    7    HG2  LYS  30           HG2      LYS  30  -2.257  -1.724   9.046
    8    HG3  LYS  30           HG1      LYS  30  -2.179  -3.335   8.331
    9    HD2  LYS  30           HD2      LYS  30  -0.721  -2.449   6.559
   10    HD3  LYS  30           HD1      LYS  30  -0.767  -0.863   7.333
   11    HE2  LYS  30           HE2      LYS  30   0.302  -1.745   9.304
   12    HE3  LYS  30           HE1      LYS  30   0.236  -3.382   8.653
   13    HZ1  LYS  30           HZ1      LYS  30   1.713  -2.686   6.869
   14    HZ2  LYS  30           HZ2      LYS  30   2.432  -2.432   8.381
   15    HZ3  LYS  30           HZ3      LYS  30   1.792  -1.120   7.515
   16    H    GLU  31           HN       GLU  31  -5.903  -0.152   7.770
   17    HA   GLU  31           HA       GLU  31  -7.837  -1.052   5.727
   18    HB2  GLU  31           HB2      GLU  31  -9.555   0.215   6.977
   19    HB3  GLU  31           HB1      GLU  31  -8.871  -1.114   7.903
   20    HG2  GLU  31           HG2      GLU  31  -7.289   0.663   8.872
   21    HG3  GLU  31           HG1      GLU  31  -8.462   1.823   8.245
   22    H    HIS  32           HN       HIS  32  -5.382   0.965   6.100
   23    HA   HIS  32           HA       HIS  32  -6.651   3.047   4.444
   24    HB2  HIS  32           HB2      HIS  32  -4.279   3.322   6.306
   25    HB3  HIS  32           HB1      HIS  32  -4.816   4.568   5.190
   26    HD1  HIS  32           HD1      HIS  32  -4.743   4.406   8.488
   27    HD2  HIS  32           HD2      HIS  32  -8.023   4.528   5.929
   28    HE1  HIS  32           HE1      HIS  32  -6.647   5.315   9.863
   29    HE2  HIS  32           HE2      HIS  32  -8.647   5.280   8.331
   30    H    LYS  33           HN       LYS  33  -5.828   3.333   2.442
   31    HA   LYS  33           HA       LYS  33  -3.633   1.640   1.619
   32    HB2  LYS  33           HB2      LYS  33  -4.113   2.272  -0.618
   33    HB3  LYS  33           HB1      LYS  33  -5.668   2.072   0.172
   34    HG2  LYS  33           HG2      LYS  33  -5.953   4.448   0.347
   35    HG3  LYS  33           HG1      LYS  33  -4.316   4.729  -0.257
   36    HD2  LYS  33           HD2      LYS  33  -4.982   3.585  -2.375
   37    HD3  LYS  33           HD1      LYS  33  -6.635   3.520  -1.762
   38    HE2  LYS  33           HE2      LYS  33  -6.357   5.405  -3.264
   39    HE3  LYS  33           HE1      LYS  33  -6.673   5.964  -1.623
   40    HZ1  LYS  33           HZ1      LYS  33  -3.960   5.781  -2.817
   41    HZ2  LYS  33           HZ2      LYS  33  -4.380   6.499  -1.337
   42    HZ3  LYS  33           HZ3      LYS  33  -4.892   7.195  -2.796
   43    H    CYS  34           HN       CYS  34  -1.869   2.656   0.273
   44    HA   CYS  34           HA       CYS  34  -0.371   4.374   1.879
   45    HB2  CYS  34           HB2      CYS  34   0.486   2.782   0.109
   46    HB3  CYS  34           HB1      CYS  34   0.004   3.975  -1.094
   47    HA   PRO  35           HA       PRO  35  -2.533   8.128   0.737
   48    HB2  PRO  35           HB2      PRO  35  -0.786   9.470   2.642
   49    HB3  PRO  35           HB1      PRO  35  -2.525   9.190   2.732
   50    HG2  PRO  35           HG2      PRO  35  -0.752   7.940   4.361
   51    HG3  PRO  35           HG1      PRO  35  -2.282   7.199   3.852
   52    HD2  PRO  35           HD2      PRO  35   0.487   6.751   2.794
   53    HD3  PRO  35           HD1      PRO  35  -0.796   5.567   3.127
   54    H    HIS  36           HN       HIS  36   0.967   7.842   0.915
   55    HA   HIS  36           HA       HIS  36   1.494  10.357  -0.326
   56    HB2  HIS  36           HB2      HIS  36   3.137   9.312   1.164
   57    HB3  HIS  36           HB1      HIS  36   3.315   7.968   0.039
   58    HD1  HIS  36           HD1      HIS  36   3.650  11.769  -0.165
   59    HD2  HIS  36           HD2      HIS  36   5.467   8.293  -1.561
   60    HE1  HIS  36           HE1      HIS  36   5.649  12.529  -1.496
   61    HE2  HIS  36           HE2      HIS  36   6.804  10.407  -2.222
   62    H    CYS  37           HN       CYS  37   1.081   7.078  -1.469
   63    HA   CYS  37           HA       CYS  37   1.640   7.960  -4.208
   64    HB2  CYS  37           HB2      CYS  37   1.091   5.143  -3.254
   65    HB3  CYS  37           HB1      CYS  37   1.778   5.633  -4.799
   66    H    ASP  38           HN       ASP  38  -0.032   8.601  -5.390
   67    HA   ASP  38           HA       ASP  38  -2.603   8.679  -4.128
   68    HB2  ASP  38           HB2      ASP  38  -1.896   9.656  -6.891
   69    HB3  ASP  38           HB1      ASP  38  -3.231  10.188  -5.877
   70    H    LYS  39           HN       LYS  39  -1.387   6.182  -5.745
   71    HA   LYS  39           HA       LYS  39  -3.403   5.792  -7.757
   72    HB2  LYS  39           HB2      LYS  39  -1.454   3.749  -6.689
   73    HB3  LYS  39           HB1      LYS  39  -2.327   3.691  -8.214
   74    HG2  LYS  39           HG2      LYS  39  -1.081   5.833  -8.815
   75    HG3  LYS  39           HG1      LYS  39  -0.034   5.465  -7.443
   76    HD2  LYS  39           HD2      LYS  39  -0.515   3.770  -9.885
   77    HD3  LYS  39           HD1      LYS  39   0.974   4.603  -9.438
   78    HE2  LYS  39           HE2      LYS  39   1.176   3.168  -7.468
   79    HE3  LYS  39           HE1      LYS  39  -0.310   2.335  -7.923
   80    HZ1  LYS  39           HZ1      LYS  39   2.255   2.363  -9.406
   81    HZ2  LYS  39           HZ2      LYS  39   0.817   1.742 -10.047
   82    HZ3  LYS  39           HZ3      LYS  39   1.507   1.032  -8.668
   83    H    LYS  40           HN       LYS  40  -4.996   4.198  -7.806
   84    HA   LYS  40           HA       LYS  40  -5.838   3.205  -5.165
   85    HB2  LYS  40           HB2      LYS  40  -7.478   4.672  -6.252
   86    HB3  LYS  40           HB1      LYS  40  -7.467   3.648  -7.680
   87    HG2  LYS  40           HG2      LYS  40  -8.321   1.784  -6.272
   88    HG3  LYS  40           HG1      LYS  40  -8.473   2.930  -4.937
   89    HD2  LYS  40           HD2      LYS  40 -10.033   4.265  -6.237
   90    HD3  LYS  40           HD1      LYS  40  -9.836   3.182  -7.619
   91    HE2  LYS  40           HE2      LYS  40 -10.709   1.328  -6.205
   92    HE3  LYS  40           HE1      LYS  40 -11.035   2.507  -4.933
   93    HZ1  LYS  40           HZ1      LYS  40 -12.212   2.536  -7.662
   94    HZ2  LYS  40           HZ2      LYS  40 -12.532   3.665  -6.443
   95    HZ3  LYS  40           HZ3      LYS  40 -13.012   2.050  -6.250
   96    H    PHE  41           HN       PHE  41  -5.701   1.089  -4.813
   97    HA   PHE  41           HA       PHE  41  -5.985  -0.811  -6.971
   98    HB2  PHE  41           HB2      PHE  41  -3.771  -1.932  -6.055
   99    HB3  PHE  41           HB1      PHE  41  -3.716  -0.709  -7.318
  100    HD1  PHE  41           HD1      PHE  41  -3.472  -1.094  -3.614
  101    HD2  PHE  41           HD2      PHE  41  -2.385   1.149  -7.065
  102    HE1  PHE  41           HE1      PHE  41  -1.949   0.276  -2.242
  103    HE2  PHE  41           HE2      PHE  41  -0.871   2.520  -5.702
  104    HZ   PHE  41           HZ       PHE  41  -0.651   2.088  -3.294
  105    H    ASN  42           HN       ASN  42  -5.659  -3.107  -6.040
  106    HA   ASN  42           HA       ASN  42  -7.588  -3.489  -4.045
  107    HB2  ASN  42           HB2      ASN  42  -5.478  -5.361  -5.128
  108    HB3  ASN  42           HB1      ASN  42  -6.758  -5.867  -4.029
  109   HD21  ASN  42          HD21      ASN  42  -5.961  -4.921  -7.259
  110   HD22  ASN  42          HD22      ASN  42  -7.502  -5.257  -7.965
  111    H    GLN  43           HN       GLN  43  -7.468  -3.183  -1.944
  112    HA   GLN  43           HA       GLN  43  -5.004  -2.515  -0.709
  113    HB2  GLN  43           HB2      GLN  43  -6.291  -2.246   1.358
  114    HB3  GLN  43           HB1      GLN  43  -7.036  -1.417   0.004
  115    HG2  GLN  43           HG2      GLN  43  -7.990  -4.152   0.586
  116    HG3  GLN  43           HG1      GLN  43  -8.398  -2.892   1.751
  117   HE21  GLN  43          HE21      GLN  43  -8.977  -4.171  -1.405
  118   HE22  GLN  43          HE22      GLN  43 -10.267  -3.090  -1.825
  119    H    VAL  44           HN       VAL  44  -6.698  -5.516  -1.028
  120    HA   VAL  44           HA       VAL  44  -5.382  -6.681   1.262
  121    HB   VAL  44           HB       VAL  44  -6.402  -8.803   0.605
  122   HG11  VAL  44          HG11      VAL  44  -8.308  -6.468   0.538
  123   HG12  VAL  44          HG12      VAL  44  -7.685  -7.274   1.979
  124   HG13  VAL  44          HG13      VAL  44  -8.753  -8.141   0.875
  125   HG21  VAL  44          HG21      VAL  44  -7.500  -7.299  -1.769
  126   HG22  VAL  44          HG22      VAL  44  -7.941  -8.938  -1.290
  127   HG23  VAL  44          HG23      VAL  44  -6.298  -8.587  -1.822
  128    H    GLY  45           HN       GLY  45  -5.033  -6.897  -2.276
  129    HA2  GLY  45           HA2      GLY  45  -2.735  -8.665  -1.928
  130    HA3  GLY  45           HA1      GLY  45  -3.489  -8.231  -3.458
  131    H    ASN  46           HN       ASN  46  -3.331  -5.681  -3.788
  132    HA   ASN  46           HA       ASN  46  -0.598  -5.314  -4.389
  133    HB2  ASN  46           HB2      ASN  46  -2.910  -3.373  -4.506
  134    HB3  ASN  46           HB1      ASN  46  -1.300  -3.021  -5.119
  135   HD21  ASN  46          HD21      ASN  46  -0.535  -4.151  -6.927
  136   HD22  ASN  46          HD22      ASN  46  -1.627  -4.936  -8.025
  137    H    LEU  47           HN       LEU  47  -2.736  -3.653  -2.088
  138    HA   LEU  47           HA       LEU  47  -0.816  -1.851  -1.128
  139    HB2  LEU  47           HB2      LEU  47  -3.228  -1.597  -0.748
  140    HB3  LEU  47           HB1      LEU  47  -3.206  -3.004   0.313
  141    HG   LEU  47           HG       LEU  47  -1.668  -1.760   1.831
  142   HD11  LEU  47          HD11      LEU  47  -2.335   0.564   0.037
  143   HD12  LEU  47          HD12      LEU  47  -0.755  -0.206   0.190
  144   HD13  LEU  47          HD13      LEU  47  -1.458   0.647   1.565
  145   HD21  LEU  47          HD21      LEU  47  -3.410  -0.296   2.744
  146   HD22  LEU  47          HD22      LEU  47  -4.044  -1.878   2.290
  147   HD23  LEU  47          HD23      LEU  47  -4.334  -0.483   1.252
  148    H    LYS  48           HN       LYS  48  -1.498  -5.177  -0.259
  149    HA   LYS  48           HA       LYS  48  -0.090  -5.317   2.157
  150    HB2  LYS  48           HB2      LYS  48  -1.550  -7.116   1.425
  151    HB3  LYS  48           HB1      LYS  48  -0.527  -7.420   0.029
  152    HG2  LYS  48           HG2      LYS  48   1.293  -8.097   1.537
  153    HG3  LYS  48           HG1      LYS  48   0.217  -7.849   2.913
  154    HD2  LYS  48           HD2      LYS  48  -1.273  -9.569   2.124
  155    HD3  LYS  48           HD1      LYS  48  -0.341  -9.746   0.636
  156    HE2  LYS  48           HE2      LYS  48   1.592 -10.489   1.953
  157    HE3  LYS  48           HE1      LYS  48   0.633 -10.352   3.427
  158    HZ1  LYS  48           HZ1      LYS  48   0.007 -12.140   1.139
  159    HZ2  LYS  48           HZ2      LYS  48  -0.864 -12.039   2.590
  160    HZ3  LYS  48           HZ3      LYS  48   0.726 -12.633   2.592
  161    H    ALA  49           HN       ALA  49   0.995  -6.012  -1.161
  162    HA   ALA  49           HA       ALA  49   3.723  -6.373  -0.398
  163    HB1  ALA  49           HB1      ALA  49   2.815  -7.421  -2.405
  164    HB2  ALA  49           HB2      ALA  49   4.184  -6.380  -2.799
  165    HB3  ALA  49           HB3      ALA  49   2.539  -5.831  -3.118
  166    H    HIS  50           HN       HIS  50   1.801  -3.721  -1.605
  167    HA   HIS  50           HA       HIS  50   3.766  -1.857  -2.237
  168    HB2  HIS  50           HB2      HIS  50   1.267  -1.759  -2.663
  169    HB3  HIS  50           HB1      HIS  50   1.091  -1.247  -0.986
  170    HD1  HIS  50           HD1      HIS  50   1.696   0.045  -4.350
  171    HD2  HIS  50           HD2      HIS  50   2.333   1.295  -0.431
  172    HE1  HIS  50           HE1      HIS  50   2.052   2.548  -4.448
  173    H    LEU  51           HN       LEU  51   2.122  -2.446   0.873
  174    HA   LEU  51           HA       LEU  51   3.509  -0.371   2.250
  175    HB2  LEU  51           HB2      LEU  51   1.990  -2.779   3.260
  176    HB3  LEU  51           HB1      LEU  51   2.639  -1.518   4.306
  177    HG   LEU  51           HG       LEU  51   0.566  -1.090   2.149
  178   HD11  LEU  51          HD11      LEU  51  -0.313  -2.413   3.997
  179   HD12  LEU  51          HD12      LEU  51  -0.999  -0.789   3.999
  180   HD13  LEU  51          HD13      LEU  51   0.270  -1.210   5.147
  181   HD21  LEU  51          HD21      LEU  51   1.638   0.772   4.264
  182   HD22  LEU  51          HD22      LEU  51   0.333   1.132   3.137
  183   HD23  LEU  51          HD23      LEU  51   1.969   0.869   2.536
  184    H    LYS  52           HN       LYS  52   4.051  -3.788   1.740
  185    HA   LYS  52           HA       LYS  52   6.181  -4.152   3.550
  186    HB2  LYS  52           HB2      LYS  52   4.915  -5.976   2.421
  187    HB3  LYS  52           HB1      LYS  52   5.700  -5.549   0.910
  188    HG2  LYS  52           HG2      LYS  52   7.854  -6.166   1.810
  189    HG3  LYS  52           HG1      LYS  52   7.129  -6.504   3.385
  190    HD2  LYS  52           HD2      LYS  52   5.757  -8.266   2.373
  191    HD3  LYS  52           HD1      LYS  52   6.482  -7.927   0.799
  192    HE2  LYS  52           HE2      LYS  52   8.673  -8.557   1.666
  193    HE3  LYS  52           HE1      LYS  52   7.964  -8.870   3.252
  194    HZ1  LYS  52           HZ1      LYS  52   8.284 -10.898   1.934
  195    HZ2  LYS  52           HZ2      LYS  52   7.220 -10.300   0.754
  196    HZ3  LYS  52           HZ3      LYS  52   6.651 -10.635   2.317
  197    H    ILE  53           HN       ILE  53   5.979  -2.897   0.311
  198    HA   ILE  53           HA       ILE  53   8.761  -2.696  -0.221
  199    HB   ILE  53           HB       ILE  53   6.314  -1.384  -1.394
  200   HG12  ILE  53          HG12      ILE  53   6.601  -3.742  -1.900
  201   HG13  ILE  53          HG11      ILE  53   6.874  -2.784  -3.351
  202   HG21  ILE  53          HG21      ILE  53   7.675  -0.457  -3.179
  203   HG22  ILE  53          HG22      ILE  53   9.140  -1.021  -2.370
  204   HG23  ILE  53          HG23      ILE  53   8.135   0.218  -1.615
  205   HD11  ILE  53          HD11      ILE  53   8.980  -4.033  -1.602
  206   HD12  ILE  53          HD12      ILE  53   9.302  -3.005  -3.001
  207   HD13  ILE  53          HD13      ILE  53   8.493  -4.559  -3.214
  208    H    HIS  54           HN       HIS  54   6.453  -0.651   1.439
  209    HA   HIS  54           HA       HIS  54   8.238   1.617   1.484
  210    HB2  HIS  54           HB2      HIS  54   5.482   1.079   2.463
  211    HB3  HIS  54           HB1      HIS  54   6.393   2.362   3.251
  212    HD1  HIS  54           HD1      HIS  54   6.435   4.589   2.088
  213    HD2  HIS  54           HD2      HIS  54   5.111   1.514  -0.378
  214    HE1  HIS  54           HE1      HIS  54   5.574   5.686  -0.025
  215    H    ILE  55           HN       ILE  55   7.274  -0.957   3.706
  216    HA   ILE  55           HA       ILE  55   8.721   0.213   5.903
  217    HB   ILE  55           HB       ILE  55   8.329  -1.958   7.067
  218   HG12  ILE  55          HG12      ILE  55   6.784  -2.646   4.554
  219   HG13  ILE  55          HG11      ILE  55   8.270  -3.430   5.096
  220   HG21  ILE  55          HG21      ILE  55   5.942  -0.571   5.861
  221   HG22  ILE  55          HG22      ILE  55   6.782  -0.143   7.350
  222   HG23  ILE  55          HG23      ILE  55   5.879  -1.654   7.251
  223   HD11  ILE  55          HD11      ILE  55   6.307  -4.773   5.595
  224   HD12  ILE  55          HD12      ILE  55   5.638  -3.452   6.554
  225   HD13  ILE  55          HD13      ILE  55   7.119  -4.254   7.072
  226    H    ALA  56           HN       ALA  56   9.255  -2.624   3.803
  227    HA   ALA  56           HA       ALA  56  12.086  -2.554   4.571
  228    HB1  ALA  56           HB1      ALA  56  11.011  -4.743   4.713
  229    HB2  ALA  56           HB2      ALA  56  12.251  -4.738   3.457
  230    HB3  ALA  56           HB3      ALA  56  10.545  -4.635   3.014
  231    H    ASP  57           HN       ASP  57  13.442  -1.499   3.275
  232    HA   ASP  57           HA       ASP  57  12.390  -0.571   0.719
  233    HB2  ASP  57           HB2      ASP  57  13.346   1.066   2.335
  234    HB3  ASP  57           HB1      ASP  57  14.913   0.282   2.153
  235    H    GLY  58           HN       GLY  58  12.955  -1.457  -1.120
  236    HA2  GLY  58           HA2      GLY  58  15.614  -2.324  -1.690
  237    HA3  GLY  58           HA1      GLY  58  14.514  -3.684  -1.463
  Start of MODEL   17
    1    H1   LYS  30           HT1      LYS  30  -5.860   5.218   8.391
    2    H2   LYS  30           HT2      LYS  30  -7.493   5.357   7.957
    3    H3   LYS  30           HT3      LYS  30  -6.426   4.481   6.976
    4    HA   LYS  30           HA       LYS  30  -7.227   3.779   9.736
    5    HB2  LYS  30           HB2      LYS  30  -7.991   2.635   7.051
    6    HB3  LYS  30           HB1      LYS  30  -8.218   1.758   8.556
    7    HG2  LYS  30           HG2      LYS  30  -9.692   3.527   9.369
    8    HG3  LYS  30           HG1      LYS  30  -9.458   4.415   7.861
    9    HD2  LYS  30           HD2      LYS  30 -10.439   2.556   6.612
   10    HD3  LYS  30           HD1      LYS  30 -10.658   1.655   8.113
   11    HE2  LYS  30           HE2      LYS  30 -11.918   4.329   7.518
   12    HE3  LYS  30           HE1      LYS  30 -12.718   2.776   7.289
   13    HZ1  LYS  30           HZ1      LYS  30 -11.706   3.822   9.877
   14    HZ2  LYS  30           HZ2      LYS  30 -12.501   2.346   9.652
   15    HZ3  LYS  30           HZ3      LYS  30 -13.327   3.800   9.390
   16    H    GLU  31           HN       GLU  31  -5.277   3.316  10.566
   17    HA   GLU  31           HA       GLU  31  -3.539   2.021  11.171
   18    HB2  GLU  31           HB2      GLU  31  -4.769  -0.045   9.345
   19    HB3  GLU  31           HB1      GLU  31  -3.602  -0.350  10.625
   20    HG2  GLU  31           HG2      GLU  31  -5.223   0.453  12.275
   21    HG3  GLU  31           HG1      GLU  31  -6.394   0.706  10.983
   22    H    HIS  32           HN       HIS  32  -3.690   0.497   7.999
   23    HA   HIS  32           HA       HIS  32  -1.071   1.697   7.427
   24    HB2  HIS  32           HB2      HIS  32  -0.501  -0.558   6.336
   25    HB3  HIS  32           HB1      HIS  32  -0.462  -0.465   8.089
   26    HD1  HIS  32           HD1      HIS  32  -2.118  -1.903   9.391
   27    HD2  HIS  32           HD2      HIS  32  -2.589  -2.159   5.265
   28    HE1  HIS  32           HE1      HIS  32  -3.644  -3.864   9.000
   29    HE2  HIS  32           HE2      HIS  32  -3.713  -4.133   6.495
   30    H    LYS  33           HN       LYS  33  -1.349   2.990   5.816
   31    HA   LYS  33           HA       LYS  33  -2.513   2.038   3.325
   32    HB2  LYS  33           HB2      LYS  33  -3.754   4.015   5.100
   33    HB3  LYS  33           HB1      LYS  33  -3.509   4.604   3.463
   34    HG2  LYS  33           HG2      LYS  33  -4.705   2.568   2.641
   35    HG3  LYS  33           HG1      LYS  33  -5.097   2.204   4.325
   36    HD2  LYS  33           HD2      LYS  33  -6.299   4.265   4.555
   37    HD3  LYS  33           HD1      LYS  33  -5.764   4.807   2.965
   38    HE2  LYS  33           HE2      LYS  33  -7.000   2.936   1.943
   39    HE3  LYS  33           HE1      LYS  33  -7.588   2.478   3.542
   40    HZ1  LYS  33           HZ1      LYS  33  -8.081   5.098   2.226
   41    HZ2  LYS  33           HZ2      LYS  33  -8.693   4.599   3.727
   42    HZ3  LYS  33           HZ3      LYS  33  -9.193   3.821   2.310
   43    H    CYS  34           HN       CYS  34  -2.010   3.555   1.532
   44    HA   CYS  34           HA       CYS  34   0.339   5.213   2.096
   45    HB2  CYS  34           HB2      CYS  34  -0.835   4.174  -0.482
   46    HB3  CYS  34           HB1      CYS  34   0.400   5.424  -0.451
   47    HA   PRO  35           HA       PRO  35  -2.733   8.551   1.678
   48    HB2  PRO  35           HB2      PRO  35  -1.712  10.178   3.545
   49    HB3  PRO  35           HB1      PRO  35  -2.684   8.770   3.991
   50    HG2  PRO  35           HG2      PRO  35   0.275   9.135   4.068
   51    HG3  PRO  35           HG1      PRO  35  -0.779   8.275   5.203
   52    HD2  PRO  35           HD2      PRO  35   0.743   7.093   3.191
   53    HD3  PRO  35           HD1      PRO  35  -0.635   6.339   4.016
   54    H    HIS  36           HN       HIS  36   0.563   8.186   1.150
   55    HA   HIS  36           HA       HIS  36   0.941  10.910   0.127
   56    HB2  HIS  36           HB2      HIS  36   3.030   8.740   0.402
   57    HB3  HIS  36           HB1      HIS  36   3.300  10.462   0.148
   58    HD1  HIS  36           HD1      HIS  36   3.566   8.087   2.713
   59    HD2  HIS  36           HD2      HIS  36   1.985  11.926   2.531
   60    HE1  HIS  36           HE1      HIS  36   3.474   8.897   5.094
   61    HE2  HIS  36           HE2      HIS  36   2.344  11.142   4.972
   62    H    CYS  37           HN       CYS  37   0.268   7.747  -0.853
   63    HA   CYS  37           HA       CYS  37   1.130   8.267  -3.615
   64    HB2  CYS  37           HB2      CYS  37   0.230   5.622  -2.460
   65    HB3  CYS  37           HB1      CYS  37   1.086   5.899  -3.972
   66    H    ASP  38           HN       ASP  38  -0.403   8.277  -5.252
   67    HA   ASP  38           HA       ASP  38  -3.190   8.142  -4.316
   68    HB2  ASP  38           HB2      ASP  38  -3.797   9.699  -6.081
   69    HB3  ASP  38           HB1      ASP  38  -2.523  10.387  -5.085
   70    H    LYS  39           HN       LYS  39  -1.012   6.357  -5.946
   71    HA   LYS  39           HA       LYS  39  -2.657   5.362  -8.069
   72    HB2  LYS  39           HB2      LYS  39  -0.212   4.221  -6.709
   73    HB3  LYS  39           HB1      LYS  39  -1.003   3.459  -8.081
   74    HG2  LYS  39           HG2      LYS  39  -0.535   5.426  -9.448
   75    HG3  LYS  39           HG1      LYS  39   0.244   6.202  -8.068
   76    HD2  LYS  39           HD2      LYS  39   2.011   5.326  -9.346
   77    HD3  LYS  39           HD1      LYS  39   1.804   4.185  -8.020
   78    HE2  LYS  39           HE2      LYS  39   0.640   3.831 -10.781
   79    HE3  LYS  39           HE1      LYS  39   2.159   3.118 -10.242
   80    HZ1  LYS  39           HZ1      LYS  39  -0.553   2.553  -9.186
   81    HZ2  LYS  39           HZ2      LYS  39   0.878   1.976  -8.481
   82    HZ3  LYS  39           HZ3      LYS  39   0.453   1.497 -10.045
   83    H    LYS  40           HN       LYS  40  -4.398   4.128  -7.828
   84    HA   LYS  40           HA       LYS  40  -4.694   2.645  -5.303
   85    HB2  LYS  40           HB2      LYS  40  -6.275   4.497  -5.514
   86    HB3  LYS  40           HB1      LYS  40  -6.831   3.861  -7.053
   87    HG2  LYS  40           HG2      LYS  40  -7.766   1.927  -5.988
   88    HG3  LYS  40           HG1      LYS  40  -7.074   2.397  -4.434
   89    HD2  LYS  40           HD2      LYS  40  -9.441   2.965  -4.526
   90    HD3  LYS  40           HD1      LYS  40  -8.450   4.422  -4.434
   91    HE2  LYS  40           HE2      LYS  40  -8.640   4.600  -6.926
   92    HE3  LYS  40           HE1      LYS  40  -9.801   3.273  -6.875
   93    HZ1  LYS  40           HZ1      LYS  40 -10.084   5.902  -5.524
   94    HZ2  LYS  40           HZ2      LYS  40 -11.198   4.630  -5.423
   95    HZ3  LYS  40           HZ3      LYS  40 -10.923   5.400  -6.911
   96    H    PHE  41           HN       PHE  41  -4.880   0.542  -5.394
   97    HA   PHE  41           HA       PHE  41  -5.967  -0.791  -7.753
   98    HB2  PHE  41           HB2      PHE  41  -3.930  -2.495  -7.172
   99    HB3  PHE  41           HB1      PHE  41  -3.853  -1.274  -8.436
  100    HD1  PHE  41           HD1      PHE  41  -2.999  -1.954  -4.908
  101    HD2  PHE  41           HD2      PHE  41  -2.275   0.469  -8.334
  102    HE1  PHE  41           HE1      PHE  41  -1.053  -0.959  -3.788
  103    HE2  PHE  41           HE2      PHE  41  -0.324   1.469  -7.213
  104    HZ   PHE  41           HZ       PHE  41   0.265   0.837  -4.979
  105    H    ASN  42           HN       ASN  42  -5.212  -3.419  -6.773
  106    HA   ASN  42           HA       ASN  42  -7.274  -3.970  -4.963
  107    HB2  ASN  42           HB2      ASN  42  -6.210  -5.687  -6.386
  108    HB3  ASN  42           HB1      ASN  42  -4.735  -5.554  -5.436
  109   HD21  ASN  42          HD21      ASN  42  -8.005  -6.718  -5.507
  110   HD22  ASN  42          HD22      ASN  42  -7.895  -7.714  -4.095
  111    H    GLN  43           HN       GLN  43  -7.459  -3.489  -2.869
  112    HA   GLN  43           HA       GLN  43  -5.202  -2.144  -1.631
  113    HB2  GLN  43           HB2      GLN  43  -8.088  -2.358  -0.769
  114    HB3  GLN  43           HB1      GLN  43  -6.870  -1.342  -0.009
  115    HG2  GLN  43           HG2      GLN  43  -6.682   0.014  -1.960
  116    HG3  GLN  43           HG1      GLN  43  -7.697  -1.088  -2.886
  117   HE21  GLN  43          HE21      GLN  43  -9.561  -1.504  -0.687
  118   HE22  GLN  43          HE22      GLN  43 -10.510  -0.054  -0.578
  119    H    VAL  44           HN       VAL  44  -6.986  -5.113  -1.251
  120    HA   VAL  44           HA       VAL  44  -6.074  -5.458   1.472
  121    HB   VAL  44           HB       VAL  44  -8.260  -6.303   0.985
  122   HG11  VAL  44          HG11      VAL  44  -8.667  -8.145  -0.562
  123   HG12  VAL  44          HG12      VAL  44  -6.974  -8.112  -1.050
  124   HG13  VAL  44          HG13      VAL  44  -8.016  -6.733  -1.393
  125   HG21  VAL  44          HG21      VAL  44  -8.055  -8.617   1.765
  126   HG22  VAL  44          HG22      VAL  44  -6.996  -7.524   2.656
  127   HG23  VAL  44          HG23      VAL  44  -6.327  -8.578   1.410
  128    H    GLY  45           HN       GLY  45  -5.438  -7.124  -1.635
  129    HA2  GLY  45           HA2      GLY  45  -3.323  -8.667  -0.342
  130    HA3  GLY  45           HA1      GLY  45  -3.951  -8.914  -1.968
  131    H    ASN  46           HN       ASN  46  -3.581  -6.674  -3.296
  132    HA   ASN  46           HA       ASN  46  -0.788  -6.804  -3.780
  133    HB2  ASN  46           HB2      ASN  46  -2.428  -6.440  -5.589
  134    HB3  ASN  46           HB1      ASN  46  -2.795  -4.850  -4.927
  135   HD21  ASN  46          HD21      ASN  46  -0.418  -6.799  -6.580
  136   HD22  ASN  46          HD22      ASN  46   0.565  -5.482  -7.119
  137    H    LEU  47           HN       LEU  47  -2.857  -4.293  -2.368
  138    HA   LEU  47           HA       LEU  47  -0.808  -2.385  -2.003
  139    HB2  LEU  47           HB2      LEU  47  -3.215  -1.852  -1.887
  140    HB3  LEU  47           HB1      LEU  47  -3.335  -2.768  -0.389
  141    HG   LEU  47           HG       LEU  47  -1.735  -1.153   0.655
  142   HD11  LEU  47          HD11      LEU  47  -1.358   0.988  -0.458
  143   HD12  LEU  47          HD12      LEU  47  -2.172   0.383  -1.901
  144   HD13  LEU  47          HD13      LEU  47  -0.657  -0.348  -1.371
  145   HD21  LEU  47          HD21      LEU  47  -4.263   0.042  -0.478
  146   HD22  LEU  47          HD22      LEU  47  -3.377   0.629   0.928
  147   HD23  LEU  47          HD23      LEU  47  -4.152  -0.953   0.973
  148    H    LYS  48           HN       LYS  48  -1.748  -5.211  -0.190
  149    HA   LYS  48           HA       LYS  48  -0.376  -4.702   2.208
  150    HB2  LYS  48           HB2      LYS  48  -1.806  -6.549   2.281
  151    HB3  LYS  48           HB1      LYS  48  -1.210  -7.194   0.759
  152    HG2  LYS  48           HG2      LYS  48   0.879  -7.833   1.843
  153    HG3  LYS  48           HG1      LYS  48   0.288  -7.174   3.370
  154    HD2  LYS  48           HD2      LYS  48  -1.270  -8.863   3.642
  155    HD3  LYS  48           HD1      LYS  48  -1.313  -9.238   1.918
  156    HE2  LYS  48           HE2      LYS  48  -0.177 -10.971   3.285
  157    HE3  LYS  48           HE1      LYS  48   0.843 -10.279   2.027
  158    HZ1  LYS  48           HZ1      LYS  48   0.908  -9.562   4.911
  159    HZ2  LYS  48           HZ2      LYS  48   1.879  -8.867   3.706
  160    HZ3  LYS  48           HZ3      LYS  48   2.050 -10.509   4.092
  161    H    ALA  49           HN       ALA  49   0.708  -6.226  -0.817
  162    HA   ALA  49           HA       ALA  49   3.410  -6.567   0.058
  163    HB1  ALA  49           HB1      ALA  49   2.272  -6.507  -2.736
  164    HB2  ALA  49           HB2      ALA  49   2.454  -7.938  -1.724
  165    HB3  ALA  49           HB3      ALA  49   3.882  -7.075  -2.294
  166    H    HIS  50           HN       HIS  50   1.590  -4.062  -1.478
  167    HA   HIS  50           HA       HIS  50   3.690  -2.421  -2.384
  168    HB2  HIS  50           HB2      HIS  50   1.338  -2.212  -3.097
  169    HB3  HIS  50           HB1      HIS  50   0.895  -1.680  -1.474
  170    HD1  HIS  50           HD1      HIS  50   2.276  -0.458  -4.696
  171    HD2  HIS  50           HD2      HIS  50   1.732   0.926  -0.813
  172    HE1  HIS  50           HE1      HIS  50   2.537   2.055  -4.792
  173    H    LEU  51           HN       LEU  51   1.864  -2.463   0.662
  174    HA   LEU  51           HA       LEU  51   3.263  -0.336   1.895
  175    HB2  LEU  51           HB2      LEU  51   1.823  -2.685   3.135
  176    HB3  LEU  51           HB1      LEU  51   2.337  -1.241   4.000
  177    HG   LEU  51           HG       LEU  51   0.329  -1.261   1.740
  178   HD11  LEU  51          HD11      LEU  51  -1.341  -0.881   3.485
  179   HD12  LEU  51          HD12      LEU  51  -0.096  -1.081   4.718
  180   HD13  LEU  51          HD13      LEU  51  -0.538  -2.439   3.684
  181   HD21  LEU  51          HD21      LEU  51   1.543   0.848   1.965
  182   HD22  LEU  51          HD22      LEU  51   1.143   0.901   3.681
  183   HD23  LEU  51          HD23      LEU  51  -0.137   1.026   2.474
  184    H    LYS  52           HN       LYS  52   3.881  -3.727   1.540
  185    HA   LYS  52           HA       LYS  52   5.869  -4.067   3.492
  186    HB2  LYS  52           HB2      LYS  52   4.782  -5.944   2.370
  187    HB3  LYS  52           HB1      LYS  52   5.501  -5.471   0.840
  188    HG2  LYS  52           HG2      LYS  52   7.743  -5.888   1.837
  189    HG3  LYS  52           HG1      LYS  52   6.927  -6.511   3.275
  190    HD2  LYS  52           HD2      LYS  52   5.801  -8.197   1.888
  191    HD3  LYS  52           HD1      LYS  52   6.653  -7.586   0.468
  192    HE2  LYS  52           HE2      LYS  52   8.796  -8.147   1.546
  193    HE3  LYS  52           HE1      LYS  52   7.913  -8.815   2.921
  194    HZ1  LYS  52           HZ1      LYS  52   7.885  -9.799   0.120
  195    HZ2  LYS  52           HZ2      LYS  52   6.843 -10.369   1.328
  196    HZ3  LYS  52           HZ3      LYS  52   8.516 -10.599   1.478
  197    H    ILE  53           HN       ILE  53   6.090  -3.092   0.074
  198    HA   ILE  53           HA       ILE  53   8.951  -3.012   0.143
  199    HB   ILE  53           HB       ILE  53   7.600  -3.422  -1.941
  200   HG12  ILE  53          HG12      ILE  53   9.118  -2.138  -3.414
  201   HG13  ILE  53          HG11      ILE  53   9.609  -1.163  -2.034
  202   HG21  ILE  53          HG21      ILE  53   5.921  -1.690  -1.672
  203   HG22  ILE  53          HG22      ILE  53   6.786  -1.484  -3.195
  204   HG23  ILE  53          HG23      ILE  53   7.159  -0.446  -1.819
  205   HD11  ILE  53          HD11      ILE  53  11.258  -2.863  -2.534
  206   HD12  ILE  53          HD12      ILE  53  10.038  -4.124  -2.347
  207   HD13  ILE  53          HD13      ILE  53  10.523  -3.153  -0.956
  208    H    HIS  54           HN       HIS  54   6.509  -0.856   1.158
  209    HA   HIS  54           HA       HIS  54   8.078   1.540   0.924
  210    HB2  HIS  54           HB2      HIS  54   5.458   0.832   2.136
  211    HB3  HIS  54           HB1      HIS  54   6.290   2.236   2.795
  212    HD1  HIS  54           HD1      HIS  54   6.667   4.263   1.129
  213    HD2  HIS  54           HD2      HIS  54   4.292   1.175  -0.322
  214    HE1  HIS  54           HE1      HIS  54   5.419   5.197  -0.866
  215    H    ILE  55           HN       ILE  55   7.525  -0.895   3.403
  216    HA   ILE  55           HA       ILE  55   9.073   0.625   5.346
  217    HB   ILE  55           HB       ILE  55   8.616  -1.235   6.897
  218   HG12  ILE  55          HG12      ILE  55   7.027  -2.407   4.595
  219   HG13  ILE  55          HG11      ILE  55   8.540  -3.061   5.227
  220   HG21  ILE  55          HG21      ILE  55   6.195  -0.863   7.085
  221   HG22  ILE  55          HG22      ILE  55   6.186  -0.164   5.465
  222   HG23  ILE  55          HG23      ILE  55   7.071   0.633   6.764
  223   HD11  ILE  55          HD11      ILE  55   5.933  -2.845   6.719
  224   HD12  ILE  55          HD12      ILE  55   7.442  -3.481   7.374
  225   HD13  ILE  55          HD13      ILE  55   6.638  -4.315   6.042
  226    H    ALA  56           HN       ALA  56   9.550  -1.836   3.019
  227    HA   ALA  56           HA       ALA  56  12.075  -2.707   4.202
  228    HB1  ALA  56           HB1      ALA  56  10.713  -3.570   1.649
  229    HB2  ALA  56           HB2      ALA  56  10.609  -4.398   3.202
  230    HB3  ALA  56           HB3      ALA  56  12.151  -4.306   2.355
  231    H    ASP  57           HN       ASP  57  14.077  -2.550   2.999
  232    HA   ASP  57           HA       ASP  57  14.224  -0.028   1.551
  233    HB2  ASP  57           HB2      ASP  57  16.574  -0.100   1.859
  234    HB3  ASP  57           HB1      ASP  57  15.880  -0.681   3.368
  235    H    GLY  58           HN       GLY  58  14.942   0.196  -0.550
  236    HA2  GLY  58           HA2      GLY  58  16.064  -1.172  -2.418
  237    HA3  GLY  58           HA1      GLY  58  14.693  -2.256  -2.157
  Start of MODEL   18
    1    H1   LYS  30           HT1      LYS  30  -9.530  -0.487  12.334
    2    H2   LYS  30           HT2      LYS  30  -8.596  -1.383  11.240
    3    H3   LYS  30           HT3      LYS  30 -10.063  -0.699  10.740
    4    HA   LYS  30           HA       LYS  30  -9.200   1.503  11.038
    5    HB2  LYS  30           HB2      LYS  30  -6.594   0.114  11.691
    6    HB3  LYS  30           HB1      LYS  30  -6.828   1.850  11.540
    7    HG2  LYS  30           HG2      LYS  30  -8.434   1.721  13.448
    8    HG3  LYS  30           HG1      LYS  30  -7.975   0.029  13.642
    9    HD2  LYS  30           HD2      LYS  30  -6.157   2.426  13.873
   10    HD3  LYS  30           HD1      LYS  30  -6.728   1.406  15.194
   11    HE2  LYS  30           HE2      LYS  30  -4.969   0.522  12.910
   12    HE3  LYS  30           HE1      LYS  30  -4.431   0.865  14.552
   13    HZ1  LYS  30           HZ1      LYS  30  -5.924  -0.933  15.317
   14    HZ2  LYS  30           HZ2      LYS  30  -4.683  -1.475  14.296
   15    HZ3  LYS  30           HZ3      LYS  30  -6.260  -1.311  13.696
   16    H    GLU  31           HN       GLU  31  -8.973   2.329   9.113
   17    HA   GLU  31           HA       GLU  31  -8.502   0.645   6.858
   18    HB2  GLU  31           HB2      GLU  31 -10.116   2.535   6.900
   19    HB3  GLU  31           HB1      GLU  31  -8.763   3.653   7.003
   20    HG2  GLU  31           HG2      GLU  31  -7.960   2.797   4.821
   21    HG3  GLU  31           HG1      GLU  31  -9.424   1.817   4.716
   22    H    HIS  32           HN       HIS  32  -6.747   0.487   5.532
   23    HA   HIS  32           HA       HIS  32  -4.337   2.001   6.324
   24    HB2  HIS  32           HB2      HIS  32  -4.610  -0.741   5.082
   25    HB3  HIS  32           HB1      HIS  32  -3.078   0.108   5.230
   26    HD1  HIS  32           HD1      HIS  32  -4.800  -2.471   6.817
   27    HD2  HIS  32           HD2      HIS  32  -2.821   0.909   8.221
   28    HE1  HIS  32           HE1      HIS  32  -4.258  -2.950   9.225
   29    HE2  HIS  32           HE2      HIS  32  -2.831  -1.009   9.960
   30    H    LYS  33           HN       LYS  33  -3.482   3.358   4.894
   31    HA   LYS  33           HA       LYS  33  -3.756   2.917   2.031
   32    HB2  LYS  33           HB2      LYS  33  -5.062   5.164   3.503
   33    HB3  LYS  33           HB1      LYS  33  -4.341   5.512   1.942
   34    HG2  LYS  33           HG2      LYS  33  -5.751   3.678   0.983
   35    HG3  LYS  33           HG1      LYS  33  -6.569   3.589   2.546
   36    HD2  LYS  33           HD2      LYS  33  -7.232   5.922   2.358
   37    HD3  LYS  33           HD1      LYS  33  -6.358   6.068   0.835
   38    HE2  LYS  33           HE2      LYS  33  -8.717   5.815   0.402
   39    HE3  LYS  33           HE1      LYS  33  -7.852   4.383  -0.154
   40    HZ1  LYS  33           HZ1      LYS  33  -8.605   3.160   1.708
   41    HZ2  LYS  33           HZ2      LYS  33  -9.966   3.954   1.088
   42    HZ3  LYS  33           HZ3      LYS  33  -9.200   4.543   2.485
   43    H    CYS  34           HN       CYS  34  -2.357   4.346   0.776
   44    HA   CYS  34           HA       CYS  34  -0.082   5.409   2.266
   45    HB2  CYS  34           HB2      CYS  34  -0.640   4.895  -0.641
   46    HB3  CYS  34           HB1      CYS  34   0.644   5.999  -0.178
   47    HA   PRO  35           HA       PRO  35  -2.192   9.383   2.390
   48    HB2  PRO  35           HB2      PRO  35   0.524  10.207   3.271
   49    HB3  PRO  35           HB1      PRO  35  -1.044  10.506   4.027
   50    HG2  PRO  35           HG2      PRO  35   0.623   8.704   5.047
   51    HG3  PRO  35           HG1      PRO  35  -1.124   8.391   4.990
   52    HD2  PRO  35           HD2      PRO  35   1.050   7.334   3.226
   53    HD3  PRO  35           HD1      PRO  35  -0.379   6.503   3.875
   54    H    HIS  36           HN       HIS  36   1.107   9.024   0.975
   55    HA   HIS  36           HA       HIS  36   0.540  11.454  -0.569
   56    HB2  HIS  36           HB2      HIS  36   2.857  11.794  -0.890
   57    HB3  HIS  36           HB1      HIS  36   2.651  11.356   0.797
   58    HD1  HIS  36           HD1      HIS  36   4.197   9.607   1.642
   59    HD2  HIS  36           HD2      HIS  36   3.849   9.494  -2.504
   60    HE1  HIS  36           HE1      HIS  36   5.910   7.944   0.860
   61    HE2  HIS  36           HE2      HIS  36   5.765   7.969  -1.656
   62    H    CYS  37           HN       CYS  37   0.429   8.153  -0.985
   63    HA   CYS  37           HA       CYS  37   1.211   8.269  -3.799
   64    HB2  CYS  37           HB2      CYS  37   0.253   5.876  -2.223
   65    HB3  CYS  37           HB1      CYS  37   1.009   5.860  -3.813
   66    H    ASP  38           HN       ASP  38  -0.260   8.741  -5.280
   67    HA   ASP  38           HA       ASP  38  -3.093   8.546  -4.659
   68    HB2  ASP  38           HB2      ASP  38  -1.511   9.820  -6.864
   69    HB3  ASP  38           HB1      ASP  38  -3.235   9.532  -7.071
   70    H    LYS  39           HN       LYS  39  -1.249   6.221  -5.226
   71    HA   LYS  39           HA       LYS  39  -2.583   5.037  -7.536
   72    HB2  LYS  39           HB2      LYS  39  -0.079   4.465  -6.039
   73    HB3  LYS  39           HB1      LYS  39  -0.901   3.107  -6.791
   74    HG2  LYS  39           HG2      LYS  39  -0.151   5.601  -8.282
   75    HG3  LYS  39           HG1      LYS  39   0.892   4.182  -8.169
   76    HD2  LYS  39           HD2      LYS  39  -0.905   2.820  -9.169
   77    HD3  LYS  39           HD1      LYS  39  -1.890   4.273  -9.331
   78    HE2  LYS  39           HE2      LYS  39  -0.788   3.711 -11.434
   79    HE3  LYS  39           HE1      LYS  39  -0.227   5.260 -10.805
   80    HZ1  LYS  39           HZ1      LYS  39   1.226   2.681 -10.498
   81    HZ2  LYS  39           HZ2      LYS  39   1.777   4.215 -10.015
   82    HZ3  LYS  39           HZ3      LYS  39   1.579   3.863 -11.660
   83    H    LYS  40           HN       LYS  40  -4.324   3.876  -7.246
   84    HA   LYS  40           HA       LYS  40  -4.733   2.536  -4.662
   85    HB2  LYS  40           HB2      LYS  40  -6.441   4.223  -5.286
   86    HB3  LYS  40           HB1      LYS  40  -6.793   3.300  -6.740
   87    HG2  LYS  40           HG2      LYS  40  -7.661   1.480  -5.476
   88    HG3  LYS  40           HG1      LYS  40  -7.091   2.188  -3.963
   89    HD2  LYS  40           HD2      LYS  40  -8.627   4.074  -4.274
   90    HD3  LYS  40           HD1      LYS  40  -9.199   3.357  -5.781
   91    HE2  LYS  40           HE2      LYS  40  -9.371   1.977  -3.110
   92    HE3  LYS  40           HE1      LYS  40 -10.668   2.965  -3.781
   93    HZ1  LYS  40           HZ1      LYS  40 -10.895   1.483  -5.605
   94    HZ2  LYS  40           HZ2      LYS  40 -10.895   0.543  -4.190
   95    HZ3  LYS  40           HZ3      LYS  40  -9.509   0.606  -5.167
   96    H    PHE  41           HN       PHE  41  -4.098   0.517  -4.777
   97    HA   PHE  41           HA       PHE  41  -4.483  -1.018  -7.249
   98    HB2  PHE  41           HB2      PHE  41  -2.898  -1.765  -4.780
   99    HB3  PHE  41           HB1      PHE  41  -2.894  -2.606  -6.324
  100    HD1  PHE  41           HD1      PHE  41  -1.749   0.365  -4.519
  101    HD2  PHE  41           HD2      PHE  41  -1.596  -1.801  -8.172
  102    HE1  PHE  41           HE1      PHE  41   0.156   1.735  -5.247
  103    HE2  PHE  41           HE2      PHE  41   0.313  -0.438  -8.904
  104    HZ   PHE  41           HZ       PHE  41   1.221   1.297  -7.432
  105    H    ASN  42           HN       ASN  42  -4.789  -3.529  -6.536
  106    HA   ASN  42           HA       ASN  42  -7.218  -3.850  -5.158
  107    HB2  ASN  42           HB2      ASN  42  -4.976  -5.749  -5.820
  108    HB3  ASN  42           HB1      ASN  42  -6.351  -6.276  -4.856
  109   HD21  ASN  42          HD21      ASN  42  -8.319  -6.569  -5.818
  110   HD22  ASN  42          HD22      ASN  42  -8.550  -6.520  -7.530
  111    H    GLN  43           HN       GLN  43  -7.557  -3.322  -3.113
  112    HA   GLN  43           HA       GLN  43  -5.358  -2.830  -1.360
  113    HB2  GLN  43           HB2      GLN  43  -6.968  -1.958   0.193
  114    HB3  GLN  43           HB1      GLN  43  -7.388  -1.409  -1.421
  115    HG2  GLN  43           HG2      GLN  43  -8.697  -3.738  -0.042
  116    HG3  GLN  43           HG1      GLN  43  -9.316  -2.089  -0.009
  117   HE21  GLN  43          HE21      GLN  43 -10.495  -4.536  -1.054
  118   HE22  GLN  43          HE22      GLN  43 -10.867  -4.202  -2.719
  119    H    VAL  44           HN       VAL  44  -6.558  -5.702  -2.135
  120    HA   VAL  44           HA       VAL  44  -6.692  -6.792   0.561
  121    HB   VAL  44           HB       VAL  44  -6.887  -8.215  -2.100
  122   HG11  VAL  44          HG11      VAL  44  -6.164  -9.683  -0.286
  123   HG12  VAL  44          HG12      VAL  44  -7.800 -10.076  -0.814
  124   HG13  VAL  44          HG13      VAL  44  -7.548  -9.175   0.681
  125   HG21  VAL  44          HG21      VAL  44  -9.053  -7.320  -0.204
  126   HG22  VAL  44          HG22      VAL  44  -9.296  -8.293  -1.654
  127   HG23  VAL  44          HG23      VAL  44  -8.715  -6.634  -1.793
  128    H    GLY  45           HN       GLY  45  -4.977  -7.938  -2.348
  129    HA2  GLY  45           HA2      GLY  45  -2.764  -8.798  -0.642
  130    HA3  GLY  45           HA1      GLY  45  -3.016  -9.239  -2.330
  131    H    ASN  46           HN       ASN  46  -3.206  -6.886  -3.600
  132    HA   ASN  46           HA       ASN  46  -0.546  -6.253  -4.063
  133    HB2  ASN  46           HB2      ASN  46  -3.079  -4.777  -4.754
  134    HB3  ASN  46           HB1      ASN  46  -1.496  -4.226  -5.288
  135   HD21  ASN  46          HD21      ASN  46  -0.431  -5.332  -6.890
  136   HD22  ASN  46          HD22      ASN  46  -1.180  -6.590  -7.821
  137    H    LEU  47           HN       LEU  47  -2.953  -4.454  -2.178
  138    HA   LEU  47           HA       LEU  47  -1.350  -2.223  -1.612
  139    HB2  LEU  47           HB2      LEU  47  -3.788  -2.298  -1.266
  140    HB3  LEU  47           HB1      LEU  47  -3.552  -3.409   0.080
  141    HG   LEU  47           HG       LEU  47  -2.280  -1.638   1.271
  142   HD11  LEU  47          HD11      LEU  47  -1.510  -0.365  -0.655
  143   HD12  LEU  47          HD12      LEU  47  -2.408   0.666   0.460
  144   HD13  LEU  47          HD13      LEU  47  -3.169   0.100  -1.027
  145   HD21  LEU  47          HD21      LEU  47  -5.057  -0.834   0.412
  146   HD22  LEU  47          HD22      LEU  47  -4.215  -0.286   1.862
  147   HD23  LEU  47          HD23      LEU  47  -4.667  -1.982   1.691
  148    H    LYS  48           HN       LYS  48  -1.590  -5.359  -0.025
  149    HA   LYS  48           HA       LYS  48  -0.167  -4.568   2.309
  150    HB2  LYS  48           HB2      LYS  48  -0.728  -7.301   1.157
  151    HB3  LYS  48           HB1      LYS  48   0.037  -7.026   2.717
  152    HG2  LYS  48           HG2      LYS  48  -2.742  -6.209   1.904
  153    HG3  LYS  48           HG1      LYS  48  -2.295  -7.478   3.046
  154    HD2  LYS  48           HD2      LYS  48  -1.705  -4.537   3.390
  155    HD3  LYS  48           HD1      LYS  48  -3.026  -5.407   4.175
  156    HE2  LYS  48           HE2      LYS  48  -0.105  -6.089   4.486
  157    HE3  LYS  48           HE1      LYS  48  -1.016  -5.083   5.611
  158    HZ1  LYS  48           HZ1      LYS  48  -1.681  -7.907   4.946
  159    HZ2  LYS  48           HZ2      LYS  48  -2.453  -6.930   6.099
  160    HZ3  LYS  48           HZ3      LYS  48  -0.847  -7.402   6.333
  161    H    ALA  49           HN       ALA  49   0.771  -6.098  -0.732
  162    HA   ALA  49           HA       ALA  49   3.516  -6.405  -0.071
  163    HB1  ALA  49           HB1      ALA  49   2.450  -7.590  -1.943
  164    HB2  ALA  49           HB2      ALA  49   3.866  -6.682  -2.468
  165    HB3  ALA  49           HB3      ALA  49   2.248  -6.058  -2.791
  166    H    HIS  50           HN       HIS  50   1.593  -3.840  -1.462
  167    HA   HIS  50           HA       HIS  50   3.634  -2.071  -2.220
  168    HB2  HIS  50           HB2      HIS  50   1.275  -1.913  -2.937
  169    HB3  HIS  50           HB1      HIS  50   0.813  -1.473  -1.297
  170    HD1  HIS  50           HD1      HIS  50   2.303  -0.071  -4.418
  171    HD2  HIS  50           HD2      HIS  50   1.467   1.138  -0.532
  172    HE1  HIS  50           HE1      HIS  50   2.440   2.441  -4.420
  173    H    LEU  51           HN       LEU  51   1.862  -2.444   0.825
  174    HA   LEU  51           HA       LEU  51   3.133  -0.253   2.125
  175    HB2  LEU  51           HB2      LEU  51   1.706  -2.654   3.273
  176    HB3  LEU  51           HB1      LEU  51   2.187  -1.230   4.192
  177    HG   LEU  51           HG       LEU  51   0.202  -1.247   1.909
  178   HD11  LEU  51          HD11      LEU  51  -1.463  -0.810   3.656
  179   HD12  LEU  51          HD12      LEU  51  -0.217  -1.020   4.886
  180   HD13  LEU  51          HD13      LEU  51  -0.684  -2.378   3.863
  181   HD21  LEU  51          HD21      LEU  51   1.019   0.957   3.800
  182   HD22  LEU  51          HD22      LEU  51  -0.267   1.053   2.598
  183   HD23  LEU  51          HD23      LEU  51   1.410   0.866   2.084
  184    H    LYS  52           HN       LYS  52   3.956  -3.580   1.617
  185    HA   LYS  52           HA       LYS  52   5.883  -3.705   3.741
  186    HB2  LYS  52           HB2      LYS  52   4.694  -5.715   2.870
  187    HB3  LYS  52           HB1      LYS  52   5.586  -5.547   1.365
  188    HG2  LYS  52           HG2      LYS  52   7.670  -5.959   2.483
  189    HG3  LYS  52           HG1      LYS  52   6.871  -5.958   4.055
  190    HD2  LYS  52           HD2      LYS  52   5.544  -7.925   3.325
  191    HD3  LYS  52           HD1      LYS  52   6.476  -7.948   1.826
  192    HE2  LYS  52           HE2      LYS  52   8.518  -8.329   3.056
  193    HE3  LYS  52           HE1      LYS  52   7.661  -8.190   4.589
  194    HZ1  LYS  52           HZ1      LYS  52   6.341 -10.149   3.923
  195    HZ2  LYS  52           HZ2      LYS  52   7.993 -10.487   4.090
  196    HZ3  LYS  52           HZ3      LYS  52   7.316 -10.316   2.544
  197    H    ILE  53           HN       ILE  53   5.973  -3.055   0.269
  198    HA   ILE  53           HA       ILE  53   8.841  -2.985   0.194
  199    HB   ILE  53           HB       ILE  53   8.619  -2.049  -2.056
  200   HG12  ILE  53          HG12      ILE  53   5.634  -2.110  -1.555
  201   HG13  ILE  53          HG11      ILE  53   6.616  -0.650  -1.647
  202   HG21  ILE  53          HG21      ILE  53   8.534  -4.451  -1.779
  203   HG22  ILE  53          HG22      ILE  53   7.466  -3.956  -3.092
  204   HG23  ILE  53          HG23      ILE  53   6.791  -4.386  -1.520
  205   HD11  ILE  53          HD11      ILE  53   7.158  -1.170  -3.972
  206   HD12  ILE  53          HD12      ILE  53   5.418  -1.037  -3.720
  207   HD13  ILE  53          HD13      ILE  53   6.169  -2.627  -3.874
  208    H    HIS  54           HN       HIS  54   6.446  -0.839   1.254
  209    HA   HIS  54           HA       HIS  54   7.955   1.578   0.930
  210    HB2  HIS  54           HB2      HIS  54   5.423   0.800   2.216
  211    HB3  HIS  54           HB1      HIS  54   6.289   2.094   3.038
  212    HD1  HIS  54           HD1      HIS  54   6.307   4.413   1.895
  213    HD2  HIS  54           HD2      HIS  54   4.523   1.422  -0.385
  214    HE1  HIS  54           HE1      HIS  54   5.122   5.576  -0.020
  215    H    ILE  55           HN       ILE  55   7.338  -0.650   3.629
  216    HA   ILE  55           HA       ILE  55   9.113   0.743   5.380
  217    HB   ILE  55           HB       ILE  55   8.868  -1.264   6.868
  218   HG12  ILE  55          HG12      ILE  55   6.911  -2.159   4.734
  219   HG13  ILE  55          HG11      ILE  55   8.457  -2.937   5.091
  220   HG21  ILE  55          HG21      ILE  55   6.359   0.068   5.863
  221   HG22  ILE  55          HG22      ILE  55   7.449   0.672   7.111
  222   HG23  ILE  55          HG23      ILE  55   6.508  -0.793   7.398
  223   HD11  ILE  55          HD11      ILE  55   7.644  -3.472   7.340
  224   HD12  ILE  55          HD12      ILE  55   6.628  -4.169   6.079
  225   HD13  ILE  55          HD13      ILE  55   6.095  -2.728   6.947
  226    H    ALA  56           HN       ALA  56   9.348  -2.371   3.642
  227    HA   ALA  56           HA       ALA  56  12.248  -2.313   4.109
  228    HB1  ALA  56           HB1      ALA  56  10.505  -4.570   3.118
  229    HB2  ALA  56           HB2      ALA  56  11.121  -4.379   4.760
  230    HB3  ALA  56           HB3      ALA  56  12.239  -4.660   3.427
  231    H    ASP  57           HN       ASP  57  13.480  -1.527   2.513
  232    HA   ASP  57           HA       ASP  57  12.354  -1.164  -0.124
  233    HB2  ASP  57           HB2      ASP  57  14.902  -0.314   1.207
  234    HB3  ASP  57           HB1      ASP  57  14.786  -0.281  -0.549
  235    H    GLY  58           HN       GLY  58  12.256  -2.831  -1.412
  236    HA2  GLY  58           HA2      GLY  58  12.886  -4.619  -2.703
  237    HA3  GLY  58           HA1      GLY  58  14.555  -4.146  -2.394
  Start of MODEL   19
    1    H1   LYS  30           HT1      LYS  30  -7.211   5.314  13.210
    2    H2   LYS  30           HT2      LYS  30  -8.217   6.105  12.101
    3    H3   LYS  30           HT3      LYS  30  -7.431   6.996  13.314
    4    HA   LYS  30           HA       LYS  30  -6.128   5.565  11.074
    5    HB2  LYS  30           HB2      LYS  30  -6.442   8.521  11.650
    6    HB3  LYS  30           HB1      LYS  30  -5.487   7.839  10.340
    7    HG2  LYS  30           HG2      LYS  30  -7.503   6.916   9.332
    8    HG3  LYS  30           HG1      LYS  30  -8.470   7.562  10.660
    9    HD2  LYS  30           HD2      LYS  30  -6.803   9.217   8.765
   10    HD3  LYS  30           HD1      LYS  30  -8.547   8.982   8.640
   11    HE2  LYS  30           HE2      LYS  30  -8.915  10.092  10.724
   12    HE3  LYS  30           HE1      LYS  30  -7.187  10.147  11.062
   13    HZ1  LYS  30           HZ1      LYS  30  -8.562  11.574   8.848
   14    HZ2  LYS  30           HZ2      LYS  30  -6.901  11.638   9.184
   15    HZ3  LYS  30           HZ3      LYS  30  -8.016  12.281  10.291
   16    H    GLU  31           HN       GLU  31  -4.563   4.517  12.277
   17    HA   GLU  31           HA       GLU  31  -3.028   6.046  14.208
   18    HB2  GLU  31           HB2      GLU  31  -2.839   3.172  13.328
   19    HB3  GLU  31           HB1      GLU  31  -1.750   3.907  14.493
   20    HG2  GLU  31           HG2      GLU  31  -3.738   4.447  15.899
   21    HG3  GLU  31           HG1      GLU  31  -4.712   3.498  14.776
   22    H    HIS  32           HN       HIS  32  -1.867   3.830  11.654
   23    HA   HIS  32           HA       HIS  32  -0.215   5.966  10.612
   24    HB2  HIS  32           HB2      HIS  32   1.903   4.780  10.894
   25    HB3  HIS  32           HB1      HIS  32   1.158   5.115  12.450
   26    HD1  HIS  32           HD1      HIS  32   2.769   2.500  10.608
   27    HD2  HIS  32           HD2      HIS  32  -0.235   2.653  13.478
   28    HE1  HIS  32           HE1      HIS  32   2.628   0.177  11.561
   29    HE2  HIS  32           HE2      HIS  32   0.746   0.269  13.240
   30    H    LYS  33           HN       LYS  33  -1.246   5.762   8.689
   31    HA   LYS  33           HA       LYS  33  -0.420   3.391   7.146
   32    HB2  LYS  33           HB2      LYS  33  -2.802   5.216   6.747
   33    HB3  LYS  33           HB1      LYS  33  -2.232   4.106   5.507
   34    HG2  LYS  33           HG2      LYS  33  -2.589   2.231   7.104
   35    HG3  LYS  33           HG1      LYS  33  -3.300   3.388   8.231
   36    HD2  LYS  33           HD2      LYS  33  -5.053   3.914   6.659
   37    HD3  LYS  33           HD1      LYS  33  -4.311   2.885   5.430
   38    HE2  LYS  33           HE2      LYS  33  -4.657   0.931   6.903
   39    HE3  LYS  33           HE1      LYS  33  -5.457   1.980   8.073
   40    HZ1  LYS  33           HZ1      LYS  33  -6.387   1.509   5.287
   41    HZ2  LYS  33           HZ2      LYS  33  -7.176   2.452   6.459
   42    HZ3  LYS  33           HZ3      LYS  33  -7.036   0.778   6.671
   43    H    CYS  34           HN       CYS  34   0.122   3.962   4.831
   44    HA   CYS  34           HA       CYS  34   2.131   5.961   4.888
   45    HB2  CYS  34           HB2      CYS  34   2.453   5.365   2.502
   46    HB3  CYS  34           HB1      CYS  34   2.402   3.953   3.551
   47    HA   PRO  35           HA       PRO  35   0.230   9.574   2.969
   48    HB2  PRO  35           HB2      PRO  35   1.444   9.664   0.455
   49    HB3  PRO  35           HB1      PRO  35   2.059  10.422   1.926
   50    HG2  PRO  35           HG2      PRO  35   2.813   7.821   0.672
   51    HG3  PRO  35           HG1      PRO  35   3.837   9.015   1.492
   52    HD2  PRO  35           HD2      PRO  35   3.117   6.747   2.706
   53    HD3  PRO  35           HD1      PRO  35   3.214   8.275   3.607
   54    H    HIS  36           HN       HIS  36  -0.719  10.211   0.567
   55    HA   HIS  36           HA       HIS  36  -2.902   8.395   0.378
   56    HB2  HIS  36           HB2      HIS  36  -2.169  10.846  -1.214
   57    HB3  HIS  36           HB1      HIS  36  -3.632   9.908  -1.520
   58    HD1  HIS  36           HD1      HIS  36  -2.676  12.833   0.181
   59    HD2  HIS  36           HD2      HIS  36  -5.063   9.579   1.188
   60    HE1  HIS  36           HE1      HIS  36  -4.144  13.622   2.062
   61    HE2  HIS  36           HE2      HIS  36  -5.699  11.695   2.535
   62    H    CYS  37           HN       CYS  37  -0.174   9.142  -1.752
   63    HA   CYS  37           HA       CYS  37   0.883   7.908  -3.326
   64    HB2  CYS  37           HB2      CYS  37  -0.718   5.587  -2.236
   65    HB3  CYS  37           HB1      CYS  37   0.741   5.479  -3.214
   66    H    ASP  38           HN       ASP  38   0.515   8.205  -5.362
   67    HA   ASP  38           HA       ASP  38  -1.996   8.339  -6.607
   68    HB2  ASP  38           HB2      ASP  38   0.545   7.677  -8.083
   69    HB3  ASP  38           HB1      ASP  38  -0.812   8.655  -8.627
   70    H    LYS  39           HN       LYS  39   0.357   5.784  -6.240
   71    HA   LYS  39           HA       LYS  39  -0.921   3.970  -8.057
   72    HB2  LYS  39           HB2      LYS  39   1.160   3.354  -5.954
   73    HB3  LYS  39           HB1      LYS  39   0.769   2.393  -7.376
   74    HG2  LYS  39           HG2      LYS  39   1.564   4.198  -8.810
   75    HG3  LYS  39           HG1      LYS  39   1.974   5.148  -7.382
   76    HD2  LYS  39           HD2      LYS  39   3.487   3.268  -6.686
   77    HD3  LYS  39           HD1      LYS  39   3.193   2.533  -8.262
   78    HE2  LYS  39           HE2      LYS  39   4.454   5.211  -7.706
   79    HE3  LYS  39           HE1      LYS  39   5.254   3.774  -8.339
   80    HZ1  LYS  39           HZ1      LYS  39   3.795   3.933 -10.303
   81    HZ2  LYS  39           HZ2      LYS  39   4.800   5.286 -10.121
   82    HZ3  LYS  39           HZ3      LYS  39   3.164   5.389  -9.699
   83    H    LYS  40           HN       LYS  40  -2.935   3.503  -7.469
   84    HA   LYS  40           HA       LYS  40  -3.307   2.181  -4.867
   85    HB2  LYS  40           HB2      LYS  40  -5.350   3.645  -6.553
   86    HB3  LYS  40           HB1      LYS  40  -5.707   2.772  -5.069
   87    HG2  LYS  40           HG2      LYS  40  -4.226   4.309  -3.841
   88    HG3  LYS  40           HG1      LYS  40  -3.959   5.206  -5.336
   89    HD2  LYS  40           HD2      LYS  40  -6.317   5.738  -5.475
   90    HD3  LYS  40           HD1      LYS  40  -6.645   4.764  -4.040
   91    HE2  LYS  40           HE2      LYS  40  -4.989   7.281  -4.181
   92    HE3  LYS  40           HE1      LYS  40  -6.580   7.106  -3.443
   93    HZ1  LYS  40           HZ1      LYS  40  -3.975   6.140  -2.484
   94    HZ2  LYS  40           HZ2      LYS  40  -5.378   5.304  -2.036
   95    HZ3  LYS  40           HZ3      LYS  40  -5.202   6.941  -1.630
   96    H    PHE  41           HN       PHE  41  -3.832   0.091  -4.922
   97    HA   PHE  41           HA       PHE  41  -4.762  -1.048  -7.472
   98    HB2  PHE  41           HB2      PHE  41  -2.873  -2.448  -5.567
   99    HB3  PHE  41           HB1      PHE  41  -3.324  -2.950  -7.192
  100    HD1  PHE  41           HD2      PHE  41  -2.529  -1.591  -9.145
  101    HD2  PHE  41           HD1      PHE  41  -1.032  -1.033  -5.199
  102    HE1  PHE  41           HE2      PHE  41  -0.564  -0.434 -10.062
  103    HE2  PHE  41           HE1      PHE  41   0.938   0.132  -6.110
  104    HZ   PHE  41           HZ       PHE  41   1.196   0.428  -8.501
  105    H    ASN  42           HN       ASN  42  -5.165  -3.623  -6.698
  106    HA   ASN  42           HA       ASN  42  -7.530  -3.679  -5.258
  107    HB2  ASN  42           HB2      ASN  42  -5.474  -5.739  -5.934
  108    HB3  ASN  42           HB1      ASN  42  -6.725  -6.154  -4.767
  109   HD21  ASN  42          HD21      ASN  42  -6.074  -5.216  -8.060
  110   HD22  ASN  42          HD22      ASN  42  -7.587  -5.749  -8.710
  111    H    GLN  43           HN       GLN  43  -8.060  -3.673  -3.154
  112    HA   GLN  43           HA       GLN  43  -6.000  -2.664  -1.406
  113    HB2  GLN  43           HB2      GLN  43  -8.959  -3.077  -0.952
  114    HB3  GLN  43           HB1      GLN  43  -7.880  -2.236   0.150
  115    HG2  GLN  43           HG2      GLN  43  -8.310  -1.379  -2.696
  116    HG3  GLN  43           HG1      GLN  43  -9.279  -0.785  -1.352
  117   HE21  GLN  43          HE21      GLN  43  -7.130  -0.705   0.537
  118   HE22  GLN  43          HE22      GLN  43  -6.101   0.609   0.081
  119    H    VAL  44           HN       VAL  44  -7.010  -5.759  -2.063
  120    HA   VAL  44           HA       VAL  44  -6.818  -6.695   0.688
  121    HB   VAL  44           HB       VAL  44  -7.234  -8.307  -1.840
  122   HG11  VAL  44          HG11      VAL  44  -6.294  -9.653  -0.045
  123   HG12  VAL  44          HG12      VAL  44  -7.987 -10.079  -0.305
  124   HG13  VAL  44          HG13      VAL  44  -7.534  -9.067   1.067
  125   HG21  VAL  44          HG21      VAL  44  -9.582  -8.419  -1.120
  126   HG22  VAL  44          HG22      VAL  44  -9.073  -6.765  -1.462
  127   HG23  VAL  44          HG23      VAL  44  -9.220  -7.318   0.207
  128    H    GLY  45           HN       GLY  45  -5.327  -7.883  -2.329
  129    HA2  GLY  45           HA2      GLY  45  -3.086  -8.876  -0.743
  130    HA3  GLY  45           HA1      GLY  45  -3.426  -9.252  -2.435
  131    H    ASN  46           HN       ASN  46  -3.603  -6.674  -3.484
  132    HA   ASN  46           HA       ASN  46  -0.820  -6.208  -3.846
  133    HB2  ASN  46           HB2      ASN  46  -3.295  -4.940  -4.960
  134    HB3  ASN  46           HB1      ASN  46  -1.728  -4.173  -5.209
  135   HD21  ASN  46          HD21      ASN  46  -3.462  -5.290  -7.215
  136   HD22  ASN  46          HD22      ASN  46  -2.563  -6.546  -7.998
  137    H    LEU  47           HN       LEU  47  -3.346  -4.553  -2.045
  138    HA   LEU  47           HA       LEU  47  -1.870  -2.265  -1.344
  139    HB2  LEU  47           HB2      LEU  47  -4.282  -2.485  -0.922
  140    HB3  LEU  47           HB1      LEU  47  -3.960  -3.731   0.279
  141    HG   LEU  47           HG       LEU  47  -2.618  -1.973   1.539
  142   HD11  LEU  47          HD11      LEU  47  -2.333  -0.395  -0.287
  143   HD12  LEU  47          HD12      LEU  47  -3.167   0.355   1.074
  144   HD13  LEU  47          HD13      LEU  47  -4.078  -0.141  -0.352
  145   HD21  LEU  47          HD21      LEU  47  -5.583  -1.578   1.178
  146   HD22  LEU  47          HD22      LEU  47  -4.623  -0.977   2.530
  147   HD23  LEU  47          HD23      LEU  47  -4.801  -2.712   2.278
  148    H    LYS  48           HN       LYS  48  -2.027  -5.493   0.032
  149    HA   LYS  48           HA       LYS  48  -0.513  -5.108   2.346
  150    HB2  LYS  48           HB2      LYS  48  -1.787  -7.162   1.804
  151    HB3  LYS  48           HB1      LYS  48  -0.610  -7.544   0.556
  152    HG2  LYS  48           HG2      LYS  48   1.131  -7.727   2.275
  153    HG3  LYS  48           HG1      LYS  48  -0.080  -7.392   3.518
  154    HD2  LYS  48           HD2      LYS  48  -1.347  -9.381   2.720
  155    HD3  LYS  48           HD1      LYS  48  -0.004  -9.742   1.632
  156    HE2  LYS  48           HE2      LYS  48   0.188 -11.058   3.653
  157    HE3  LYS  48           HE1      LYS  48   1.500  -9.883   3.562
  158    HZ1  LYS  48           HZ1      LYS  48   0.294  -8.459   5.095
  159    HZ2  LYS  48           HZ2      LYS  48   0.547  -9.987   5.781
  160    HZ3  LYS  48           HZ3      LYS  48  -0.980  -9.573   5.171
  161    H    ALA  49           HN       ALA  49   0.507  -6.018  -0.935
  162    HA   ALA  49           HA       ALA  49   3.284  -6.088  -0.343
  163    HB1  ALA  49           HB1      ALA  49   2.297  -7.258  -2.260
  164    HB2  ALA  49           HB2      ALA  49   3.599  -6.174  -2.753
  165    HB3  ALA  49           HB3      ALA  49   1.919  -5.703  -3.005
  166    H    HIS  50           HN       HIS  50   1.069  -3.586  -1.365
  167    HA   HIS  50           HA       HIS  50   2.949  -1.633  -2.121
  168    HB2  HIS  50           HB2      HIS  50   0.520  -1.500  -2.626
  169    HB3  HIS  50           HB1      HIS  50   0.203  -1.213  -0.908
  170    HD1  HIS  50           HD1      HIS  50   2.064   0.444  -3.806
  171    HD2  HIS  50           HD2      HIS  50   0.279   1.360  -0.161
  172    HE1  HIS  50           HE1      HIS  50   2.103   2.971  -3.607
  173    H    LEU  51           HN       LEU  51   1.392  -2.333   0.984
  174    HA   LEU  51           HA       LEU  51   2.679  -0.235   2.387
  175    HB2  LEU  51           HB2      LEU  51   1.145  -2.676   3.133
  176    HB3  LEU  51           HB1      LEU  51   2.151  -1.934   4.377
  177    HG   LEU  51           HG       LEU  51  -0.218  -1.196   4.444
  178   HD11  LEU  51          HD11      LEU  51   0.266   1.188   4.660
  179   HD12  LEU  51          HD12      LEU  51   1.781   0.959   3.786
  180   HD13  LEU  51          HD13      LEU  51   1.548   0.207   5.363
  181   HD21  LEU  51          HD21      LEU  51   0.421   0.126   1.814
  182   HD22  LEU  51          HD22      LEU  51  -1.056   0.338   2.755
  183   HD23  LEU  51          HD23      LEU  51  -0.682  -1.230   2.044
  184    H    LYS  52           HN       LYS  52   3.578  -3.511   1.578
  185    HA   LYS  52           HA       LYS  52   5.782  -3.703   3.340
  186    HB2  LYS  52           HB2      LYS  52   5.056  -5.175   0.822
  187    HB3  LYS  52           HB1      LYS  52   6.538  -5.515   1.706
  188    HG2  LYS  52           HG2      LYS  52   3.726  -5.774   2.746
  189    HG3  LYS  52           HG1      LYS  52   4.830  -7.089   2.336
  190    HD2  LYS  52           HD2      LYS  52   6.392  -6.209   4.083
  191    HD3  LYS  52           HD1      LYS  52   5.131  -5.071   4.556
  192    HE2  LYS  52           HE2      LYS  52   5.089  -6.996   6.017
  193    HE3  LYS  52           HE1      LYS  52   3.631  -6.963   5.027
  194    HZ1  LYS  52           HZ1      LYS  52   6.026  -8.584   4.352
  195    HZ2  LYS  52           HZ2      LYS  52   4.482  -8.680   3.652
  196    HZ3  LYS  52           HZ3      LYS  52   4.722  -9.183   5.254
  197    H    ILE  53           HN       ILE  53   5.448  -2.386   0.075
  198    HA   ILE  53           HA       ILE  53   8.287  -2.126  -0.275
  199    HB   ILE  53           HB       ILE  53   6.638  -2.287  -2.190
  200   HG12  ILE  53          HG12      ILE  53   7.891  -0.680  -3.619
  201   HG13  ILE  53          HG11      ILE  53   8.593   0.016  -2.165
  202   HG21  ILE  53          HG21      ILE  53   4.994  -0.674  -1.393
  203   HG22  ILE  53          HG22      ILE  53   5.601  -0.230  -2.989
  204   HG23  ILE  53          HG23      ILE  53   6.178   0.623  -1.554
  205   HD11  ILE  53          HD11      ILE  53   8.966  -2.805  -3.145
  206   HD12  ILE  53          HD12      ILE  53   9.630  -2.149  -1.651
  207   HD13  ILE  53          HD13      ILE  53  10.153  -1.503  -3.207
  208    H    HIS  54           HN       HIS  54   5.853  -0.330   1.325
  209    HA   HIS  54           HA       HIS  54   7.363   2.117   1.458
  210    HB2  HIS  54           HB2      HIS  54   4.913   1.111   2.889
  211    HB3  HIS  54           HB1      HIS  54   5.713   2.592   3.391
  212    HD1  HIS  54           HD1      HIS  54   5.854   4.495   1.403
  213    HD2  HIS  54           HD2      HIS  54   3.095   1.419   0.935
  214    HE1  HIS  54           HE1      HIS  54   4.154   5.308  -0.291
  215    H    ILE  55           HN       ILE  55   7.162  -0.854   3.218
  216    HA   ILE  55           HA       ILE  55   8.651   0.143   5.497
  217    HB   ILE  55           HB       ILE  55   7.808  -2.672   4.772
  218   HG12  ILE  55          HG12      ILE  55   6.640  -0.718   6.771
  219   HG13  ILE  55          HG11      ILE  55   5.928  -1.134   5.208
  220   HG21  ILE  55          HG21      ILE  55   8.914  -1.623   7.376
  221   HG22  ILE  55          HG22      ILE  55   9.773  -2.653   6.232
  222   HG23  ILE  55          HG23      ILE  55   8.349  -3.265   7.071
  223   HD11  ILE  55          HD11      ILE  55   4.823  -2.309   7.018
  224   HD12  ILE  55          HD12      ILE  55   6.357  -3.023   7.515
  225   HD13  ILE  55          HD13      ILE  55   5.653  -3.442   5.952
  226    H    ALA  56           HN       ALA  56   9.177  -1.826   2.643
  227    HA   ALA  56           HA       ALA  56  11.923  -2.413   3.329
  228    HB1  ALA  56           HB1      ALA  56  11.963  -3.613   1.200
  229    HB2  ALA  56           HB2      ALA  56  10.371  -2.968   0.803
  230    HB3  ALA  56           HB3      ALA  56  10.557  -4.075   2.161
  231    H    ASP  57           HN       ASP  57  13.608  -2.019   1.602
  232    HA   ASP  57           HA       ASP  57  13.295   0.683   0.468
  233    HB2  ASP  57           HB2      ASP  57  15.134   0.559   2.062
  234    HB3  ASP  57           HB1      ASP  57  15.811  -0.825   1.211
  235    H    GLY  58           HN       GLY  58  13.257   0.880  -1.670
  236    HA2  GLY  58           HA2      GLY  58  14.021  -1.480  -3.267
  237    HA3  GLY  58           HA1      GLY  58  12.802  -0.294  -3.749
  Start of MODEL   20
    1    H1   LYS  30           HT1      LYS  30  -8.002   3.400  10.210
    2    H2   LYS  30           HT2      LYS  30  -9.299   4.441   9.920
    3    H3   LYS  30           HT3      LYS  30  -8.302   4.690  11.269
    4    HA   LYS  30           HA       LYS  30  -7.593   5.034   8.412
    5    HB2  LYS  30           HB2      LYS  30  -7.396   7.005  10.698
    6    HB3  LYS  30           HB1      LYS  30  -7.273   7.340   8.978
    7    HG2  LYS  30           HG2      LYS  30  -9.786   6.344  10.296
    8    HG3  LYS  30           HG1      LYS  30  -9.409   8.053  10.077
    9    HD2  LYS  30           HD2      LYS  30  -9.569   6.047   7.831
   10    HD3  LYS  30           HD1      LYS  30 -10.902   7.093   8.323
   11    HE2  LYS  30           HE2      LYS  30  -9.418   9.052   7.906
   12    HE3  LYS  30           HE1      LYS  30  -8.217   7.942   7.251
   13    HZ1  LYS  30           HZ1      LYS  30 -10.969   8.299   6.196
   14    HZ2  LYS  30           HZ2      LYS  30  -9.777   7.282   5.543
   15    HZ3  LYS  30           HZ3      LYS  30  -9.566   8.967   5.521
   16    H    GLU  31           HN       GLU  31  -5.834   3.613   8.379
   17    HA   GLU  31           HA       GLU  31  -3.590   4.402  10.096
   18    HB2  GLU  31           HB2      GLU  31  -4.697   2.470  11.145
   19    HB3  GLU  31           HB1      GLU  31  -4.500   1.555   9.658
   20    HG2  GLU  31           HG2      GLU  31  -2.809   0.846  11.137
   21    HG3  GLU  31           HG1      GLU  31  -2.032   1.845   9.912
   22    H    HIS  32           HN       HIS  32  -4.238   1.878   7.630
   23    HA   HIS  32           HA       HIS  32  -1.558   2.374   6.637
   24    HB2  HIS  32           HB2      HIS  32  -1.698   0.281   5.481
   25    HB3  HIS  32           HB1      HIS  32  -2.304   0.050   7.110
   26    HD1  HIS  32           HD1      HIS  32  -4.971  -0.206   7.320
   27    HD2  HIS  32           HD2      HIS  32  -3.381  -0.484   3.486
   28    HE1  HIS  32           HE1      HIS  32  -6.754  -1.287   5.917
   29    HE2  HIS  32           HE2      HIS  32  -5.652  -1.698   3.694
   30    H    LYS  33           HN       LYS  33  -1.426   4.055   5.349
   31    HA   LYS  33           HA       LYS  33  -2.632   3.798   2.729
   32    HB2  LYS  33           HB2      LYS  33  -4.181   5.284   4.080
   33    HB3  LYS  33           HB1      LYS  33  -2.851   6.430   4.204
   34    HG2  LYS  33           HG2      LYS  33  -2.792   6.278   1.621
   35    HG3  LYS  33           HG1      LYS  33  -4.414   5.608   1.788
   36    HD2  LYS  33           HD2      LYS  33  -4.616   7.959   1.407
   37    HD3  LYS  33           HD1      LYS  33  -5.039   7.646   3.092
   38    HE2  LYS  33           HE2      LYS  33  -2.944   8.460   3.858
   39    HE3  LYS  33           HE1      LYS  33  -2.282   8.484   2.226
   40    HZ1  LYS  33           HZ1      LYS  33  -4.432  10.252   3.272
   41    HZ2  LYS  33           HZ2      LYS  33  -3.884  10.233   1.669
   42    HZ3  LYS  33           HZ3      LYS  33  -2.835  10.700   2.915
   43    H    CYS  34           HN       CYS  34  -1.328   4.693   1.127
   44    HA   CYS  34           HA       CYS  34   1.326   5.489   1.875
   45    HB2  CYS  34           HB2      CYS  34  -0.079   5.512  -0.797
   46    HB3  CYS  34           HB1      CYS  34   1.619   5.892  -0.564
   47    HA   PRO  35           HA       PRO  35   0.290   9.774   2.614
   48    HB2  PRO  35           HB2      PRO  35   3.237  10.009   2.259
   49    HB3  PRO  35           HB1      PRO  35   2.207  10.599   3.570
   50    HG2  PRO  35           HG2      PRO  35   3.738   8.459   3.928
   51    HG3  PRO  35           HG1      PRO  35   2.096   8.521   4.596
   52    HD2  PRO  35           HD2      PRO  35   3.106   7.077   2.181
   53    HD3  PRO  35           HD1      PRO  35   1.911   6.560   3.390
   54    H    HIS  36           HN       HIS  36   2.680   8.912   0.054
   55    HA   HIS  36           HA       HIS  36   1.866  11.366  -1.318
   56    HB2  HIS  36           HB2      HIS  36   3.856  11.379  -2.494
   57    HB3  HIS  36           HB1      HIS  36   4.345  10.668  -0.967
   58    HD1  HIS  36           HD1      HIS  36   3.654   9.726  -4.565
   59    HD2  HIS  36           HD2      HIS  36   5.464   8.154  -1.162
   60    HE1  HIS  36           HE1      HIS  36   4.879   7.671  -5.332
   61    HE2  HIS  36           HE2      HIS  36   6.134   6.862  -3.302
   62    H    CYS  37           HN       CYS  37   1.694   7.884  -1.729
   63    HA   CYS  37           HA       CYS  37   1.077   7.948  -4.503
   64    HB2  CYS  37           HB2      CYS  37   0.267   5.789  -2.555
   65    HB3  CYS  37           HB1      CYS  37   0.486   5.638  -4.292
   66    H    ASP  38           HN       ASP  38  -0.744   8.482  -5.472
   67    HA   ASP  38           HA       ASP  38  -3.225   8.661  -3.918
   68    HB2  ASP  38           HB2      ASP  38  -2.447   9.764  -6.623
   69    HB3  ASP  38           HB1      ASP  38  -4.092   9.824  -5.996
   70    H    LYS  39           HN       LYS  39  -1.571   6.677  -6.036
   71    HA   LYS  39           HA       LYS  39  -3.782   5.481  -7.371
   72    HB2  LYS  39           HB2      LYS  39  -2.134   3.696  -7.953
   73    HB3  LYS  39           HB1      LYS  39  -1.609   5.318  -8.382
   74    HG2  LYS  39           HG2      LYS  39  -0.098   5.400  -6.542
   75    HG3  LYS  39           HG1      LYS  39  -0.756   3.908  -5.866
   76    HD2  LYS  39           HD2      LYS  39   1.385   3.509  -6.975
   77    HD3  LYS  39           HD1      LYS  39   0.075   2.664  -7.796
   78    HE2  LYS  39           HE2      LYS  39  -0.014   4.427  -9.480
   79    HE3  LYS  39           HE1      LYS  39   1.282   5.293  -8.655
   80    HZ1  LYS  39           HZ1      LYS  39   2.188   4.061 -10.487
   81    HZ2  LYS  39           HZ2      LYS  39   1.475   2.623  -9.945
   82    HZ3  LYS  39           HZ3      LYS  39   2.718   3.344  -9.044
   83    H    LYS  40           HN       LYS  40  -5.318   4.476  -6.255
   84    HA   LYS  40           HA       LYS  40  -4.429   2.394  -4.384
   85    HB2  LYS  40           HB2      LYS  40  -6.545   2.658  -3.143
   86    HB3  LYS  40           HB1      LYS  40  -5.554   4.107  -3.096
   87    HG2  LYS  40           HG2      LYS  40  -6.963   5.089  -4.866
   88    HG3  LYS  40           HG1      LYS  40  -7.996   3.656  -4.795
   89    HD2  LYS  40           HD2      LYS  40  -8.476   4.113  -2.447
   90    HD3  LYS  40           HD1      LYS  40  -7.417   5.523  -2.495
   91    HE2  LYS  40           HE2      LYS  40  -8.883   6.523  -4.208
   92    HE3  LYS  40           HE1      LYS  40  -9.964   5.135  -4.064
   93    HZ1  LYS  40           HZ1      LYS  40 -10.232   5.703  -1.693
   94    HZ2  LYS  40           HZ2      LYS  40 -10.796   6.922  -2.726
   95    HZ3  LYS  40           HZ3      LYS  40  -9.304   7.101  -1.936
   96    H    PHE  41           HN       PHE  41  -5.317   0.402  -4.602
   97    HA   PHE  41           HA       PHE  41  -7.348  -0.096  -6.584
   98    HB2  PHE  41           HB2      PHE  41  -5.722  -1.753  -7.760
   99    HB3  PHE  41           HB1      PHE  41  -5.656  -0.048  -8.178
  100    HD1  PHE  41           HD1      PHE  41  -3.851   1.366  -7.062
  101    HD2  PHE  41           HD2      PHE  41  -3.821  -2.888  -7.036
  102    HE1  PHE  41           HE1      PHE  41  -1.448   1.384  -6.538
  103    HE2  PHE  41           HE2      PHE  41  -1.418  -2.875  -6.516
  104    HZ   PHE  41           HZ       PHE  41  -0.212  -0.729  -6.341
  105    H    ASN  42           HN       ASN  42  -6.295  -2.926  -6.835
  106    HA   ASN  42           HA       ASN  42  -7.942  -4.096  -4.984
  107    HB2  ASN  42           HB2      ASN  42  -6.876  -6.223  -5.475
  108    HB3  ASN  42           HB1      ASN  42  -7.065  -5.285  -6.946
  109   HD21  ASN  42          HD21      ASN  42  -5.231  -4.483  -7.987
  110   HD22  ASN  42          HD22      ASN  42  -3.645  -5.083  -7.637
  111    H    GLN  43           HN       GLN  43  -7.926  -4.384  -2.896
  112    HA   GLN  43           HA       GLN  43  -5.548  -3.429  -1.481
  113    HB2  GLN  43           HB2      GLN  43  -7.110  -2.946   0.373
  114    HB3  GLN  43           HB1      GLN  43  -7.545  -2.121  -1.117
  115    HG2  GLN  43           HG2      GLN  43  -9.297  -3.703  -1.546
  116    HG3  GLN  43           HG1      GLN  43  -8.801  -4.685  -0.169
  117   HE21  GLN  43          HE21      GLN  43 -10.391  -1.770  -1.195
  118   HE22  GLN  43          HE22      GLN  43 -11.117  -1.399   0.338
  119    H    VAL  44           HN       VAL  44  -6.606  -6.374  -2.260
  120    HA   VAL  44           HA       VAL  44  -6.459  -7.527   0.414
  121    HB   VAL  44           HB       VAL  44  -6.894  -8.929  -2.231
  122   HG11  VAL  44          HG11      VAL  44  -5.970 -10.388  -0.502
  123   HG12  VAL  44          HG12      VAL  44  -7.638 -10.814  -0.878
  124   HG13  VAL  44          HG13      VAL  44  -7.268  -9.917   0.596
  125   HG21  VAL  44          HG21      VAL  44  -9.245  -9.047  -1.580
  126   HG22  VAL  44          HG22      VAL  44  -8.711  -7.372  -1.717
  127   HG23  VAL  44          HG23      VAL  44  -8.900  -8.110  -0.126
  128    H    GLY  45           HN       GLY  45  -4.913  -8.322  -2.709
  129    HA2  GLY  45           HA2      GLY  45  -2.738  -9.572  -1.217
  130    HA3  GLY  45           HA1      GLY  45  -3.022  -9.700  -2.953
  131    H    ASN  46           HN       ASN  46  -2.931  -7.261  -3.945
  132    HA   ASN  46           HA       ASN  46  -0.142  -6.854  -3.963
  133    HB2  ASN  46           HB2      ASN  46  -1.628  -6.395  -5.917
  134    HB3  ASN  46           HB1      ASN  46  -2.211  -4.958  -5.080
  135   HD21  ASN  46          HD21      ASN  46   0.385  -6.404  -6.816
  136   HD22  ASN  46          HD22      ASN  46   1.376  -4.987  -6.940
  137    H    LEU  47           HN       LEU  47  -2.778  -5.066  -2.415
  138    HA   LEU  47           HA       LEU  47  -1.255  -2.814  -1.706
  139    HB2  LEU  47           HB2      LEU  47  -3.737  -2.931  -1.621
  140    HB3  LEU  47           HB1      LEU  47  -3.602  -3.940  -0.184
  141    HG   LEU  47           HG       LEU  47  -2.502  -2.092   1.013
  142   HD11  LEU  47          HD11      LEU  47  -3.029  -0.514  -1.503
  143   HD12  LEU  47          HD12      LEU  47  -1.446  -0.980  -0.879
  144   HD13  LEU  47          HD13      LEU  47  -2.455   0.148   0.026
  145   HD21  LEU  47          HD21      LEU  47  -4.453  -0.658   1.239
  146   HD22  LEU  47          HD22      LEU  47  -4.936  -2.351   1.130
  147   HD23  LEU  47          HD23      LEU  47  -5.111  -1.293  -0.269
  148    H    LYS  48           HN       LYS  48  -1.558  -5.962  -0.198
  149    HA   LYS  48           HA       LYS  48  -0.264  -5.330   2.232
  150    HB2  LYS  48           HB2      LYS  48  -0.394  -7.909   0.668
  151    HB3  LYS  48           HB1      LYS  48   0.382  -7.775   2.239
  152    HG2  LYS  48           HG2      LYS  48  -1.779  -7.040   3.194
  153    HG3  LYS  48           HG1      LYS  48  -2.530  -7.324   1.620
  154    HD2  LYS  48           HD2      LYS  48  -1.849  -9.675   1.728
  155    HD3  LYS  48           HD1      LYS  48  -1.104  -9.389   3.301
  156    HE2  LYS  48           HE2      LYS  48  -4.031  -9.121   2.623
  157    HE3  LYS  48           HE1      LYS  48  -3.290 -10.418   3.558
  158    HZ1  LYS  48           HZ1      LYS  48  -2.508  -8.480   5.063
  159    HZ2  LYS  48           HZ2      LYS  48  -4.105  -9.036   5.178
  160    HZ3  LYS  48           HZ3      LYS  48  -3.768  -7.616   4.322
  161    H    ALA  49           HN       ALA  49   0.973  -6.515  -0.883
  162    HA   ALA  49           HA       ALA  49   3.716  -6.421  -0.105
  163    HB1  ALA  49           HB1      ALA  49   2.921  -7.832  -1.945
  164    HB2  ALA  49           HB2      ALA  49   4.202  -6.740  -2.475
  165    HB3  ALA  49           HB3      ALA  49   2.521  -6.389  -2.875
  166    H    HIS  50           HN       HIS  50   1.491  -4.176  -1.553
  167    HA   HIS  50           HA       HIS  50   3.197  -2.181  -2.486
  168    HB2  HIS  50           HB2      HIS  50   0.700  -2.421  -2.824
  169    HB3  HIS  50           HB1      HIS  50   0.486  -1.799  -1.187
  170    HD1  HIS  50           HD1      HIS  50   0.494  -0.705  -4.592
  171    HD2  HIS  50           HD2      HIS  50   1.701   0.921  -0.973
  172    HE1  HIS  50           HE1      HIS  50   0.534   1.797  -4.924
  173    H    LEU  51           HN       LEU  51   1.518  -2.361   0.655
  174    HA   LEU  51           HA       LEU  51   2.852  -0.145   1.794
  175    HB2  LEU  51           HB2      LEU  51   1.557  -2.510   3.158
  176    HB3  LEU  51           HB1      LEU  51   1.978  -0.985   3.930
  177    HG   LEU  51           HG       LEU  51  -0.023  -1.245   1.681
  178   HD11  LEU  51          HD11      LEU  51  -0.789  -2.420   3.680
  179   HD12  LEU  51          HD12      LEU  51  -1.724  -0.949   3.402
  180   HD13  LEU  51          HD13      LEU  51  -0.476  -0.980   4.649
  181   HD21  LEU  51          HD21      LEU  51   0.609   1.031   3.560
  182   HD22  LEU  51          HD22      LEU  51  -0.653   1.024   2.328
  183   HD23  LEU  51          HD23      LEU  51   1.044   0.952   1.853
  184    H    LYS  52           HN       LYS  52   3.587  -3.524   1.551
  185    HA   LYS  52           HA       LYS  52   5.573  -3.724   3.526
  186    HB2  LYS  52           HB2      LYS  52   4.521  -5.685   2.553
  187    HB3  LYS  52           HB1      LYS  52   5.189  -5.297   0.975
  188    HG2  LYS  52           HG2      LYS  52   7.463  -5.590   1.930
  189    HG3  LYS  52           HG1      LYS  52   6.708  -6.131   3.432
  190    HD2  LYS  52           HD2      LYS  52   5.707  -8.003   2.339
  191    HD3  LYS  52           HD1      LYS  52   6.197  -7.407   0.751
  192    HE2  LYS  52           HE2      LYS  52   8.572  -7.632   1.487
  193    HE3  LYS  52           HE1      LYS  52   7.986  -8.406   2.958
  194    HZ1  LYS  52           HZ1      LYS  52   8.682  -9.954   1.160
  195    HZ2  LYS  52           HZ2      LYS  52   7.373  -9.404   0.235
  196    HZ3  LYS  52           HZ3      LYS  52   7.095 -10.196   1.711
  197    H    ILE  53           HN       ILE  53   5.818  -3.003   0.031
  198    HA   ILE  53           HA       ILE  53   8.668  -2.913   0.094
  199    HB   ILE  53           HB       ILE  53   8.568  -1.965  -2.149
  200   HG12  ILE  53          HG12      ILE  53   5.571  -1.868  -1.749
  201   HG13  ILE  53          HG11      ILE  53   6.633  -0.466  -1.812
  202   HG21  ILE  53          HG21      ILE  53   7.362  -3.794  -3.256
  203   HG22  ILE  53          HG22      ILE  53   6.592  -4.200  -1.723
  204   HG23  ILE  53          HG23      ILE  53   8.339  -4.365  -1.903
  205   HD11  ILE  53          HD11      ILE  53   6.126  -2.409  -4.053
  206   HD12  ILE  53          HD12      ILE  53   7.209  -1.019  -4.124
  207   HD13  ILE  53          HD13      ILE  53   5.475  -0.776  -3.915
  208    H    HIS  54           HN       HIS  54   6.191  -0.610   0.836
  209    HA   HIS  54           HA       HIS  54   7.918   1.676   0.654
  210    HB2  HIS  54           HB2      HIS  54   5.199   1.234   1.841
  211    HB3  HIS  54           HB1      HIS  54   6.069   2.739   2.109
  212    HD1  HIS  54           HD1      HIS  54   6.778   4.019  -0.249
  213    HD2  HIS  54           HD2      HIS  54   3.752   1.171  -0.402
  214    HE1  HIS  54           HE1      HIS  54   5.458   4.480  -2.367
  215    H    ILE  55           HN       ILE  55   7.103  -0.648   3.142
  216    HA   ILE  55           HA       ILE  55   8.595   0.906   5.123
  217    HB   ILE  55           HB       ILE  55   7.875  -0.737   6.766
  218   HG12  ILE  55          HG12      ILE  55   6.464  -2.103   4.457
  219   HG13  ILE  55          HG11      ILE  55   7.871  -2.731   5.320
  220   HG21  ILE  55          HG21      ILE  55   6.424   1.167   6.263
  221   HG22  ILE  55          HG22      ILE  55   5.489  -0.248   6.746
  222   HG23  ILE  55          HG23      ILE  55   5.585   0.206   5.044
  223   HD11  ILE  55          HD11      ILE  55   5.144  -2.250   6.502
  224   HD12  ILE  55          HD12      ILE  55   6.547  -2.880   7.363
  225   HD13  ILE  55          HD13      ILE  55   5.824  -3.813   6.053
  226    H    ALA  56           HN       ALA  56   9.320  -1.143   2.732
  227    HA   ALA  56           HA       ALA  56  11.251  -2.815   4.083
  228    HB1  ALA  56           HB1      ALA  56  10.770  -2.389   1.130
  229    HB2  ALA  56           HB2      ALA  56  10.034  -3.652   2.117
  230    HB3  ALA  56           HB3      ALA  56  11.777  -3.647   1.847
  231    H    ASP  57           HN       ASP  57  13.511  -2.704   3.691
  232    HA   ASP  57           HA       ASP  57  14.443   0.010   3.715
  233    HB2  ASP  57           HB2      ASP  57  16.579  -0.862   4.318
  234    HB3  ASP  57           HB1      ASP  57  15.383  -1.833   5.168
  235    H    GLY  58           HN       GLY  58  15.799   1.010   2.256
  236    HA2  GLY  58           HA2      GLY  58  17.168   0.497   0.147
  237    HA3  GLY  58           HA1      GLY  58  15.623  -0.109  -0.453