*HEADER    TRANSLATION                             23-OCT-01   1K8B              
*TITLE     NMR STRUCTURE ANALYSIS OF THE N-TERMINAL DOMAIN OF ARCHAEAL           
*TITLE    2 TRANSLATION INITIATION FACTOR 2 SUBUNIT BETA                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROBABLE TRANSLATION INITIATION FACTOR 2 BETA              
*COMPND   3 SUBUNIT;                                                             
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 SYNONYM: EIF-2-BETA;                                                 
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: METHANOCOCCUS JANNASCHII;                       
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET14B                                    
*KEYWDS    N-TERMINAL DOMAIN, AIF2 SUBUNIT BETA                                  
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    S.CHO, D.W.HOFFMAN                                                    
*REVDAT   1   24-APR-02 1K8B    0                                                


{******beta sheet **** }
 
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{ ********* helix 52-60 ******** }

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{ ********* helix 62-74 ******** }


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{******beta sheet 78-81, 84-88 **** }
 
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{ E39 HN 8.66 }

 assign (resid 39 and name hn ) (resid 38 and name hn ) 2.0 1.0 2.0 { m,7.45 }

{***** anti-parallel strand 1  *****}

{ I40 HN 8.27 }

assign (resid 40 and name hn ) (resid 40 and name ha ) 2.0 1.0 1.0 { s,5.07}
assign (resid 40 and name hn ) (resid 40 and name hb*) 2.0 1.0 2.0 { m,1.67}

assign (resid 40 and name ha ) (resid 49 and name ha ) 2.0 1.0 1.0 { s,4.78*}
assign (resid 40 and name ha ) (resid 50 and name hn ) 2.0 1.0 2.0 { m,8.92*}

{ L41 HN 9.39 }
assign (resid 41 and name hn ) (resid 41 and name ha ) 2.0 1.0 2.0 { m,4.78 }
assign (resid 41 and name hn ) (resid 40 and name ha ) 2.0 1.0 1.0 { s,5.07 }
assign (resid 41 and name hn ) (resid 41 and name hb*) 2.0 1.0 2.0 { m,1.53 }
assign (resid 41 and name hn ) (resid 40 and name hg2*) 2.0 1.0 2.0 { m,0.71 }
assign (resid 41 and name hn ) (resid 48 and name hn ) 2.0 1.0 2.0 { m,9.49*}

{ I42 HN 8.60 }

assign (resid 42 and name ha ) (resid 47 and name ha ) 2.0 1.0 1.0 { s,4.83*}
assign (resid 42 and name ha ) (resid 41 and name hb*) 2.0 1.0 2.0 { m,1.53}

{ E43 HN 8.38 }

assign (resid 43 and name hn ) (resid 43 and name ha ) 2.0 1.0 2.0 { m,4.59 }
assign (resid 43 and name hn ) (resid 42 and name ha ) 2.0 1.0 2.0 { m,4.77 }
assign (resid 43 and name hn ) (resid 43 and name hb*) 2.0 1.0 2.0 { m,1.71 }
assign (resid 43 and name hn ) (resid 43 and name hg*) 2.0 1.0 2.0 { m,2.04 }

assign (resid 43 and name hn ) (resid 46 and name hn ) 2.0 1.0 2.0 { m,7.58 }
assign (resid 43 and name hn ) (resid 42 and name hn ) 2.0 1.0 3.0 { w,8.6 }

{ G44 NH 8.84 }

assign (resid 44 and name hn ) (resid 44 and name ha1) 2.0 1.0 1.0 { s,3.88 }
assign (resid 44 and name hn ) (resid 44 and name ha2) 2.0 1.0 2.0 { m,3.61 }
assign (resid 44 and name hn ) (resid 43 and name ha ) 2.0 1.0 2.0 { m,4.59 }

{ N45 NH 8.57 }

assign (resid 45 and name hn ) (resid 44 and name ha1)  2.0 1.0 2.0 { m,3.87 }
assign (resid 45 and name hn ) (resid 45 and name hd2*) 2.0 1.0 2.0 { m,6.85 }
assign (resid 45 and name hn ) (resid 45 and name hd22) 2.0 1.0 2.0 { m,7.47 } 

{ R46 NH 7.58 }

assign (resid 46 and name hn ) (resid 46 and name hb*) 2.0 1.0 2.0 { m,1.81 }
assign (resid 46 and name hn ) (resid 45 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 46 and name hn ) (resid 44 and name ha1) 2.0 1.0 2.0 { m,3.88 }
assign (resid 46 and name hn ) (resid 44 and name ha1) 2.0 1.0 2.0 { m,3.61 }
assign (resid 46 and name hn ) (resid 45 and name hn ) 2.0 1.0 2.0 { m,8.60 }
assign (resid 46 and name ha ) (resid 88 and name ha ) 2.0 1.0 1.0 { s,4.34* }

{ T47 NH 8.62 }

assign (resid 47 and name hn ) (resid 46 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 47 and name hn ) (resid 47 and name ha ) 2.0 1.0 2.0 { m,4.83 }
assign (resid 47 and name hn ) (resid 47 and name hg2*)2.0 1.0 2.0 { m,1.09 }
assign (resid 47 and name hn ) (resid 47 and name hb ) 2.0 1.0 1.0 { s,3.92 }
assign (resid 47 and name hn ) (resid 47 and name hg1) 2.0 1.0 2.0 { m,6.11 }

assign (resid 47 and name hn ) (resid 87 and name hn ) 2.0 1.0 2.0 { m,9.31* }
assign (resid 47 and name hn ) (resid 88 and name ha ) 2.0 1.0 2.0 { m,4.34*}
assign (resid 47 and name hn ) (resid 89 and name hn ) 2.0 1.0 2.0 { m,8.01*}

assign (resid 47 and name ha ) (resid 47 and name hb ) 2.0 1.0 2.0 { m,1 }
assign (resid 47 and name hb ) (resid 47 and name hg1) 2.0 1.0 2.0 { m,6.13 }
assign (resid 47 and name hb ) (resid 47 and name hg2*)2.0 1.0 2.0 { m,1.09 }
assign (resid 47 and name hb ) (resid 89 and name hn ) 2.0 1.0 2.0 { m,8.01* }
assign (resid 47 and name hb ) (resid 41 and name hn ) 2.0 1.0 3.0 { w,9.39* }

{ I48 NH 9.49 }

assign (resid 48 and name hn ) (resid 48 and name ha ) 2.0 1.0 1.0 { s,5.03 }
assign (resid 48 and name hn ) (resid 47 and name ha ) 2.0 1.0 1.0 { s,4.83 }
assign (resid 48 and name hn ) (resid 48 and name hb*) 2.0 1.0 2.0 { m,1.83 }

assign (resid 48 and name hn ) (resid 48 and name hg1*) 2.0 1.0 2.0 { m }
assign (resid 48 and name hn ) (resid 48 and name hg2*) 2.0 1.0 2.0 { m }

assign (resid 48 and name hn ) (resid 47 and name hb  ) 2.0 1.0 2.0  { m }
assign (resid 48 and name hn ) (resid 47 and name hg* ) 2.0 1.0 2.0 { m }
assign (resid 48 and name hn ) (resid 47 and name hg* ) 2.0 1.0 2.0 { m }
assign (resid 48 and name hn ) (resid 47 and name hg* ) 2.0 1.0 2.0 { m }

assign (resid 48 and name hn ) (resid 47 and name hn ) 2.0 1.0 4.0 { v,8.60 }

assign (resid 48 and name ha ) (resid 86 and name ha ) 2.0 1.0 1.0 { s,4.34* }
assign (resid 48 and name ha ) (resid 87 and name hn ) 2.0 1.0 2.0 { m,9.31* }

{ I49 NH 9.12 }
assign (resid 49 and name hn ) (resid 48 and name hn ) 2.0 1.0 3.0 { w,9.12}
assign (resid 49 and name hn ) (resid 48 and name ha ) 2.0 1.0 3.0 { w,}
assign (resid 49 and name hn ) (resid 85 and name hn ) 2.0 1.0 2.0 { m,7.69* }
assign (resid 49 and name hn ) (resid 87 and name hn ) 2.0 1.0 3.0 { w,9.31* }

assign (resid 49 and name hb ) (resid 85 and name hd2*) 2.0 1.0 3.0 { w,-0.02* }

{ R50 NH 8.92 }
assign (resid 50 and name hn ) (resid 50 and name ha ) 2.0 1.0 2.0 { m,3.79 }
assign (resid 50 and name hn ) (resid 50 and name hb*) 2.0 1.0 2.0 { m,1.62 }
assign (resid 50 and name hn ) (resid 49 and name ha ) 2.0 1.0 1.0 { s,4.78 }

assign (resid 50 and name hn ) (resid 40 and name ha ) 2.0 1.0 2.0 { m,5.07* }

assign (resid 50 and name hn ) (resid 49 and name hg1*) 2.0 1.0 2.0 { m }
assign (resid 50 and name hn ) (resid 49 and name hg2*) 2.0 1.0 2.0 { m }
assign (resid 50 and name hn ) (resid 49 and name hb* ) 2.0 1.0 2.0 { m }

assign (resid 50 and name hn ) (resid 51 and name hn ) 2.0 1.0 2.0 { m,8.49 }

{ N51 HN 8.49 }

assign (resid 51 and name hn ) (resid 51 and name ha ) 2.0 1.0 1.0 { s,5.25 }
assign (resid 51 and name hn ) (resid 51 and name hb1) 2.0 1.0 1.0 { s,2.55 }
assign (resid 51 and name hn ) (resid 51 and name hb2) 2.0 1.0 3.0 { w,3.10 }

assign (resid 51 and name hn ) (resid 50 and name hn ) 2.0 1.0 2.0 { m,8.92 }
assign (resid 51 and name hn ) (resid 52 and name hn ) 2.0 1.0 3.0 { w,7.07 }

assign (resid 51 and name ha ) (resid 51 and name hb2) 2.0 1.0 1.0 { s,3.10 }
assign (resid 51 and name ha ) (resid 51 and name hb1) 2.0 1.0 1.0 { s,2.55 }

assign (resid 51 and name ha ) (resid 84 and name ha ) 2.0 1.0 3.0 { w,4.94* }

assign (resid 51 and name ha ) (resid 52 and name hn ) 2.0 1.0 2.0 { m,7.07  }
assign (resid 51 and name ha ) (resid 53 and name hn ) 2.0 1.0 4.0 { v,5.25  }
assign (resid 51 and name ha ) (resid 51 and name hd*) 2.0 1.0 2.0 { m,7.4/7.64}


{ F52 HN 7.07 }

assign (resid 52 and name hn ) (resid 52 and name ha ) 2.0 1.0 1.0 { s,3.75 }
assign (resid 52 and name hn ) (resid 51 and name ha ) 2.0 1.0 1.0 { s,5.25 }
assign (resid 52 and name hn ) (resid 84 and name ha ) 2.0 1.0 2.0 { m,4.93*}
assign (resid 52 and name hn ) (resid 85 and name hn ) 2.0 1.0 2.0 { m,7.69 }
assign (resid 52 and name hn ) (resid 51 and name hn ) 2.0 1.0 3.0 { w,8.49 }
assign (resid 52 and name hn ) (resid 53 and name hn ) 2.0 1.0 2.0 { m,8.42 }

{ F52 aromatic ring delta 6.71 } 

assign (resid 52 and name hd2) (resid 63 and name hb1 ) 2.0 1.0 4.0 { w,2.05*}
assign (resid 52 and name hd2) (resid 63 and name hb2 ) 2.0 1.0 4.0 { w,2.17*}

{ F52 aromatic ring eta 6.6 } 
assign (resid 52 and name he2) (resid 63 and name hb1 ) 2.0 1.0 4.0 { w,2.05* }
assign (resid 52 and name he2) (resid 63 and name hb2 ) 2.0 1.0 4.0 { w,2.17* }

assign (resid 52 and name he*) (resid 63 and name ha  ) 2.0 1.0 5.0 { w,3.83*}

{ R53 HN 8.41 }

assign (resid 53 and name hn ) (resid 53 and name ha ) 2.0 1.0 1.0 { s,3.72 }
assign (resid 53 and name hn ) (resid 52 and name hn ) 2.0 1.0 2.0 { m,7.07 }
assign (resid 53 and name hn ) (resid 52 and name hd*) 2.0 1.0 5.0 { w,6.71 }
assign (resid 53 and name hn ) (resid 55 and name hn ) 2.0 1.0 3.0 { w,7.79 }

{ E54 HN 8.10??}



{ L55 HN 7.79 }

assign (resid 55 and name hn ) (resid 55 and name hb*) 2.0 1.0 2.0 { m,1.54 }
assign (resid 55 and name hn ) (resid 55 and name hd**) 2.0 1.0 4.0 { m,0.76 }
assign (resid 55 and name hn ) (resid 52 and name hd2) 2.0 1.0 4.0 { w,6.71 }
assign (resid 55 and name hn ) (resid 53 and name ha ) 2.0 1.0 3.0 { w,3.72 }
assign (resid 55 and name hn ) (resid 56 and name hn ) 2.0 1.0 2.0 { m,8.05 }

{ A56 HN 8.05 }

assign (resid 56 and name hn ) (resid 56 and name hb*) 2.0 1.0 2.0 { m,1.25 }
assign (resid 56 and name hn ) (resid 52 and name ha ) 2.0 1.0 3.0 { w,3.75 }

assign (resid 56 and name hn ) (resid 52 and name he*) 2.0 1.0 5.0 { w,6.61 }

{ K57 HN 8.15 }
{ A58 HN 7.86 }

{ V59 HN 7.39 }

assign (resid 59 and name hn ) (resid 59 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 59 and name hn ) (resid 58 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 59 and name hn ) (resid 58 and name hb*) 2.0 1.0 2.0 { m }
assign (resid 59 and name hn ) (resid 59 and name hb*) 2.0 1.0 2.0 { m }

assign (resid 59 and name hn ) (resid 58 and name hn ) 2.0 1.0 2.0 { m }
assign (resid 59 and name hn ) (resid 60 and name hn ) 2.0 1.0 1.0 { s,7.92 }
assign (resid 59 and name hn ) (resid 56 and name ha ) 2.0 1.0 2.0 { m,3.87 }

{ V59.5 HN 7.34 }
assign (resid 59 and name hn ) (resid 56 and name ha ) 2.0 1.0 2.0 { m,3.87 }
assign (resid 59 and name hn ) (resid 59 and name hb ) 2.0 1.0 3.0 { m,2.52 }
assign (resid 59 and name hn ) (resid 59 and name hg**) 2.0 1.0 4.0 { w,0.87 }
assign (resid 59 and name hn ) (resid 59 and name hg**) 2.0 1.0 4.0 { w,0.94 }

assign (resid 59 and name hn ) (resid 58 and name ha ) 2.0 1.0 3.0 { w,4.20 }
assign (resid 59 and name hn ) (resid 58 and name hb*) 2.0 1.0 4.0 { w,1.63 }

{ N60 HN 7.92 }

assign (resid 60 and name hn ) (resid 57 and name ha  ) 2.0 1.0 3.0 { w,4.12 }
assign (resid 60 and name hn ) (resid 60 and name ha  ) 2.0 1.0 1.0 { s,4.31 }
assign (resid 60 and name hn ) (resid 60 and name hb1 ) 2.0 1.0 3.0 { w,2.5 }
assign (resid 60 and name hn ) (resid 60 and name hb2 ) 2.0 1.0 3.0 { w,3.19 }

assign (resid 60 and name hn ) (resid 59 and name hg2* ) 2.0 1.0 4.0 { w,0.77}

{ R61 HN 7.82 }
{ D62 HN 8.36 }

{ E63 HN 8.97 }

assign (resid 63 and name hn ) (resid 63 and name ha ) 2.0 1.0 1.0 { s }
assign (resid 63 and name hn ) (resid 64 and name ha ) 2.0 1.0 3.0 { w }
assign (resid 63 and name hn ) (resid 64 and name hn ) 2.0 1.0 2.0 { m }

{ E63.5 HN 9.07 }
assign (resid 63 and name hn ) (resid 64 and name hn ) 2.0 1.0 2.0 { m,8.64 }
assign (resid 63 and name hn ) (resid 63 and name hb*) 2.0 1.0 2.0 { m,2.17}
assign (resid 63 and name hn ) (resid 63 and name hg*) 2.0 1.0 2.0 { m,2.3 }
assign (resid 63 and name hn ) (resid 62 and name ha ) 2.0 1.0 1.0 { s,4.46 }
assign (resid 63 and name hn ) (resid 62 and name hb*) 2.0 1.0 2.0 { m,2.74 }


{ E64 HN 8.53 }

assign (resid 64 and name hn ) (resid 64 and name ha ) 2.0 1.0 1.0 { s }
assign (resid 64 and name hn ) (resid 63 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 64 and name hn ) (resid 64 and name hb*) 2.0 1.0 2.0 { m }

assign (resid 64 and name hn ) (resid 59 and name hg**) 2.0 1.0 3.0 { m }
assign (resid 64 and name hn ) (resid 59 and name hb ) 2.0 1.0 2.0 { m }

assign (resid 64 and name hn ) (resid 62 and name ha ) 2.0 1.0 1.0 { s,4.46 }
assign (resid 64 and name hn ) (resid 62 and name hb*) 2.0 1.0 2.0 { m,2.74 }

{ F65 HN      }
{ F66 HN 8.24, zeta 6.24}

assign (resid 66 and name hn ) (resid 66 and name hd*) 2.0 1.0 5.0 { w, }
assign (resid 66 and name hn ) (resid 66 and name he*) 2.0 1.0 5.0 { w}

assign (resid 66 and name hz ) (resid 67 and name ha ) 2.0 1.0 2.0 { m,3.5}
assign (resid 66 and name hz ) (resid 69 and name ha ) 2.0 1.0 4.0 { m,4.11}
assign (resid 66 and name hz ) (resid 69 and name hb1) 2.0 1.0 2.0 { m,3.3}
assign (resid 66 and name hz ) (resid 69 and name hb2) 2.0 1.0 2.0 { m,2.86}
assign (resid 66 and name hz ) (resid 70 and name ha ) 2.0 1.0 2.0 { m,3.77}


{ A67 HN 8.81/8.89}

assign (resid 67 and name hn ) (resid 67 and name ha ) 2.0 1.0 1.0 { s,3.49 }
assign (resid 67 and name hn ) (resid 67 and name hb*) 2.0 1.0 1.0 { s,1.22 }

assign (resid 67 and name hn ) (resid 66 and name hn ) 2.0 1.0 2.0 { s,8.24 }
assign (resid 67 and name hn ) (resid 68 and name hn ) 2.0 1.0 2.0 { m }

assign (resid 67 and name ha ) (resid 70 and name hn ) 2.0 1.0 2.0 { m,7.77 }
assign (resid 67 and name hn ) (resid 66 and name hn ) 2.0 1.0 2.0 { s,8.24 }

{ K68 HN 8.32 }

assign (resid 68 and name hn ) (resid 69 and name hn  ) 2.0 1.0 2.0 { m,7.57 }

{ Y69 HN 7.57}

assign (resid 69 and name hn ) (resid 70 and name hn  ) 2.0 1.0 2.0 { m,7.77 }
assign (resid 69 and name hn ) (resid 72 and name hn  ) 2.0 1.0 2.0 { m,8.7 }

{ L70 HN  7.73/7/77}

assign (resid 70 and name hn ) (resid 70 and name ha  ) 2.0 1.0 2.0 { m,3.77 }
assign (resid 70 and name hn ) (resid 69 and name hb1 ) 2.0 1.0 2.0 { m,3.25 }
assign (resid 70 and name hn ) (resid 69 and name hb2 ) 2.0 1.0 3.0 { w,2.86 }

assign (resid 70 and name hn ) (resid 67 and name ha ) 2.0 1.0 2.0 { m,3.51 }
assign (resid 70 and name hn ) (resid 69 and name ha ) 2.0 1.0 3.0 { w,4.11 }


{ L71 HN 8.7/8.79 }

assign (resid 71 and name hn ) (resid 71 and name ha ) 2.0 1.0 1.0 { s,3.66 }
assign (resid 71 and name hn ) (resid 70 and name ha ) 2.0 1.0 2.0 { m,3.77 }

assign (resid 71 and name hn ) (resid 71 and name ha ) 2.0 1.0 1.0 { s,3.66 }
assign (resid 71 and name hn ) (resid 70 and name hn ) 2.0 1.0 2.0 { m,7.77 }
assign (resid 71 and name hn ) (resid 72 and name hn ) 2.0 1.0 3.0 { w,7.88 }

assign (resid 71 and name hn ) (resid 73 and name hn ) 2.0 1.0 2.0 { m, }

{ K72 HN }
{ E73 HN 8.48 }

assign (resid 73 and name hn ) (resid 73 and name ha ) 2.0 1.0 1.0 { s,4.07 }

{ T74 HN 7.5 }

assign (resid 74 and name hn ) (resid 74 and name ha ) 2.0 1.0 1.0 { s,4.39 }
assign (resid 74 and name hn ) (resid 74 and name hg2*)2.0 1.0 2.0 { m,1.06 }

assign (resid 74 and name hn ) (resid 73 and name ha ) 2.0 1.0 2.0 { m,4.07 }

assign (resid 74 and name hn ) (resid 73 and name hb1) 2.0 1.0 2.0 { m,1.44 }
assign (resid 74 and name hn ) (resid 73 and name hn ) 2.0 1.0 1.0 { s,8.48 }
assign (resid 74 and name hn ) (resid 76 and name hn ) 2.0 1.0 4.0 { v,8.10 }
assign (resid 74 and name hn ) (resid 72 and name hn ) 2.0 1.0 4.0 { v,7.83 }

{ G75 HN 7.57 }

assign (resid 75 and name hn ) (resid 75 and name ha*) 2.0 1.0 1.0 { s,3.83 }
assign (resid 75 and name hn ) (resid 74 and name ha ) 2.0 1.0 2.0 { m,4.39  }
assign (resid 75 and name hn ) (resid 76 and name ha ) 2.0 1.0 3.0 { w,4.64  }

assign (resid 75 and name hn ) (resid 76 and name hn ) 2.0 1.0 3.0 { w,8.10  }
assign (resid 75 and name hn ) (resid 77 and name hn ) 2.0 1.0 3.0 { w,8.27  }


{ S76 HN 8.10 }

{ A77 HN 8,27 }

assign (resid 77 and name hn ) (resid 88 and name hn ) 2.0 1.0 2.0 { m,8.7 }

assign (resid 81 and name hn ) (resid 80 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 82 and name hn ) (resid 81 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 83 and name hn ) (resid 82 and name ha1) 2.0 1.0 2.0 { m }
assign (resid 84 and name hn ) (resid 83 and name ha1) 2.0 1.0 2.0 { m }
assign (resid 85 and name hn ) (resid 84 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 86 and name hn ) (resid 85 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 87 and name hn ) (resid 86 and name ha ) 2.0 1.0 2.0 { m }


{ ******79-86******}

{ N79 HN 8.58 }

{ L80 HN 8.48}

assign (resid 80 and name hn ) (resid 80 and name ha ) 2.0 1.0 2.0 { m,4.91 }
assign (resid 80 and name hn ) (resid 79 and name ha ) 2.0 1.0 1.0 { s,4.77 }
assign (resid 80 and name ha ) (resid 85 and name ha ) 2.0 1.0 1.0 { s,4.6 }
assign (resid 80 and name ha ) (resid 81 and name hn ) 2.0 1.0 3.0 { w,8.61 }

{ E81 HN 8.61 }

assign (resid 81 and name hn ) (resid 84 and name hn ) 2.0 1.0 2.0 { m,7.88 }
assign (resid 81 and name hn ) (resid 83 and name hn ) 2.0 1.0 2.0 { m }

assign (resid 86 and name hn ) (resid 80 and name ha ) 2.0 1.0 2.0 { m*}
assign (resid 86 and name hn ) (resid 79 and name hn ) 2.0 1.0 2.0 { m* }

{ G82 HN 9.11 }

assign (resid 82 and name hn ) (resid 82 and name ha1) 2.0 1.0 1.0 { s,4.71 }

{ G83 HN 8.73 }

assign (resid 83 and name hn ) (resid 83 and name ha1 ) 2.0 1.0 2.0 { m,4.2 }
assign (resid 83 and name hn ) (resid 83 and name ha2 ) 2.0 1.0 2.0 { m,3.84}
assign (resid 83 and name hn ) (resid 82 and name ha1 ) 2.0 1.0 2.0 { s,4.71 }

{ R84 HN 7.88 }

assign (resid 84 and name hn ) (resid 84 and name hd*) 2.0 1.0 2.0 { m,3.23 }
assign (resid 84 and name hn ) (resid 83 and name ha1) 2.0 1.0 1.0 { s,4.20 }
assign (resid 84 and name hn ) (resid 83 and name ha2) 2.0 1.0 1.0 { s,3.84 }
assign (resid 84 and name hn ) (resid 83 and name hn ) 2.0 1.0 2.0 { m }
assign (resid 84 and name hn ) (resid 85 and name hn ) 2.0 1.0 2.0 { m,7.70 }

{ L85 HN  7.70   hd1* 0.26,hd2* -0.02 }

assign (resid 85 and name hn ) (resid 85 and name hb1 ) 2.0 1.0 2.0 { m,1.10 }
assign (resid 85 and name hn ) (resid 85 and name hb2 ) 2.0 1.0 2.0 { m,0.02 }
assign (resid 85 and name ha ) (resid 85 and name hb* ) 2.0 1.0 2.0 { m,1.1,0.02}

assign (resid 85 and name ha ) (resid 67 and name hb* ) 2.0 1.0 2.0 { m }
assign (resid 85 and name ha ) (resid 67 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 85 and name ha ) (resid 67 and name hn  ) 2.0 1.0 2.0 { m }

assign (resid 85 and name hb2 ) (resid 67 and name hn  ) 2.0 1.0 2.0 { m }
assign (resid 85 and name hb2 ) (resid 67 and name hn  ) 2.0 1.0 2.0 { m }

assign (resid 85 and name hd1* ) (resid 67 and name hb* ) 2.0 1.0 3.0 { m,1.25 }
assign (resid 85 and name hd1* ) (resid 67 and name ha  ) 2.0 1.0 3.0 { m,3.50 }
assign (resid 85 and name hd** ) (resid 67 and name hn  ) 2.0 1.0 4.0 { w,8.80 }

assign (resid 85 and name hd** ) (resid 86 and name hn  ) 2.0 1.0 4.0 { w,8.73 }
assign (resid 85 and name hd** ) (resid 81 and name hn  ) 2.0 1.0 4.0 { w,8.61 }
 
assign (resid 85 and name hd** ) (resid 49 and name hn  ) 2.0 1.0 5.0 { v,9.13 }

{ I86 HN 8.7 }

assign (resid 86 and name hn ) (resid 86 and name ha  ) 2.0 1.0 2.0 { m,4.33 }
assign (resid 86 and name hn ) (resid 85 and name ha  ) 2.0 1.0 1.0 { s,4.6 }
assign (resid 86 and name hn ) (resid 86 and name hb  ) 2.0 1.0 2.0 { m,1.91 }
assign (resid 86 and name hn ) (resid 80 and name ha  ) 2.0 1.0 2.0 { m,4.91 }

{ L87 HN 9.31 }

assign (resid 87 and name hn ) (resid 87 and name ha  ) 2.0 1.0 2.0 { m,4.8}
assign (resid 87 and name hn ) (resid 86 and name ha  ) 2.0 1.0 1.0 { s,4.33 }
assign (resid 87 and name hn ) (resid 86 and name hg2*) 2.0 1.0 1.0 { m,0.67 }

assign (resid 87 and name hn ) (resid 47 and name hb  ) 2.0 1.0 2.0 { w,3.92 }
assign (resid 87 and name hn ) (resid 47 and name hg2*) 2.0 1.0 2.0 { w,1.09 }

{ Q88 HN 8.7 }

assign (resid 88 and name hn ) (resid 87 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 88 and name hn ) (resid 78 and name ha1 ) 2.0 1.0 2.0 { m,4.5* }
assign (resid 88 and name hn ) (resid 78 and name ha2 ) 2.0 1.0 2.0 { m,4,12* }
assign (resid 88 and name hn ) (resid 87 and name hn  ) 2.0 1.0 3.0 { w,9.31 }

{ R89 HN 8.01 }

{ R90 HN 8.41 }

{ I91 HN 7.95 }

assign (resid 91 and name hn ) (resid 90 and name ha ) 2.0 1.0 2.0 { m, }
assign (resid 91 and name hn ) (resid 92 and name hn ) 2.0 1.0 2.0 { m,8.24 }

{ S92 HN 8.24 }
assign (resid 92 and name hn ) (resid 89 and name hn ) 2.0 1.0 3.0 { w,8.01 }

{ E94 HN 8.38 }

assign (resid 94 and name hn ) (resid 94 and name ha  ) 2.0 1.0 1.0 { s }
assign (resid 94 and name hn ) (resid 94 and name hb1 ) 2.0 1.0 2.0 { m }
assign (resid 94 and name hn ) (resid 96 and name hn  ) 2.0 1.0 3.0 { w,7.82 }

assign (resid 94 and name hn ) (resid 93 and name hb* ) 2.0 1.0 2.0 { m }


{ **** anti parallel B strands ****  }

assign (resid 41 and name o )     (resid 48 and name hn)    2.15 0.4 0.2
assign (resid 41 and name c  )    (resid 48 and name  n)    4.35 0.02 0.02
assign (resid 41 and name o  )    (resid 48 and name  n)    3.14 0.02 0.02
assign (resid 41 and name c  )    (resid 48 and name hn)    3.38 0.02 0.02

assign (resid 48 and name o )     (resid 41 and name hn)    2.15 0.4 0.2
assign (resid 48 and name c  )    (resid 41 and name  n)    4.35 0.02 0.02
assign (resid 48 and name o  )    (resid 41 and name  n)    3.14 0.02 0.02
assign (resid 48 and name c  )    (resid 41 and name hn)    3.38 0.02 0.02



assign (resid 43 and name o )     (resid 46 and name hn)    2.15 0.4 0.2
assign (resid 43 and name c  )    (resid 46 and name  n)    4.35 0.02 0.02
assign (resid 43 and name o  )    (resid 46 and name  n)    3.14 0.02 0.02
assign (resid 43 and name c  )    (resid 46 and name hn)    3.38 0.02 0.02

assign (resid 46 and name o )     (resid 43 and name hn)    2.15 0.4 0.2
assign (resid 46 and name c  )    (resid 43 and name  n)    4.35 0.02 0.02
assign (resid 46 and name o  )    (resid 43 and name  n)    3.14 0.02 0.02
assign (resid 46 and name c  )    (resid 43 and name hn)    3.38 0.02 0.02



assign (resid 49 and name o )     (resid 85 and name hn)    2.15 0.4 0.2
assign (resid 49 and name c  )    (resid 85 and name  n)    4.35 0.02 0.02
assign (resid 49 and name o  )    (resid 85 and name  n)    3.14 0.02 0.02
assign (resid 49 and name c  )    (resid 85 and name hn)    3.38 0.02 0.02


assign (resid 87 and name o )     (resid 47 and name hn)    2.15 0.4 0.2
assign (resid 87 and name c  )    (resid 47 and name  n)    4.35 0.02 0.02
assign (resid 87 and name o  )    (resid 47 and name  n)    3.14 0.02 0.02
assign (resid 87 and name c  )    (resid 47 and name hn)    3.38 0.02 0.02

assign (resid 47 and name o )     (resid 87 and name hn)    2.15 0.4 0.2
assign (resid 47 and name c  )    (resid 87 and name  n)    4.35 0.02 0.02
assign (resid 47 and name o  )    (resid 87 and name  n)    3.14 0.02 0.02
assign (resid 47 and name c  )    (resid 87 and name hn)    3.38 0.02 0.02



assign (resid 81 and name o )     (resid 84 and name hn)    2.15 0.4 0.2
assign (resid 81 and name c  )    (resid 84 and name  n)    4.35 0.02 0.02
assign (resid 81 and name o  )    (resid 84 and name  n)    3.14 0.02 0.02
assign (resid 81 and name c  )    (resid 84 and name hn)    3.38 0.02 0.02

assign (resid 84 and name o )     (resid 81 and name hn)    2.15 0.4 0.2
assign (resid 84 and name c  )    (resid 81 and name  n)    4.35 0.02 0.02
assign (resid 84 and name o  )    (resid 81 and name  n)    3.14 0.02 0.02
assign (resid 84 and name c  )    (resid 81 and name hn)    3.38 0.02 0.02



assign (resid 79 and name o )     (resid 86 and name hn)    2.15 0.4 0.2
assign (resid 79 and name c  )    (resid 86 and name  n)    4.35 0.02 0.02
assign (resid 79 and name o  )    (resid 86 and name  n)    3.14 0.02 0.02
assign (resid 79 and name c  )    (resid 86 and name hn)    3.38 0.02 0.02

assign (resid 86 and name o )     (resid 79 and name hn)    2.15 0.4 0.2
assign (resid 86 and name c  )    (resid 79 and name  n)    4.35 0.02 0.02
assign (resid 86 and name o  )    (resid 79 and name  n)    3.14 0.02 0.02
assign (resid 86 and name c  )    (resid 79 and name hn)    3.38 0.02 0.02



assign (resid 77 and name o )     (resid 88 and name hn)    2.15 0.4 0.2
assign (resid 77 and name c  )    (resid 88 and name  n)    4.35 0.02 0.02
assign (resid 77 and name o  )    (resid 88 and name  n)    3.14 0.02 0.02
assign (resid 77 and name c  )    (resid 88 and name hn)    3.38 0.02 0.02

assign (resid 88 and name o )     (resid 77 and name hn)    2.15 0.4 0.2
assign (resid 88 and name c  )    (resid 77 and name  n)    4.35 0.02 0.02
assign (resid 88 and name o  )    (resid 77 and name  n)    3.14 0.02 0.02
assign (resid 88 and name c  )    (resid 77 and name hn)    3.38 0.02 0.02


{ ***** helix 52-60/ 62-68 **** }

assign (resid 52 and name o  )    (resid 56 and name hn)    2.15 0.4 0.2
assign (resid 52 and name c  )    (resid 56 and name  n)    4.35 0.4 0.2
assign (resid 52 and name o  )    (resid 56 and name  n)    3.14 0.4 0.2
assign (resid 52 and name c  )    (resid 56 and name hn)    3.38 0.4 0.2

assign (resid 53 and name o  )    (resid 57 and name hn)    2.15 0.4 0.2
assign (resid 53 and name c  )    (resid 57 and name  n)    4.35 0.4 0.2
assign (resid 53 and name o  )    (resid 57 and name  n)    3.14 0.4 0.2
assign (resid 53 and name c  )    (resid 57 and name hn)    3.38 0.4 0.2

assign (resid 54 and name o  )    (resid 58 and name hn)    2.15 0.4 0.2
assign (resid 54 and name c  )    (resid 58 and name  n)    4.35 0.4 0.2
assign (resid 54 and name o  )    (resid 58 and name  n)    3.14 0.4 0.2
assign (resid 54 and name c  )    (resid 58 and name hn)    3.38 0.4 0.2

assign (resid 55 and name o  )    (resid 59 and name hn)    2.15 0.4 0.2
assign (resid 55 and name c  )    (resid 59 and name  n)    4.35 0.4 0.2
assign (resid 55 and name o  )    (resid 59 and name  n)    3.14 0.4 0.2
assign (resid 55 and name c  )    (resid 59 and name hn)    3.38 0.4 0.2


assign (resid 56 and name o  )    (resid 60 and name hn)    2.15 0.4 0.2
assign (resid 56 and name c  )    (resid 60 and name  n)    4.35 0.4 0.2
assign (resid 56 and name o  )    (resid 60 and name  n)    3.14 0.4 0.2
assign (resid 56 and name c  )    (resid 60 and name hn)    3.38 0.4 0.2

assign (resid 57 and name o  )    (resid 61 and name hn)    2.15 0.4 0.2
assign (resid 57 and name c  )    (resid 61 and name  n)    4.35 0.4 0.2
assign (resid 57 and name o  )    (resid 61 and name  n)    3.14 0.4 0.2
assign (resid 57 and name c  )    (resid 61 and name hn)    3.38 0.4 0.2

assign (resid 58 and name o  )    (resid 62 and name hn)    2.15 0.4 0.2
assign (resid 58 and name c  )    (resid 62 and name  n)    4.35 0.4 0.2
assign (resid 58 and name o  )    (resid 62 and name  n)    3.14 0.4 0.2
assign (resid 58 and name c  )    (resid 62 and name hn)    3.38 0.4 0.2

assign (resid 59 and name o  )    (resid 63 and name hn)    2.15 0.4 0.2
assign (resid 59 and name c  )    (resid 63 and name  n)    4.35 0.4 0.2
assign (resid 59 and name o  )    (resid 63 and name  n)    3.14 0.4 0.2
assign (resid 59 and name c  )    (resid 63 and name hn)    3.38 0.4 0.2

assign (resid 62 and name o  )    (resid 66 and name hn)    2.15 0.4 0.2
assign (resid 62 and name c  )    (resid 66 and name  n)    4.35 0.4 0.2
assign (resid 62 and name o  )    (resid 66 and name  n)    3.14 0.4 0.2
assign (resid 62 and name c  )    (resid 66 and name hn)    3.38 0.4 0.2

assign (resid 63 and name o  )    (resid 67 and name hn)    2.15 0.4 0.2
assign (resid 63 and name c  )    (resid 67 and name  n)    4.35 0.4 0.2
assign (resid 63 and name o  )    (resid 67 and name  n)    3.14 0.4 0.2
assign (resid 63 and name c  )    (resid 67 and name hn)    3.38 0.4 0.2

assign (resid 64 and name o  )    (resid 68 and name hn)    2.15 0.4 0.2
assign (resid 64 and name c  )    (resid 68 and name  n)    4.35 0.4 0.2
assign (resid 64 and name o  )    (resid 68 and name  n)    3.14 0.4 0.2
assign (resid 64 and name c  )    (resid 68 and name hn)    3.38 0.4 0.2

assign (resid 65 and name o  )    (resid 69 and name hn)    2.15 0.4 0.2
assign (resid 65 and name c  )    (resid 69 and name  n)    4.35 0.4 0.2
assign (resid 65 and name o  )    (resid 69 and name  n)    3.14 0.4 0.2
assign (resid 65 and name c  )    (resid 69 and name hn)    3.38 0.4 0.2

assign (resid 66 and name o  )    (resid 70 and name hn)    2.15 0.4 0.2
assign (resid 66 and name c  )    (resid 70 and name  n)    4.35 0.4 0.2
assign (resid 66 and name o  )    (resid 70 and name  n)    3.14 0.4 0.2
assign (resid 66 and name c  )    (resid 70 and name hn)    3.38 0.4 0.2

assign (resid 67 and name o  )    (resid 71 and name hn)    2.15 0.4 0.2
assign (resid 67 and name c  )    (resid 71 and name  n)    4.35 0.4 0.2
assign (resid 67 and name o  )    (resid 71 and name  n)    3.14 0.4 0.2
assign (resid 67 and name c  )    (resid 71 and name hn)    3.38 0.4 0.2

assign (resid 68 and name o  )    (resid 72 and name hn)    2.15 0.4 0.2
assign (resid 68 and name c  )    (resid 72 and name  n)    4.35 0.4 0.2
assign (resid 68 and name o  )    (resid 72 and name  n)    3.14 0.4 0.2
assign (resid 68 and name c  )    (resid 72 and name hn)    3.38 0.4 0.2


 
 




 




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    GLU  39           HN       GLU  39   7.856   1.706   5.487
    2    HA   GLU  39           HA       GLU  39   6.848  -0.694   4.162
    3   1HB   GLU  39          HB2       GLU  39   6.395   0.001   6.962
    4   2HB   GLU  39          HB1       GLU  39   4.898  -0.215   6.067
    5   1HG   GLU  39          HG2       GLU  39   5.792  -2.421   5.288
    6   2HG   GLU  39          HG1       GLU  39   7.126  -2.200   6.420
    7    H    ILE  40           HN       ILE  40   5.213   1.952   5.879
    8    HA   ILE  40           HA       ILE  40   3.915   2.691   3.333
    9    HB   ILE  40           HB       ILE  40   2.985   3.329   6.135
   10   1HG1  ILE  40          HG12      ILE  40   1.312   1.417   4.806
   11   2HG1  ILE  40          HG11      ILE  40   2.967   0.817   4.807
   12   1HG2  ILE  40          HG21      ILE  40   1.663   3.517   3.437
   13   2HG2  ILE  40          HG22      ILE  40   2.080   4.842   4.524
   14   3HG2  ILE  40          HG23      ILE  40   0.811   3.701   4.971
   15   1HD1  ILE  40          HD11      ILE  40   2.545   0.065   6.849
   16   2HD1  ILE  40          HD12      ILE  40   1.059   1.007   6.971
   17   3HD1  ILE  40          HD13      ILE  40   2.607   1.746   7.379
   18    H    LEU  41           HN       LEU  41   4.206   4.704   2.527
   19    HA   LEU  41           HA       LEU  41   5.385   6.774   4.280
   20   1HB   LEU  41          HB2       LEU  41   6.100   6.543   1.376
   21   2HB   LEU  41          HB1       LEU  41   6.954   7.390   2.650
   22    HG   LEU  41           HG       LEU  41   6.793   4.384   2.435
   23   1HD1  LEU  41          HD11      LEU  41   9.207   6.054   1.827
   24   2HD1  LEU  41          HD12      LEU  41   8.035   5.638   0.577
   25   3HD1  LEU  41          HD13      LEU  41   8.900   4.362   1.434
   26   1HD2  LEU  41          HD21      LEU  41   7.343   4.650   4.613
   27   2HD2  LEU  41          HD22      LEU  41   7.962   6.284   4.373
   28   3HD2  LEU  41          HD23      LEU  41   8.953   4.892   3.934
   29    H    ILE  42           HN       ILE  42   4.352   8.756   4.092
   30    HA   ILE  42           HA       ILE  42   2.538   9.023   1.781
   31    HB   ILE  42           HB       ILE  42   1.280   8.610   3.848
   32   1HG1  ILE  42          HG12      ILE  42   0.967  11.486   2.970
   33   2HG1  ILE  42          HG11      ILE  42   0.402  10.109   2.029
   34   1HG2  ILE  42          HG21      ILE  42   1.914  11.230   5.021
   35   2HG2  ILE  42          HG22      ILE  42   3.196  10.024   5.119
   36   3HG2  ILE  42          HG23      ILE  42   1.607   9.678   5.800
   37   1HD1  ILE  42          HD11      ILE  42  -0.586  11.095   4.679
   38   2HD1  ILE  42          HD12      ILE  42  -0.947   9.472   4.090
   39   3HD1  ILE  42          HD13      ILE  42  -1.479  10.882   3.173
   40    H    GLU  43           HN       GLU  43   2.709  10.771   0.610
   41    HA   GLU  43           HA       GLU  43   4.020  13.189   1.675
   42   1HB   GLU  43          HB2       GLU  43   4.679  11.527  -0.712
   43   2HB   GLU  43          HB1       GLU  43   4.718  13.270  -0.938
   44   1HG   GLU  43          HG2       GLU  43   6.266  13.402   1.020
   45   2HG   GLU  43          HG1       GLU  43   6.334  11.641   1.003
   46    H    GLY  44           HN       GLY  44   2.898  15.066   1.092
   47   1HA   GLY  44          HA2       GLY  44   1.195  16.352   0.224
   48   2HA   GLY  44          HA1       GLY  44   1.364  15.371  -1.224
   49    H    ASN  45           HN       ASN  45   0.013  13.511  -1.487
   50    HA   ASN  45           HA       ASN  45  -2.102  13.114   0.486
   51   1HB   ASN  45          HB2       ASN  45  -2.788  13.672  -2.399
   52   2HB   ASN  45          HB1       ASN  45  -3.906  13.447  -1.058
   53   1HD2  ASN  45          HD21      ASN  45  -1.384  15.549  -2.322
   54   2HD2  ASN  45          HD22      ASN  45  -1.952  16.993  -1.563
   55    H    ARG  46           HN       ARG  46   0.061  11.770  -1.655
   56    HA   ARG  46           HA       ARG  46  -1.512   9.286  -1.952
   57   1HB   ARG  46          HB2       ARG  46   0.183   8.796  -3.767
   58   2HB   ARG  46          HB1       ARG  46  -0.893  10.146  -4.096
   59   1HG   ARG  46          HG2       ARG  46   1.702  10.752  -2.801
   60   2HG   ARG  46          HG1       ARG  46   1.720  10.280  -4.502
   61   1HD   ARG  46          HD2       ARG  46  -0.335  12.081  -4.428
   62   2HD   ARG  46          HD1       ARG  46   0.781  12.749  -3.238
   63    HE   ARG  46           HE       ARG  46   2.373  12.200  -5.364
   64   1HH1  ARG  46          HH11      ARG  46  -0.583  14.015  -4.973
   65   2HH1  ARG  46          HH12      ARG  46  -0.220  15.121  -6.254
   66   1HH2  ARG  46          HH21      ARG  46   2.853  13.655  -7.049
   67   2HH2  ARG  46          HH22      ARG  46   1.731  14.918  -7.432
   68    H    THR  47           HN       THR  47  -0.682   7.395  -1.098
   69    HA   THR  47           HA       THR  47   2.007   7.530   0.120
   70    HB   THR  47           HB       THR  47  -0.492   6.196   1.167
   71    HG1  THR  47           HG1      THR  47  -0.693   7.883   2.379
   72   1HG2  THR  47          HG21      THR  47   2.086   5.352   1.638
   73   2HG2  THR  47          HG22      THR  47   0.663   4.998   2.617
   74   3HG2  THR  47          HG23      THR  47   1.701   6.363   3.032
   75    H    ILE  48           HN       ILE  48   3.303   5.814  -0.277
   76    HA   ILE  48           HA       ILE  48   2.238   3.612  -1.941
   77    HB   ILE  48           HB       ILE  48   5.107   4.525  -1.642
   78   1HG1  ILE  48          HG12      ILE  48   4.460   5.188  -4.182
   79   2HG1  ILE  48          HG11      ILE  48   2.911   5.468  -3.392
   80   1HG2  ILE  48          HG21      ILE  48   5.705   2.905  -3.097
   81   2HG2  ILE  48          HG22      ILE  48   4.201   3.020  -4.010
   82   3HG2  ILE  48          HG23      ILE  48   4.244   2.126  -2.490
   83   1HD1  ILE  48          HD11      ILE  48   4.561   7.417  -3.593
   84   2HD1  ILE  48          HD12      ILE  48   5.434   6.625  -2.280
   85   3HD1  ILE  48          HD13      ILE  48   3.767   7.148  -2.042
   86    H    ILE  49           HN       ILE  49   2.502   1.504  -1.224
   87    HA   ILE  49           HA       ILE  49   4.041   1.166   1.265
   88    HB   ILE  49           HB       ILE  49   1.540  -0.334   0.505
   89   1HG1  ILE  49          HG12      ILE  49   1.995   1.688   2.703
   90   2HG1  ILE  49          HG11      ILE  49   1.163   2.029   1.189
   91   1HG2  ILE  49          HG21      ILE  49   3.170  -1.673   1.772
   92   2HG2  ILE  49          HG22      ILE  49   1.701  -1.359   2.694
   93   3HG2  ILE  49          HG23      ILE  49   3.170  -0.445   3.038
   94   1HD1  ILE  49          HD11      ILE  49  -0.614   0.546   1.751
   95   2HD1  ILE  49          HD12      ILE  49  -0.333   1.610   3.130
   96   3HD1  ILE  49          HD13      ILE  49   0.260  -0.050   3.162
   97    H    ARG  50           HN       ARG  50   5.498  -0.365   1.316
   98    HA   ARG  50           HA       ARG  50   6.066  -1.850  -1.103
   99   1HB   ARG  50          HB2       ARG  50   7.847  -0.734   0.290
  100   2HB   ARG  50          HB1       ARG  50   7.535  -1.930   1.540
  101   1HG   ARG  50          HG2       ARG  50   9.040  -3.232   0.572
  102   2HG   ARG  50          HG1       ARG  50   7.938  -3.402  -0.796
  103   1HD   ARG  50          HD2       ARG  50  10.189  -1.438  -0.449
  104   2HD   ARG  50          HD1       ARG  50  10.006  -2.677  -1.690
  105    HE   ARG  50           HE       ARG  50   7.850  -1.083  -2.072
  106   1HH1  ARG  50          HH11      ARG  50  11.278  -0.467  -1.844
  107   2HH1  ARG  50          HH12      ARG  50  11.228   0.907  -2.896
  108   1HH2  ARG  50          HH21      ARG  50   7.782   0.724  -3.456
  109   2HH2  ARG  50          HH22      ARG  50   9.243   1.585  -3.811
  110    H    ASN  51           HN       ASN  51   3.779  -2.815  -0.516
  111    HA   ASN  51           HA       ASN  51   3.950  -4.998   1.362
  112   1HB   ASN  51          HB2       ASN  51   1.896  -3.458   0.876
  113   2HB   ASN  51          HB1       ASN  51   1.614  -4.580  -0.452
  114   1HD2  ASN  51          HD21      ASN  51   2.479  -4.718   2.991
  115   2HD2  ASN  51          HD22      ASN  51   1.374  -5.984   3.390
  116    H    PHE  52           HN       PHE  52   5.567  -4.969  -1.109
  117    HA   PHE  52           HA       PHE  52   4.726  -6.534  -3.115
  118   1HB   PHE  52          HB2       PHE  52   7.057  -5.581  -2.856
  119   2HB   PHE  52          HB1       PHE  52   7.446  -7.042  -1.947
  120    HD1  PHE  52           HD1      PHE  52   9.184  -7.191  -3.898
  121    HD2  PHE  52           HD2      PHE  52   4.986  -7.711  -4.407
  122    HE1  PHE  52           HE1      PHE  52   9.579  -8.403  -6.005
  123    HE2  PHE  52           HE2      PHE  52   5.362  -8.915  -6.502
  124    HZ   PHE  52           HZ       PHE  52   7.674  -9.268  -7.309
  125    H    ARG  53           HN       ARG  53   5.847  -7.948   0.019
  126    HA   ARG  53           HA       ARG  53   5.905 -10.599  -0.687
  127   1HB   ARG  53          HB2       ARG  53   5.703  -9.178   1.726
  128   2HB   ARG  53          HB1       ARG  53   4.390 -10.347   1.767
  129   1HG   ARG  53          HG2       ARG  53   5.785 -12.116   1.920
  130   2HG   ARG  53          HG1       ARG  53   7.025 -11.366   0.914
  131   1HD   ARG  53          HD2       ARG  53   6.523 -10.122   3.548
  132   2HD   ARG  53          HD1       ARG  53   7.284 -11.712   3.561
  133    HE   ARG  53           HE       ARG  53   8.512  -9.852   1.744
  134   1HH1  ARG  53          HH11      ARG  53   8.434 -11.012   5.035
  135   2HH1  ARG  53          HH12      ARG  53  10.051 -10.503   5.384
  136   1HH2  ARG  53          HH21      ARG  53  10.639  -9.181   2.203
  137   2HH2  ARG  53          HH22      ARG  53  11.303  -9.463   3.777
  138    H    GLU  54           HN       GLU  54   2.995  -9.294   0.847
  139    HA   GLU  54           HA       GLU  54   1.190 -11.229   0.064
  140   1HB   GLU  54          HB2       GLU  54   1.006  -8.402   0.933
  141   2HB   GLU  54          HB1       GLU  54  -0.391  -9.020   0.063
  142   1HG   GLU  54          HG2       GLU  54  -1.111  -9.855   1.979
  143   2HG   GLU  54          HG1       GLU  54   0.224 -11.004   1.909
  144    H    LEU  55           HN       LEU  55   2.122  -8.235  -1.522
  145    HA   LEU  55           HA       LEU  55   0.473  -8.198  -3.695
  146   1HB   LEU  55          HB2       LEU  55   2.953  -7.002  -2.937
  147   2HB   LEU  55          HB1       LEU  55   3.044  -7.456  -4.625
  148    HG   LEU  55           HG       LEU  55   2.235  -5.085  -4.015
  149   1HD1  LEU  55          HD11      LEU  55   0.215  -6.195  -5.807
  150   2HD1  LEU  55          HD12      LEU  55   1.866  -6.683  -6.190
  151   3HD1  LEU  55          HD13      LEU  55   1.450  -4.971  -6.100
  152   1HD2  LEU  55          HD21      LEU  55  -0.122  -4.835  -3.589
  153   2HD2  LEU  55          HD22      LEU  55   0.597  -5.819  -2.315
  154   3HD2  LEU  55          HD23      LEU  55  -0.349  -6.581  -3.593
  155    H    ALA  56           HN       ALA  56   3.581  -9.987  -3.504
  156    HA   ALA  56           HA       ALA  56   3.665 -10.975  -6.079
  157   1HB   ALA  56          HB1       ALA  56   4.493 -12.416  -3.557
  158   2HB   ALA  56          HB2       ALA  56   5.482 -11.261  -4.453
  159   3HB   ALA  56          HB3       ALA  56   5.027 -12.796  -5.195
  160    H    LYS  57           HN       LYS  57   2.208 -12.480  -3.186
  161    HA   LYS  57           HA       LYS  57   1.049 -14.684  -4.507
  162   1HB   LYS  57          HB2       LYS  57   0.311 -13.139  -2.035
  163   2HB   LYS  57          HB1       LYS  57  -0.769 -14.389  -2.636
  164   1HG   LYS  57          HG2       LYS  57   0.577 -16.060  -1.967
  165   2HG   LYS  57          HG1       LYS  57   2.050 -15.182  -2.380
  166   1HD   LYS  57          HD2       LYS  57   1.966 -13.928  -0.359
  167   2HD   LYS  57          HD1       LYS  57   0.337 -14.503   0.003
  168   1HE   LYS  57          HE2       LYS  57   1.959 -15.663   1.381
  169   2HE   LYS  57          HE1       LYS  57   1.212 -16.785   0.244
  170   1HZ   LYS  57          HZ1       LYS  57   3.638 -17.057   0.439
  171   2HZ   LYS  57          HZ2       LYS  57   3.853 -15.492  -0.166
  172   3HZ   LYS  57          HZ3       LYS  57   3.149 -16.684  -1.138
  173    H    ALA  58           HN       ALA  58  -0.188 -11.479  -3.819
  174    HA   ALA  58           HA       ALA  58  -2.684 -11.570  -4.942
  175   1HB   ALA  58          HB1       ALA  58  -1.465  -9.675  -3.674
  176   2HB   ALA  58          HB2       ALA  58  -2.680  -9.257  -4.882
  177   3HB   ALA  58          HB3       ALA  58  -0.965  -9.147  -5.281
  178    H    VAL  59           HN       VAL  59   0.378 -10.756  -6.637
  179    HA   VAL  59           HA       VAL  59  -0.716 -10.133  -9.049
  180    HB   VAL  59           HB       VAL  59   1.278  -9.900  -9.848
  181   1HG1  VAL  59          HG11      VAL  59   3.272 -10.503  -8.290
  182   2HG1  VAL  59          HG12      VAL  59   2.015 -10.886  -7.123
  183   3HG1  VAL  59          HG13      VAL  59   2.123  -9.264  -7.793
  184   1HG2  VAL  59          HG21      VAL  59   1.845 -12.800  -9.219
  185   2HG2  VAL  59          HG22      VAL  59   2.904 -11.747 -10.156
  186   3HG2  VAL  59          HG23      VAL  59   1.291 -12.133 -10.755
  187    H    ASN  60           HN       ASN  60   0.232 -13.372  -7.969
  188    HA   ASN  60           HA       ASN  60  -0.513 -14.789 -10.230
  189   1HB   ASN  60          HB2       ASN  60  -0.838 -15.498  -7.306
  190   2HB   ASN  60          HB1       ASN  60  -1.143 -16.639  -8.612
  191   1HD2  ASN  60          HD21      ASN  60   0.487 -18.014  -7.950
  192   2HD2  ASN  60          HD22      ASN  60   2.160 -17.633  -8.149
  193    H    ARG  61           HN       ARG  61  -2.484 -13.299  -7.736
  194    HA   ARG  61           HA       ARG  61  -4.918 -14.144  -9.193
  195   1HB   ARG  61          HB2       ARG  61  -4.352 -14.381  -6.518
  196   2HB   ARG  61          HB1       ARG  61  -5.293 -12.896  -6.563
  197   1HG   ARG  61          HG2       ARG  61  -7.184 -13.972  -7.381
  198   2HG   ARG  61          HG1       ARG  61  -6.264 -15.371  -7.938
  199   1HD   ARG  61          HD2       ARG  61  -5.730 -15.796  -5.489
  200   2HD   ARG  61          HD1       ARG  61  -6.980 -14.610  -5.119
  201    HE   ARG  61           HE       ARG  61  -7.360 -17.302  -6.069
  202   1HH1  ARG  61          HH11      ARG  61  -8.781 -14.126  -5.785
  203   2HH1  ARG  61          HH12      ARG  61 -10.408 -14.708  -5.895
  204   1HH2  ARG  61          HH21      ARG  61  -9.499 -18.068  -6.216
  205   2HH2  ARG  61          HH22      ARG  61 -10.816 -16.946  -6.139
  206    H    ASP  62           HN       ASP  62  -3.119 -11.855  -9.855
  207    HA   ASP  62           HA       ASP  62  -3.495  -9.803 -10.876
  208   1HB   ASP  62          HB2       ASP  62  -6.116  -9.523  -9.411
  209   2HB   ASP  62          HB1       ASP  62  -5.606  -8.756 -10.912
  210    H    GLU  63           HN       GLU  63  -1.727  -9.448  -9.511
  211    HA   GLU  63           HA       GLU  63  -1.817  -8.375  -6.901
  212   1HB   GLU  63          HB2       GLU  63   0.336  -7.254  -7.467
  213   2HB   GLU  63          HB1       GLU  63   0.331  -8.963  -7.812
  214   1HG   GLU  63          HG2       GLU  63  -0.027  -8.489 -10.183
  215   2HG   GLU  63          HG1       GLU  63  -0.042  -6.764  -9.825
  216    H    GLU  64           HN       GLU  64  -1.934  -7.037 -10.093
  217    HA   GLU  64           HA       GLU  64  -1.973  -4.316  -9.534
  218   1HB   GLU  64          HB2       GLU  64  -3.383  -5.929 -11.651
  219   2HB   GLU  64          HB1       GLU  64  -3.509  -4.178 -11.605
  220   1HG   GLU  64          HG2       GLU  64  -1.011  -5.811 -11.963
  221   2HG   GLU  64          HG1       GLU  64  -1.809  -4.801 -13.167
  222    H    PHE  65           HN       PHE  65  -4.713  -6.485  -9.858
  223    HA   PHE  65           HA       PHE  65  -6.782  -4.823  -9.160
  224   1HB   PHE  65          HB2       PHE  65  -6.512  -7.504  -9.720
  225   2HB   PHE  65          HB1       PHE  65  -7.053  -7.517  -8.046
  226    HD1  PHE  65           HD1      PHE  65  -9.306  -7.846  -7.833
  227    HD2  PHE  65           HD2      PHE  65  -7.872  -5.530 -11.102
  228    HE1  PHE  65           HE1      PHE  65 -11.620  -7.481  -8.584
  229    HE2  PHE  65           HE2      PHE  65 -10.184  -5.159 -11.858
  230    HZ   PHE  65           HZ       PHE  65 -12.062  -6.135 -10.598
  231    H    PHE  66           HN       PHE  66  -4.760  -6.829  -6.950
  232    HA   PHE  66           HA       PHE  66  -6.160  -6.236  -4.670
  233   1HB   PHE  66          HB2       PHE  66  -4.443  -7.798  -4.250
  234   2HB   PHE  66          HB1       PHE  66  -3.179  -6.675  -4.822
  235    HD1  PHE  66           HD1      PHE  66  -2.244  -5.090  -3.348
  236    HD2  PHE  66           HD2      PHE  66  -5.905  -7.018  -2.371
  237    HE1  PHE  66           HE1      PHE  66  -2.404  -3.759  -1.292
  238    HE2  PHE  66           HE2      PHE  66  -6.046  -5.724  -0.294
  239    HZ   PHE  66           HZ       PHE  66  -4.332  -4.053   0.196
  240    H    ALA  67           HN       ALA  67  -3.137  -4.343  -5.560
  241    HA   ALA  67           HA       ALA  67  -3.294  -2.526  -3.567
  242   1HB   ALA  67          HB1       ALA  67  -2.029  -2.579  -6.078
  243   2HB   ALA  67          HB2       ALA  67  -1.732  -1.450  -4.756
  244   3HB   ALA  67          HB3       ALA  67  -2.891  -1.042  -6.020
  245    H    LYS  68           HN       LYS  68  -5.232  -2.509  -6.572
  246    HA   LYS  68           HA       LYS  68  -6.731  -0.220  -6.194
  247   1HB   LYS  68          HB2       LYS  68  -6.937  -2.149  -7.977
  248   2HB   LYS  68          HB1       LYS  68  -8.158  -2.771  -6.875
  249   1HG   LYS  68          HG2       LYS  68  -9.457  -1.525  -8.273
  250   2HG   LYS  68          HG1       LYS  68  -9.094  -0.328  -7.029
  251   1HD   LYS  68          HD2       LYS  68  -8.492   0.947  -8.787
  252   2HD   LYS  68          HD1       LYS  68  -6.989   0.028  -8.688
  253   1HE   LYS  68          HE2       LYS  68  -9.353  -0.652 -10.435
  254   2HE   LYS  68          HE1       LYS  68  -7.866   0.124 -10.981
  255   1HZ   LYS  68          HZ1       LYS  68  -6.630  -1.817 -10.510
  256   2HZ   LYS  68          HZ2       LYS  68  -8.001  -2.331 -11.356
  257   3HZ   LYS  68          HZ3       LYS  68  -7.916  -2.540  -9.680
  258    H    TYR  69           HN       TYR  69  -7.248  -3.393  -4.707
  259    HA   TYR  69           HA       TYR  69  -9.449  -3.091  -3.159
  260   1HB   TYR  69          HB2       TYR  69  -6.955  -4.670  -2.817
  261   2HB   TYR  69          HB1       TYR  69  -8.019  -4.525  -1.430
  262    HD1  TYR  69           HD1      TYR  69  -9.877  -5.926  -1.225
  263    HD2  TYR  69           HD2      TYR  69  -7.989  -5.524  -5.016
  264    HE1  TYR  69           HE1      TYR  69 -11.285  -7.737  -2.112
  265    HE2  TYR  69           HE2      TYR  69  -9.392  -7.333  -5.913
  266    HH   TYR  69           HH       TYR  69 -11.960  -8.281  -5.032
  267    H    LEU  70           HN       LEU  70  -6.130  -2.320  -2.139
  268    HA   LEU  70           HA       LEU  70  -6.640  -1.349   0.376
  269   1HB   LEU  70          HB2       LEU  70  -4.462  -1.290  -1.277
  270   2HB   LEU  70          HB1       LEU  70  -4.866   0.415  -1.175
  271    HG   LEU  70           HG       LEU  70  -3.246  -0.065   0.523
  272   1HD1  LEU  70          HD11      LEU  70  -5.653   1.124   1.025
  273   2HD1  LEU  70          HD12      LEU  70  -4.264   1.135   2.112
  274   3HD1  LEU  70          HD13      LEU  70  -5.543  -0.059   2.329
  275   1HD2  LEU  70          HD21      LEU  70  -5.007  -2.408   1.060
  276   2HD2  LEU  70          HD22      LEU  70  -4.066  -1.721   2.383
  277   3HD2  LEU  70          HD23      LEU  70  -3.250  -2.323   0.942
  278    H    LEU  71           HN       LEU  71  -6.936   0.338  -2.691
  279    HA   LEU  71           HA       LEU  71  -7.926   2.779  -1.674
  280   1HB   LEU  71          HB2       LEU  71  -7.575   3.303  -3.809
  281   2HB   LEU  71          HB1       LEU  71  -7.419   1.613  -4.240
  282    HG   LEU  71           HG       LEU  71  -9.932   1.537  -4.466
  283   1HD1  LEU  71          HD11      LEU  71 -11.241   3.346  -4.184
  284   2HD1  LEU  71          HD12      LEU  71 -10.021   4.459  -4.802
  285   3HD1  LEU  71          HD13      LEU  71  -9.927   3.883  -3.138
  286   1HD2  LEU  71          HD21      LEU  71  -9.033   3.601  -6.372
  287   2HD2  LEU  71          HD22      LEU  71  -9.750   2.016  -6.664
  288   3HD2  LEU  71          HD23      LEU  71  -8.037   2.149  -6.267
  289    H    LYS  72           HN       LYS  72  -9.520  -0.138  -2.979
  290    HA   LYS  72           HA       LYS  72 -12.165   0.627  -2.778
  291   1HB   LYS  72          HB2       LYS  72 -10.946  -2.067  -2.135
  292   2HB   LYS  72          HB1       LYS  72 -12.665  -1.784  -2.361
  293   1HG   LYS  72          HG2       LYS  72 -11.809  -0.764  -4.655
  294   2HG   LYS  72          HG1       LYS  72 -10.478  -1.883  -4.354
  295   1HD   LYS  72          HD2       LYS  72 -11.726  -3.618  -4.974
  296   2HD   LYS  72          HD1       LYS  72 -12.991  -3.175  -3.826
  297   1HE   LYS  72          HE2       LYS  72 -12.654  -1.952  -6.562
  298   2HE   LYS  72          HE1       LYS  72 -13.765  -3.269  -6.186
  299   1HZ   LYS  72          HZ1       LYS  72 -13.846  -0.642  -4.814
  300   2HZ   LYS  72          HZ2       LYS  72 -15.010  -1.869  -4.767
  301   3HZ   LYS  72          HZ3       LYS  72 -14.763  -0.993  -6.193
  302    H    GLU  73           HN       GLU  73 -10.082  -0.735  -0.268
  303    HA   GLU  73           HA       GLU  73 -11.949  -0.798   1.816
  304   1HB   GLU  73          HB2       GLU  73  -8.981  -0.742   1.633
  305   2HB   GLU  73          HB1       GLU  73  -9.698  -0.368   3.195
  306   1HG   GLU  73          HG2       GLU  73 -11.069  -2.609   2.475
  307   2HG   GLU  73          HG1       GLU  73  -9.475  -2.916   1.785
  308    H    THR  74           HN       THR  74  -9.618   1.757   0.950
  309    HA   THR  74           HA       THR  74 -10.515   3.551   2.974
  310    HB   THR  74           HB       THR  74  -8.930   4.109   0.460
  311    HG1  THR  74           HG1      THR  74  -7.883   2.643   1.823
  312   1HG2  THR  74          HG21      THR  74  -9.378   5.757   2.926
  313   2HG2  THR  74          HG22      THR  74  -9.659   6.204   1.244
  314   3HG2  THR  74          HG23      THR  74  -8.011   6.003   1.840
  315    H    GLY  75           HN       GLY  75 -10.652   4.049  -0.565
  316   1HA   GLY  75          HA2       GLY  75 -13.032   4.282  -1.426
  317   2HA   GLY  75          HA1       GLY  75 -13.212   5.454  -0.132
  318    H    SER  76           HN       SER  76 -10.660   6.710  -0.408
  319    HA   SER  76           HA       SER  76 -11.248   8.703  -2.239
  320   1HB   SER  76          HB2       SER  76  -9.690   9.297  -0.601
  321   2HB   SER  76          HB1       SER  76  -8.696   7.870  -0.890
  322    HG   SER  76           HG       SER  76  -7.564   9.178  -2.081
  323    H    ALA  77           HN       ALA  77  -8.102   7.351  -2.900
  324    HA   ALA  77           HA       ALA  77  -9.007   6.237  -5.452
  325   1HB   ALA  77          HB1       ALA  77  -8.534   8.298  -6.344
  326   2HB   ALA  77          HB2       ALA  77  -6.945   7.542  -6.455
  327   3HB   ALA  77          HB3       ALA  77  -7.300   8.659  -5.138
  328    H    GLY  78           HN       GLY  78  -7.408   4.783  -6.417
  329   1HA   GLY  78          HA2       GLY  78  -5.222   4.131  -4.541
  330   2HA   GLY  78          HA1       GLY  78  -6.253   2.876  -5.182
  331    H    ASN  79           HN       ASN  79  -3.455   2.995  -5.333
  332    HA   ASN  79           HA       ASN  79  -3.050   3.057  -8.250
  333   1HB   ASN  79          HB2       ASN  79  -1.814   4.701  -6.303
  334   2HB   ASN  79          HB1       ASN  79  -0.606   3.508  -6.766
  335   1HD2  ASN  79          HD21      ASN  79  -3.179   5.028  -8.658
  336   2HD2  ASN  79          HD22      ASN  79  -2.132   5.737  -9.836
  337    H    LEU  80           HN       LEU  80  -2.026   1.245  -9.037
  338    HA   LEU  80           HA       LEU  80  -0.975  -0.716  -7.063
  339   1HB   LEU  80          HB2       LEU  80  -1.754  -2.305  -9.092
  340   2HB   LEU  80          HB1       LEU  80  -2.807  -1.899  -7.756
  341    HG   LEU  80           HG       LEU  80  -2.900  -0.060 -10.069
  342   1HD1  LEU  80          HD11      LEU  80  -2.759  -2.526 -10.893
  343   2HD1  LEU  80          HD12      LEU  80  -3.978  -1.436 -11.552
  344   3HD1  LEU  80          HD13      LEU  80  -4.421  -2.608 -10.311
  345   1HD2  LEU  80          HD21      LEU  80  -5.268  -1.336  -8.819
  346   2HD2  LEU  80          HD22      LEU  80  -5.026   0.327  -9.355
  347   3HD2  LEU  80          HD23      LEU  80  -4.318  -0.221  -7.836
  348    H    GLU  81           HN       GLU  81   0.995  -1.571  -7.557
  349    HA   GLU  81           HA       GLU  81   2.112  -1.083 -10.255
  350   1HB   GLU  81          HB2       GLU  81   2.966  -0.013  -7.731
  351   2HB   GLU  81          HB1       GLU  81   4.188  -1.145  -8.293
  352   1HG   GLU  81          HG2       GLU  81   3.147   0.840 -10.232
  353   2HG   GLU  81          HG1       GLU  81   4.219   1.412  -8.954
  354    H    GLY  82           HN       GLY  82   3.211  -2.915 -11.065
  355   1HA   GLY  82          HA2       GLY  82   2.674  -5.423  -9.963
  356   2HA   GLY  82          HA1       GLY  82   3.911  -5.101 -11.157
  357    H    GLY  83           HN       GLY  83   3.366  -4.855  -7.581
  358   1HA   GLY  83          HA2       GLY  83   5.182  -6.472  -6.605
  359   2HA   GLY  83          HA1       GLY  83   6.262  -5.233  -7.173
  360    H    ARG  84           HN       ARG  84   4.061  -3.380  -6.380
  361    HA   ARG  84           HA       ARG  84   4.301  -3.261  -3.478
  362   1HB   ARG  84          HB2       ARG  84   4.615  -0.760  -3.859
  363   2HB   ARG  84          HB1       ARG  84   5.984  -1.751  -4.341
  364   1HG   ARG  84          HG2       ARG  84   5.193  -1.636  -6.678
  365   2HG   ARG  84          HG1       ARG  84   3.907  -0.548  -6.154
  366   1HD   ARG  84          HD2       ARG  84   6.452   0.367  -5.176
  367   2HD   ARG  84          HD1       ARG  84   6.519   0.125  -6.921
  368    HE   ARG  84           HE       ARG  84   4.215   1.595  -5.989
  369   1HH1  ARG  84          HH11      ARG  84   7.510   1.798  -7.130
  370   2HH1  ARG  84          HH12      ARG  84   7.357   3.440  -7.655
  371   1HH2  ARG  84          HH21      ARG  84   4.016   3.755  -6.681
  372   2HH2  ARG  84          HH22      ARG  84   5.376   4.551  -7.400
  373    H    LEU  85           HN       LEU  85   2.523  -2.400  -2.551
  374    HA   LEU  85           HA       LEU  85   0.132  -1.863  -4.307
  375   1HB   LEU  85          HB2       LEU  85  -1.092  -2.981  -2.758
  376   2HB   LEU  85          HB1       LEU  85   0.440  -3.621  -2.200
  377    HG   LEU  85           HG       LEU  85   0.462  -1.552  -0.623
  378   1HD1  LEU  85          HD11      LEU  85  -1.678  -0.744  -1.930
  379   2HD1  LEU  85          HD12      LEU  85  -1.475  -0.430  -0.207
  380   3HD1  LEU  85          HD13      LEU  85  -2.496  -1.763  -0.747
  381   1HD2  LEU  85          HD21      LEU  85  -0.321  -4.187  -0.331
  382   2HD2  LEU  85          HD22      LEU  85  -1.637  -3.269   0.399
  383   3HD2  LEU  85          HD23      LEU  85   0.015  -3.042   0.966
  384    H    ILE  86           HN       ILE  86  -0.761   0.190  -4.145
  385    HA   ILE  86           HA       ILE  86   0.369   2.026  -2.118
  386    HB   ILE  86           HB       ILE  86  -0.394   2.633  -4.983
  387   1HG1  ILE  86          HG12      ILE  86   2.247   3.262  -4.751
  388   2HG1  ILE  86          HG11      ILE  86   2.138   1.864  -3.685
  389   1HG2  ILE  86          HG21      ILE  86  -0.612   4.420  -3.063
  390   2HG2  ILE  86          HG22      ILE  86   0.047   4.846  -4.641
  391   3HG2  ILE  86          HG23      ILE  86   1.133   4.536  -3.287
  392   1HD1  ILE  86          HD11      ILE  86   0.739   1.259  -6.074
  393   2HD1  ILE  86          HD12      ILE  86   2.212   0.527  -5.438
  394   3HD1  ILE  86          HD13      ILE  86   2.313   1.928  -6.504
  395    H    LEU  87           HN       LEU  87  -1.066   3.303  -1.047
  396    HA   LEU  87           HA       LEU  87  -3.886   3.215  -1.920
  397   1HB   LEU  87          HB2       LEU  87  -3.644   1.937   0.118
  398   2HB   LEU  87          HB1       LEU  87  -2.698   3.210   0.861
  399    HG   LEU  87           HG       LEU  87  -5.125   2.951   1.616
  400   1HD1  LEU  87          HD11      LEU  87  -4.688   5.724   0.652
  401   2HD1  LEU  87          HD12      LEU  87  -3.498   5.017   1.745
  402   3HD1  LEU  87          HD13      LEU  87  -5.186   5.140   2.240
  403   1HD2  LEU  87          HD21      LEU  87  -5.677   3.028  -1.054
  404   2HD2  LEU  87          HD22      LEU  87  -6.021   4.686  -0.561
  405   3HD2  LEU  87          HD23      LEU  87  -6.841   3.342   0.233
  406    H    GLN  88           HN       GLN  88  -4.856   5.166  -2.111
  407    HA   GLN  88           HA       GLN  88  -3.283   7.519  -1.288
  408   1HB   GLN  88          HB2       GLN  88  -3.986   6.930  -3.832
  409   2HB   GLN  88          HB1       GLN  88  -5.379   7.882  -3.339
  410   1HG   GLN  88          HG2       GLN  88  -3.537   9.539  -2.476
  411   2HG   GLN  88          HG1       GLN  88  -2.539   8.697  -3.661
  412   1HE2  GLN  88          HE21      GLN  88  -2.388   9.903  -5.408
  413   2HE2  GLN  88          HE22      GLN  88  -3.685  10.736  -6.187
  414    H    ARG  89           HN       ARG  89  -4.073   8.134   0.586
  415    HA   ARG  89           HA       ARG  89  -6.655   7.758   1.547
  416   1HB   ARG  89          HB2       ARG  89  -4.298   9.275   2.332
  417   2HB   ARG  89          HB1       ARG  89  -5.788  10.087   2.791
  418   1HG   ARG  89          HG2       ARG  89  -5.640   8.811   4.623
  419   2HG   ARG  89          HG1       ARG  89  -6.326   7.558   3.587
  420   1HD   ARG  89          HD2       ARG  89  -4.450   6.351   3.645
  421   2HD   ARG  89          HD1       ARG  89  -3.443   7.759   3.309
  422    HE   ARG  89           HE       ARG  89  -3.900   6.553   5.845
  423   1HH1  ARG  89          HH11      ARG  89  -3.328   9.624   4.289
  424   2HH1  ARG  89          HH12      ARG  89  -2.619  10.345   5.694
  425   1HH2  ARG  89          HH21      ARG  89  -2.968   7.501   7.695
  426   2HH2  ARG  89          HH22      ARG  89  -2.415   9.141   7.628
  427    H    ARG  90           HN       ARG  90  -7.838   9.968   2.391
  428    HA   ARG  90           HA       ARG  90  -8.968  11.065  -0.030
  429   1HB   ARG  90          HB2       ARG  90  -9.683  11.762   2.818
  430   2HB   ARG  90          HB1       ARG  90 -10.666  12.002   1.381
  431   1HG   ARG  90          HG2       ARG  90 -11.418   9.888   1.384
  432   2HG   ARG  90          HG1       ARG  90  -9.858   9.224   1.874
  433   1HD   ARG  90          HD2       ARG  90 -10.480   9.126   4.011
  434   2HD   ARG  90          HD1       ARG  90 -11.047  10.795   3.990
  435    HE   ARG  90           HE       ARG  90 -12.644   8.445   3.816
  436   1HH1  ARG  90          HH11      ARG  90 -12.440  11.758   2.741
  437   2HH1  ARG  90          HH12      ARG  90 -14.151  11.929   2.539
  438   1HH2  ARG  90          HH21      ARG  90 -14.895   8.667   3.550
  439   2HH2  ARG  90          HH22      ARG  90 -15.545  10.175   2.997
  Start of MODEL    2
    1    H    GLU  39           HN       GLU  39   6.341   0.154   6.965
    2    HA   GLU  39           HA       GLU  39   6.872  -0.438   4.213
    3   1HB   GLU  39          HB2       GLU  39   4.471  -1.101   5.925
    4   2HB   GLU  39          HB1       GLU  39   4.809  -1.780   4.339
    5   1HG   GLU  39          HG2       GLU  39   6.904  -2.735   5.246
    6   2HG   GLU  39          HG1       GLU  39   6.440  -2.143   6.841
    7    H    ILE  40           HN       ILE  40   4.869   1.826   5.926
    8    HA   ILE  40           HA       ILE  40   3.550   2.606   3.405
    9    HB   ILE  40           HB       ILE  40   1.998   3.882   4.935
   10   1HG1  ILE  40          HG12      ILE  40   3.283   2.170   7.075
   11   2HG1  ILE  40          HG11      ILE  40   3.562   3.899   6.884
   12   1HG2  ILE  40          HG21      ILE  40   2.178   1.002   4.530
   13   2HG2  ILE  40          HG22      ILE  40   0.808   2.094   4.327
   14   3HG2  ILE  40          HG23      ILE  40   1.192   1.451   5.923
   15   1HD1  ILE  40          HD11      ILE  40   1.387   2.506   8.172
   16   2HD1  ILE  40          HD12      ILE  40   0.809   3.669   6.980
   17   3HD1  ILE  40          HD13      ILE  40   1.872   4.198   8.283
   18    H    LEU  41           HN       LEU  41   3.964   4.560   2.534
   19    HA   LEU  41           HA       LEU  41   5.391   6.567   4.169
   20   1HB   LEU  41          HB2       LEU  41   6.170   5.282   1.635
   21   2HB   LEU  41          HB1       LEU  41   6.269   7.033   1.609
   22    HG   LEU  41           HG       LEU  41   7.571   6.595   3.904
   23   1HD1  LEU  41          HD11      LEU  41   7.176   4.082   3.483
   24   2HD1  LEU  41          HD12      LEU  41   8.779   4.618   3.984
   25   3HD1  LEU  41          HD13      LEU  41   8.466   4.239   2.291
   26   1HD2  LEU  41          HD21      LEU  41   8.345   7.808   1.868
   27   2HD2  LEU  41          HD22      LEU  41   8.880   6.260   1.210
   28   3HD2  LEU  41          HD23      LEU  41   9.610   6.892   2.687
   29    H    ILE  42           HN       ILE  42   4.497   8.625   3.993
   30    HA   ILE  42           HA       ILE  42   2.546   8.965   1.805
   31    HB   ILE  42           HB       ILE  42   1.397   8.710   3.936
   32   1HG1  ILE  42          HG12      ILE  42   0.699  10.425   2.110
   33   2HG1  ILE  42          HG11      ILE  42  -0.093  10.485   3.678
   34   1HG2  ILE  42          HG21      ILE  42   2.926  11.136   4.858
   35   2HG2  ILE  42          HG22      ILE  42   3.232   9.479   5.378
   36   3HG2  ILE  42          HG23      ILE  42   1.697  10.256   5.769
   37   1HD1  ILE  42          HD11      ILE  42   1.164  12.568   2.321
   38   2HD1  ILE  42          HD12      ILE  42   2.231  12.175   3.669
   39   3HD1  ILE  42          HD13      ILE  42   0.542  12.583   3.971
   40    H    GLU  43           HN       GLU  43   2.754  10.647   0.559
   41    HA   GLU  43           HA       GLU  43   4.307  13.000   1.430
   42   1HB   GLU  43          HB2       GLU  43   5.123  13.096  -0.975
   43   2HB   GLU  43          HB1       GLU  43   5.791  11.778  -0.022
   44   1HG   GLU  43          HG2       GLU  43   3.345  11.069  -1.444
   45   2HG   GLU  43          HG1       GLU  43   4.671  11.548  -2.502
   46    H    GLY  44           HN       GLY  44   3.266  14.930   0.850
   47   1HA   GLY  44          HA2       GLY  44   1.577  16.290   0.066
   48   2HA   GLY  44          HA1       GLY  44   1.597  15.265  -1.362
   49    H    ASN  45           HN       ASN  45   0.131  13.479  -1.488
   50    HA   ASN  45           HA       ASN  45  -1.868  13.241   0.627
   51   1HB   ASN  45          HB2       ASN  45  -3.719  13.429  -1.083
   52   2HB   ASN  45          HB1       ASN  45  -2.891  14.933  -0.689
   53   1HD2  ASN  45          HD21      ASN  45  -2.931  12.283  -3.022
   54   2HD2  ASN  45          HD22      ASN  45  -2.433  13.232  -4.376
   55    H    ARG  46           HN       ARG  46   0.065  11.753  -1.642
   56    HA   ARG  46           HA       ARG  46  -1.647   9.353  -1.804
   57   1HB   ARG  46          HB2       ARG  46  -0.248   8.735  -3.728
   58   2HB   ARG  46          HB1       ARG  46  -0.967  10.323  -3.962
   59   1HG   ARG  46          HG2       ARG  46   1.161  11.354  -3.250
   60   2HG   ARG  46          HG1       ARG  46   1.868   9.741  -3.132
   61   1HD   ARG  46          HD2       ARG  46   2.460  10.761  -5.250
   62   2HD   ARG  46          HD1       ARG  46   1.399   9.377  -5.516
   63    HE   ARG  46           HE       ARG  46  -0.189  10.796  -6.365
   64   1HH1  ARG  46          HH11      ARG  46   2.243  12.671  -4.708
   65   2HH1  ARG  46          HH12      ARG  46   1.629  14.191  -5.264
   66   1HH2  ARG  46          HH21      ARG  46  -0.998  12.795  -7.099
   67   2HH2  ARG  46          HH22      ARG  46  -0.210  14.262  -6.621
   68    H    THR  47           HN       THR  47  -0.893   7.424  -0.954
   69    HA   THR  47           HA       THR  47   1.825   7.443   0.206
   70    HB   THR  47           HB       THR  47  -0.699   6.160   1.263
   71    HG1  THR  47           HG1      THR  47   0.676   8.488   1.888
   72   1HG2  THR  47          HG21      THR  47   1.507   6.249   3.113
   73   2HG2  THR  47          HG22      THR  47   1.881   5.274   1.691
   74   3HG2  THR  47          HG23      THR  47   0.456   4.905   2.664
   75    H    ILE  48           HN       ILE  48   3.057   5.685  -0.236
   76    HA   ILE  48           HA       ILE  48   1.881   3.548  -1.903
   77    HB   ILE  48           HB       ILE  48   4.190   3.159  -2.690
   78   1HG1  ILE  48          HG12      ILE  48   5.463   5.577  -1.931
   79   2HG1  ILE  48          HG11      ILE  48   4.831   4.850  -0.457
   80   1HG2  ILE  48          HG21      ILE  48   4.394   5.703  -3.614
   81   2HG2  ILE  48          HG22      ILE  48   2.706   5.652  -3.106
   82   3HG2  ILE  48          HG23      ILE  48   3.312   4.479  -4.275
   83   1HD1  ILE  48          HD11      ILE  48   7.219   4.255  -1.612
   84   2HD1  ILE  48          HD12      ILE  48   6.187   2.958  -2.215
   85   3HD1  ILE  48          HD13      ILE  48   6.351   3.221  -0.479
   86    H    ILE  49           HN       ILE  49   2.071   1.434  -1.222
   87    HA   ILE  49           HA       ILE  49   3.541   1.009   1.294
   88    HB   ILE  49           HB       ILE  49   1.158  -0.546   0.309
   89   1HG1  ILE  49          HG12      ILE  49   1.414   1.480   2.533
   90   2HG1  ILE  49          HG11      ILE  49   0.557   1.724   1.015
   91   1HG2  ILE  49          HG21      ILE  49   1.826  -0.821   3.108
   92   2HG2  ILE  49          HG22      ILE  49   3.166  -1.312   2.072
   93   3HG2  ILE  49          HG23      ILE  49   1.583  -2.064   1.881
   94   1HD1  ILE  49          HD11      ILE  49  -1.284   0.853   1.873
   95   2HD1  ILE  49          HD12      ILE  49  -0.460   0.732   3.427
   96   3HD1  ILE  49          HD13      ILE  49  -0.430  -0.629   2.305
   97    H    ARG  50           HN       ARG  50   5.089  -0.396   1.311
   98    HA   ARG  50           HA       ARG  50   5.751  -1.815  -1.136
   99   1HB   ARG  50          HB2       ARG  50   7.198  -1.071   1.359
  100   2HB   ARG  50          HB1       ARG  50   7.756  -2.496   0.493
  101   1HG   ARG  50          HG2       ARG  50   8.145  -1.201  -1.494
  102   2HG   ARG  50          HG1       ARG  50   7.438   0.231  -0.742
  103   1HD   ARG  50          HD2       ARG  50   9.246  -0.026   1.041
  104   2HD   ARG  50          HD1       ARG  50  10.018  -1.154  -0.072
  105    HE   ARG  50           HE       ARG  50   9.378   1.369  -1.278
  106   1HH1  ARG  50          HH11      ARG  50  11.741  -0.361   0.621
  107   2HH1  ARG  50          HH12      ARG  50  13.054   0.665   0.150
  108   1HH2  ARG  50          HH21      ARG  50  11.103   2.720  -1.898
  109   2HH2  ARG  50          HH22      ARG  50  12.692   2.415  -1.279
  110    H    ASN  51           HN       ASN  51   3.544  -2.976  -0.403
  111    HA   ASN  51           HA       ASN  51   4.080  -5.130   1.427
  112   1HB   ASN  51          HB2       ASN  51   1.786  -3.754   0.724
  113   2HB   ASN  51          HB1       ASN  51   1.594  -5.331  -0.024
  114   1HD2  ASN  51          HD21      ASN  51   0.580  -6.751   1.179
  115   2HD2  ASN  51          HD22      ASN  51   0.589  -6.818   2.905
  116    H    PHE  52           HN       PHE  52   5.456  -4.879  -1.155
  117    HA   PHE  52           HA       PHE  52   4.701  -6.485  -3.137
  118   1HB   PHE  52          HB2       PHE  52   6.927  -5.300  -2.966
  119   2HB   PHE  52          HB1       PHE  52   7.515  -6.725  -2.110
  120    HD1  PHE  52           HD1      PHE  52   9.180  -6.732  -4.087
  121    HD2  PHE  52           HD2      PHE  52   5.017  -7.532  -4.523
  122    HE1  PHE  52           HE1      PHE  52   9.610  -7.855  -6.237
  123    HE2  PHE  52           HE2      PHE  52   5.429  -8.646  -6.660
  124    HZ   PHE  52           HZ       PHE  52   7.741  -8.815  -7.525
  125    H    ARG  53           HN       ARG  53   6.075  -7.924  -0.100
  126    HA   ARG  53           HA       ARG  53   6.315 -10.510  -1.100
  127   1HB   ARG  53          HB2       ARG  53   6.321  -9.308   1.456
  128   2HB   ARG  53          HB1       ARG  53   5.200 -10.659   1.545
  129   1HG   ARG  53          HG2       ARG  53   6.848 -12.143   1.552
  130   2HG   ARG  53          HG1       ARG  53   7.629 -11.391   0.161
  131   1HD   ARG  53          HD2       ARG  53   9.106 -11.372   2.091
  132   2HD   ARG  53          HD1       ARG  53   8.654  -9.731   1.639
  133    HE   ARG  53           HE       ARG  53   7.743 -11.201   4.005
  134   1HH1  ARG  53          HH11      ARG  53   7.831  -8.229   2.164
  135   2HH1  ARG  53          HH12      ARG  53   7.245  -7.261   3.472
  136   1HH2  ARG  53          HH21      ARG  53   6.970  -9.922   5.718
  137   2HH2  ARG  53          HH22      ARG  53   6.755  -8.219   5.486
  138    H    GLU  54           HN       GLU  54   3.570  -9.699   1.000
  139    HA   GLU  54           HA       GLU  54   1.874 -11.749   0.264
  140   1HB   GLU  54          HB2       GLU  54   1.713  -9.566   1.954
  141   2HB   GLU  54          HB1       GLU  54   0.456  -9.233   0.771
  142   1HG   GLU  54          HG2       GLU  54  -0.080 -11.811   1.290
  143   2HG   GLU  54          HG1       GLU  54   0.613 -11.325   2.838
  144    H    LEU  55           HN       LEU  55   2.111  -8.489  -1.023
  145    HA   LEU  55           HA       LEU  55   0.131  -8.486  -2.918
  146   1HB   LEU  55          HB2       LEU  55   1.503  -6.533  -2.399
  147   2HB   LEU  55          HB1       LEU  55   2.896  -7.295  -3.140
  148    HG   LEU  55           HG       LEU  55   0.593  -7.096  -4.937
  149   1HD1  LEU  55          HD11      LEU  55   1.281  -4.798  -3.355
  150   2HD1  LEU  55          HD12      LEU  55   0.021  -4.986  -4.576
  151   3HD1  LEU  55          HD13      LEU  55   1.650  -4.510  -5.055
  152   1HD2  LEU  55          HD21      LEU  55   3.517  -6.405  -5.057
  153   2HD2  LEU  55          HD22      LEU  55   2.404  -6.117  -6.393
  154   3HD2  LEU  55          HD23      LEU  55   2.686  -7.761  -5.819
  155    H    ALA  56           HN       ALA  56   3.421  -9.726  -3.253
  156    HA   ALA  56           HA       ALA  56   3.559 -10.371  -5.885
  157   1HB   ALA  56          HB1       ALA  56   5.238 -11.972  -5.316
  158   2HB   ALA  56          HB2       ALA  56   4.608 -12.127  -3.676
  159   3HB   ALA  56          HB3       ALA  56   5.375 -10.624  -4.188
  160    H    LYS  57           HN       LYS  57   2.463 -12.549  -3.266
  161    HA   LYS  57           HA       LYS  57   1.587 -14.642  -4.943
  162   1HB   LYS  57          HB2       LYS  57   0.855 -13.695  -2.218
  163   2HB   LYS  57          HB1       LYS  57  -0.301 -14.755  -3.013
  164   1HG   LYS  57          HG2       LYS  57   1.537 -16.395  -3.362
  165   2HG   LYS  57          HG1       LYS  57   2.583 -15.352  -2.396
  166   1HD   LYS  57          HD2       LYS  57   0.476 -15.563  -0.735
  167   2HD   LYS  57          HD1       LYS  57   0.366 -17.117  -1.564
  168   1HE   LYS  57          HE2       LYS  57   1.759 -17.642   0.190
  169   2HE   LYS  57          HE1       LYS  57   2.927 -17.234  -1.067
  170   1HZ   LYS  57          HZ1       LYS  57   3.753 -15.932   0.553
  171   2HZ   LYS  57          HZ2       LYS  57   2.290 -15.836   1.398
  172   3HZ   LYS  57          HZ3       LYS  57   2.553 -14.851   0.047
  173    H    ALA  58           HN       ALA  58  -0.069 -11.804  -3.745
  174    HA   ALA  58           HA       ALA  58  -2.544 -12.048  -4.886
  175   1HB   ALA  58          HB1       ALA  58  -1.381  -9.346  -5.007
  176   2HB   ALA  58          HB2       ALA  58  -1.318 -10.137  -3.432
  177   3HB   ALA  58          HB3       ALA  58  -2.867  -9.912  -4.245
  178    H    VAL  59           HN       VAL  59   0.388 -10.624  -6.407
  179    HA   VAL  59           HA       VAL  59  -0.785  -9.818  -8.728
  180    HB   VAL  59           HB       VAL  59   1.158  -9.293  -9.549
  181   1HG1  VAL  59          HG11      VAL  59   2.813  -8.892  -8.019
  182   2HG1  VAL  59          HG12      VAL  59   2.686 -10.490  -7.293
  183   3HG1  VAL  59          HG13      VAL  59   1.474  -9.262  -6.933
  184   1HG2  VAL  59          HG21      VAL  59   1.555 -11.417 -10.580
  185   2HG2  VAL  59          HG22      VAL  59   2.092 -12.126  -9.057
  186   3HG2  VAL  59          HG23      VAL  59   3.066 -10.885  -9.844
  187    H    ASN  60           HN       ASN  60   0.507 -13.052  -8.058
  188    HA   ASN  60           HA       ASN  60   0.096 -14.222 -10.516
  189   1HB   ASN  60          HB2       ASN  60   0.841 -15.244  -8.182
  190   2HB   ASN  60          HB1       ASN  60  -0.859 -15.696  -8.084
  191   1HD2  ASN  60          HD21      ASN  60  -1.361 -17.595  -8.884
  192   2HD2  ASN  60          HD22      ASN  60  -0.470 -18.469 -10.077
  193    H    ARG  61           HN       ARG  61  -2.200 -13.303  -8.016
  194    HA   ARG  61           HA       ARG  61  -4.480 -14.344  -9.510
  195   1HB   ARG  61          HB2       ARG  61  -4.040 -13.039  -6.920
  196   2HB   ARG  61          HB1       ARG  61  -5.504 -12.496  -7.729
  197   1HG   ARG  61          HG2       ARG  61  -6.547 -14.309  -7.015
  198   2HG   ARG  61          HG1       ARG  61  -5.440 -15.304  -7.961
  199   1HD   ARG  61          HD2       ARG  61  -4.612 -16.127  -6.073
  200   2HD   ARG  61          HD1       ARG  61  -4.044 -14.516  -5.642
  201    HE   ARG  61           HE       ARG  61  -6.739 -14.659  -4.968
  202   1HH1  ARG  61          HH11      ARG  61  -3.734 -16.164  -4.029
  203   2HH1  ARG  61          HH12      ARG  61  -4.248 -16.466  -2.403
  204   1HH2  ARG  61          HH21      ARG  61  -7.417 -15.054  -2.830
  205   2HH2  ARG  61          HH22      ARG  61  -6.338 -15.834  -1.721
  206    H    ASP  62           HN       ASP  62  -3.661 -11.084  -8.454
  207    HA   ASP  62           HA       ASP  62  -3.536  -9.742 -10.890
  208   1HB   ASP  62          HB2       ASP  62  -5.727  -8.424 -10.572
  209   2HB   ASP  62          HB1       ASP  62  -5.848 -10.025 -11.291
  210    H    GLU  63           HN       GLU  63  -1.759  -9.154  -9.610
  211    HA   GLU  63           HA       GLU  63  -1.713  -7.859  -7.156
  212   1HB   GLU  63          HB2       GLU  63   0.247  -6.555  -8.051
  213   2HB   GLU  63          HB1       GLU  63   0.381  -8.287  -8.211
  214   1HG   GLU  63          HG2       GLU  63  -0.301  -8.111 -10.569
  215   2HG   GLU  63          HG1       GLU  63  -0.383  -6.361 -10.387
  216    H    GLU  64           HN       GLU  64  -2.263  -6.753 -10.371
  217    HA   GLU  64           HA       GLU  64  -2.501  -4.021  -9.927
  218   1HB   GLU  64          HB2       GLU  64  -4.043  -5.750 -11.863
  219   2HB   GLU  64          HB1       GLU  64  -4.013  -3.993 -11.924
  220   1HG   GLU  64          HG2       GLU  64  -1.459  -4.256 -12.071
  221   2HG   GLU  64          HG1       GLU  64  -1.809  -5.933 -12.487
  222    H    PHE  65           HN       PHE  65  -5.090  -6.392 -10.049
  223    HA   PHE  65           HA       PHE  65  -7.222  -4.855  -9.263
  224   1HB   PHE  65          HB2       PHE  65  -7.119  -7.332 -10.014
  225   2HB   PHE  65          HB1       PHE  65  -6.927  -7.681  -8.299
  226    HD1  PHE  65           HD1      PHE  65  -9.229  -7.182 -10.914
  227    HD2  PHE  65           HD2      PHE  65  -8.714  -6.617  -6.726
  228    HE1  PHE  65           HE1      PHE  65 -11.671  -7.072 -10.633
  229    HE2  PHE  65           HE2      PHE  65 -11.155  -6.507  -6.438
  230    HZ   PHE  65           HZ       PHE  65 -12.637  -6.735  -8.392
  231    H    PHE  66           HN       PHE  66  -4.977  -6.688  -7.113
  232    HA   PHE  66           HA       PHE  66  -6.343  -6.118  -4.799
  233   1HB   PHE  66          HB2       PHE  66  -4.561  -7.631  -4.434
  234   2HB   PHE  66          HB1       PHE  66  -3.351  -6.445  -4.997
  235    HD1  PHE  66           HD1      PHE  66  -2.476  -4.843  -3.499
  236    HD2  PHE  66           HD2      PHE  66  -6.063  -6.925  -2.560
  237    HE1  PHE  66           HE1      PHE  66  -2.704  -3.531  -1.431
  238    HE2  PHE  66           HE2      PHE  66  -6.272  -5.651  -0.479
  239    HZ   PHE  66           HZ       PHE  66  -4.635  -3.916   0.026
  240    H    ALA  67           HN       ALA  67  -3.372  -4.174  -5.716
  241    HA   ALA  67           HA       ALA  67  -3.555  -2.338  -3.758
  242   1HB   ALA  67          HB1       ALA  67  -2.001  -1.270  -4.977
  243   2HB   ALA  67          HB2       ALA  67  -3.173  -0.883  -6.238
  244   3HB   ALA  67          HB3       ALA  67  -2.305  -2.418  -6.282
  245    H    LYS  68           HN       LYS  68  -5.509  -2.360  -6.758
  246    HA   LYS  68           HA       LYS  68  -6.995  -0.065  -6.412
  247   1HB   LYS  68          HB2       LYS  68  -7.354  -2.580  -7.772
  248   2HB   LYS  68          HB1       LYS  68  -8.879  -2.086  -7.048
  249   1HG   LYS  68          HG2       LYS  68  -8.989  -0.138  -8.311
  250   2HG   LYS  68          HG1       LYS  68  -7.264  -0.170  -8.685
  251   1HD   LYS  68          HD2       LYS  68  -8.108  -0.915 -10.676
  252   2HD   LYS  68          HD1       LYS  68  -7.915  -2.456  -9.837
  253   1HE   LYS  68          HE2       LYS  68 -10.073  -2.499 -10.800
  254   2HE   LYS  68          HE1       LYS  68 -10.309  -2.201  -9.079
  255   1HZ   LYS  68          HZ1       LYS  68 -11.596  -0.538  -9.807
  256   2HZ   LYS  68          HZ2       LYS  68 -10.888  -0.501 -11.343
  257   3HZ   LYS  68          HZ3       LYS  68 -10.142   0.292 -10.050
  258    H    TYR  69           HN       TYR  69  -7.531  -3.208  -4.857
  259    HA   TYR  69           HA       TYR  69  -9.723  -2.795  -3.298
  260   1HB   TYR  69          HB2       TYR  69  -7.309  -4.500  -2.980
  261   2HB   TYR  69          HB1       TYR  69  -8.331  -4.274  -1.572
  262    HD1  TYR  69           HD1      TYR  69 -11.015  -4.175  -2.843
  263    HD2  TYR  69           HD2      TYR  69  -7.698  -6.730  -3.589
  264    HE1  TYR  69           HE1      TYR  69 -12.546  -5.915  -3.662
  265    HE2  TYR  69           HE2      TYR  69  -9.218  -8.476  -4.411
  266    HH   TYR  69           HH       TYR  69 -11.706  -8.392  -5.492
  267    H    LEU  70           HN       LEU  70  -6.354  -2.107  -2.397
  268    HA   LEU  70           HA       LEU  70  -6.726  -1.120   0.136
  269   1HB   LEU  70          HB2       LEU  70  -4.650  -1.054  -1.689
  270   2HB   LEU  70          HB1       LEU  70  -5.007   0.645  -1.447
  271    HG   LEU  70           HG       LEU  70  -3.317   0.134   0.112
  272   1HD1  LEU  70          HD11      LEU  70  -5.652  -0.243   1.918
  273   2HD1  LEU  70          HD12      LEU  70  -5.558   1.227   0.948
  274   3HD1  LEU  70          HD13      LEU  70  -4.261   0.831   2.076
  275   1HD2  LEU  70          HD21      LEU  70  -4.919  -2.244   1.026
  276   2HD2  LEU  70          HD22      LEU  70  -3.315  -1.760   1.579
  277   3HD2  LEU  70          HD23      LEU  70  -3.545  -2.323  -0.077
  278    H    LEU  71           HN       LEU  71  -7.148   0.554  -2.921
  279    HA   LEU  71           HA       LEU  71  -8.073   3.005  -1.862
  280   1HB   LEU  71          HB2       LEU  71  -7.741   3.523  -4.002
  281   2HB   LEU  71          HB1       LEU  71  -7.677   1.833  -4.457
  282    HG   LEU  71           HG       LEU  71 -10.187   1.860  -4.604
  283   1HD1  LEU  71          HD11      LEU  71 -11.076   3.598  -3.462
  284   2HD1  LEU  71          HD12      LEU  71 -10.911   4.399  -5.026
  285   3HD1  LEU  71          HD13      LEU  71  -9.696   4.652  -3.773
  286   1HD2  LEU  71          HD21      LEU  71  -9.381   3.948  -6.496
  287   2HD2  LEU  71          HD22      LEU  71 -10.023   2.333  -6.789
  288   3HD2  LEU  71          HD23      LEU  71  -8.307   2.551  -6.444
  289    H    LYS  72           HN       LYS  72  -9.725   0.108  -3.145
  290    HA   LYS  72           HA       LYS  72 -12.355   0.890  -2.888
  291   1HB   LYS  72          HB2       LYS  72 -11.113  -1.800  -2.289
  292   2HB   LYS  72          HB1       LYS  72 -12.847  -1.529  -2.378
  293   1HG   LYS  72          HG2       LYS  72 -12.084  -0.483  -4.738
  294   2HG   LYS  72          HG1       LYS  72 -10.847  -1.722  -4.525
  295   1HD   LYS  72          HD2       LYS  72 -12.700  -2.667  -5.737
  296   2HD   LYS  72          HD1       LYS  72 -12.646  -3.381  -4.125
  297   1HE   LYS  72          HE2       LYS  72 -14.695  -2.650  -3.662
  298   2HE   LYS  72          HE1       LYS  72 -14.271  -1.003  -4.127
  299   1HZ   LYS  72          HZ1       LYS  72 -14.725  -2.918  -6.282
  300   2HZ   LYS  72          HZ2       LYS  72 -15.110  -1.274  -6.196
  301   3HZ   LYS  72          HZ3       LYS  72 -16.084  -2.411  -5.410
  302    H    GLU  73           HN       GLU  73 -10.236  -0.464  -0.404
  303    HA   GLU  73           HA       GLU  73 -12.116  -0.394   1.703
  304   1HB   GLU  73          HB2       GLU  73  -9.349  -1.054   1.370
  305   2HB   GLU  73          HB1       GLU  73  -9.516  -0.015   2.777
  306   1HG   GLU  73          HG2       GLU  73 -11.565  -2.029   2.767
  307   2HG   GLU  73          HG1       GLU  73  -9.969  -2.762   2.624
  308    H    THR  74           HN       THR  74  -9.542   1.895   0.787
  309    HA   THR  74           HA       THR  74 -10.102   3.776   2.814
  310    HB   THR  74           HB       THR  74  -8.700   5.305   1.545
  311    HG1  THR  74           HG1      THR  74  -8.558   5.173  -0.531
  312   1HG2  THR  74          HG21      THR  74  -6.945   4.171   2.246
  313   2HG2  THR  74          HG22      THR  74  -7.018   3.187   0.784
  314   3HG2  THR  74          HG23      THR  74  -7.873   2.672   2.239
  315    H    GLY  75           HN       GLY  75 -10.636   4.283  -0.685
  316   1HA   GLY  75          HA2       GLY  75 -13.063   4.702  -1.274
  317   2HA   GLY  75          HA1       GLY  75 -13.023   5.860   0.045
  318    H    SER  76           HN       SER  76 -10.501   7.015  -0.445
  319    HA   SER  76           HA       SER  76 -11.156   9.012  -2.259
  320   1HB   SER  76          HB2       SER  76  -8.738   8.218  -0.772
  321   2HB   SER  76          HB1       SER  76  -8.436   9.173  -2.224
  322    HG   SER  76           HG       SER  76 -10.334   9.919  -0.261
  323    H    ALA  77           HN       ALA  77  -8.121   7.384  -2.978
  324    HA   ALA  77           HA       ALA  77  -9.124   6.280  -5.468
  325   1HB   ALA  77          HB1       ALA  77  -7.366   8.708  -5.380
  326   2HB   ALA  77          HB2       ALA  77  -8.796   8.404  -6.367
  327   3HB   ALA  77          HB3       ALA  77  -7.280   7.580  -6.733
  328    H    GLY  78           HN       GLY  78  -7.580   4.796  -6.444
  329   1HA   GLY  78          HA2       GLY  78  -5.232   4.317  -4.714
  330   2HA   GLY  78          HA1       GLY  78  -6.276   3.000  -5.198
  331    H    ASN  79           HN       ASN  79  -3.481   3.225  -5.573
  332    HA   ASN  79           HA       ASN  79  -3.329   3.081  -8.513
  333   1HB   ASN  79          HB2       ASN  79  -1.349   4.270  -6.549
  334   2HB   ASN  79          HB1       ASN  79  -0.946   3.901  -8.224
  335   1HD2  ASN  79          HD21      ASN  79  -1.823   6.302  -6.209
  336   2HD2  ASN  79          HD22      ASN  79  -2.568   7.384  -7.331
  337    H    LEU  80           HN       LEU  80  -2.303   1.261  -9.261
  338    HA   LEU  80           HA       LEU  80  -1.138  -0.563  -7.233
  339   1HB   LEU  80          HB2       LEU  80  -1.801  -2.375  -8.803
  340   2HB   LEU  80          HB1       LEU  80  -3.164  -1.478  -8.162
  341    HG   LEU  80           HG       LEU  80  -2.693  -0.121 -10.479
  342   1HD1  LEU  80          HD11      LEU  80  -1.351  -2.651 -10.734
  343   2HD1  LEU  80          HD12      LEU  80  -1.415  -1.293 -11.856
  344   3HD1  LEU  80          HD13      LEU  80  -2.674  -2.526 -11.892
  345   1HD2  LEU  80          HD21      LEU  80  -4.764  -0.840 -11.066
  346   2HD2  LEU  80          HD22      LEU  80  -4.765  -1.381  -9.388
  347   3HD2  LEU  80          HD23      LEU  80  -4.412  -2.524 -10.682
  348    H    GLU  81           HN       GLU  81   0.885  -1.348  -7.598
  349    HA   GLU  81           HA       GLU  81   2.153  -0.770 -10.210
  350   1HB   GLU  81          HB2       GLU  81   2.868   0.108  -7.529
  351   2HB   GLU  81          HB1       GLU  81   4.161  -0.851  -8.238
  352   1HG   GLU  81          HG2       GLU  81   4.835   0.962  -9.300
  353   2HG   GLU  81          HG1       GLU  81   3.357   0.894 -10.258
  354    H    GLY  82           HN       GLY  82   3.328  -2.536 -11.026
  355   1HA   GLY  82          HA2       GLY  82   2.797  -5.103 -10.022
  356   2HA   GLY  82          HA1       GLY  82   4.044  -4.715 -11.189
  357    H    GLY  83           HN       GLY  83   3.442  -4.493  -7.629
  358   1HA   GLY  83          HA2       GLY  83   5.370  -6.098  -6.721
  359   2HA   GLY  83          HA1       GLY  83   6.311  -4.692  -7.117
  360    H    ARG  84           HN       ARG  84   4.121  -3.026  -6.339
  361    HA   ARG  84           HA       ARG  84   4.013  -3.233  -3.423
  362   1HB   ARG  84          HB2       ARG  84   4.449  -0.780  -3.397
  363   2HB   ARG  84          HB1       ARG  84   5.805  -1.664  -4.083
  364   1HG   ARG  84          HG2       ARG  84   4.232  -1.050  -6.276
  365   2HG   ARG  84          HG1       ARG  84   4.140   0.390  -5.262
  366   1HD   ARG  84          HD2       ARG  84   6.009   0.461  -6.878
  367   2HD   ARG  84          HD1       ARG  84   6.543   0.557  -5.199
  368    HE   ARG  84           HE       ARG  84   6.549  -2.110  -6.280
  369   1HH1  ARG  84          HH11      ARG  84   8.381   0.836  -5.902
  370   2HH1  ARG  84          HH12      ARG  84   9.914   0.053  -6.084
  371   1HH2  ARG  84          HH21      ARG  84   8.565  -3.141  -6.519
  372   2HH2  ARG  84          HH22      ARG  84  10.019  -2.205  -6.433
  373    H    LEU  85           HN       LEU  85   2.143  -2.436  -2.618
  374    HA   LEU  85           HA       LEU  85  -0.027  -1.708  -4.596
  375   1HB   LEU  85          HB2       LEU  85  -1.563  -2.268  -2.692
  376   2HB   LEU  85          HB1       LEU  85  -0.651  -3.625  -3.316
  377    HG   LEU  85           HG       LEU  85   0.941  -2.788  -1.248
  378   1HD1  LEU  85          HD11      LEU  85  -1.665  -2.844   0.105
  379   2HD1  LEU  85          HD12      LEU  85  -1.310  -1.361  -0.783
  380   3HD1  LEU  85          HD13      LEU  85  -0.210  -1.922   0.477
  381   1HD2  LEU  85          HD21      LEU  85  -0.275  -4.708  -0.019
  382   2HD2  LEU  85          HD22      LEU  85   0.570  -5.056  -1.528
  383   3HD2  LEU  85          HD23      LEU  85  -1.180  -4.876  -1.522
  384    H    ILE  86           HN       ILE  86  -0.888   0.342  -4.410
  385    HA   ILE  86           HA       ILE  86   0.075   2.043  -2.186
  386    HB   ILE  86           HB       ILE  86  -0.557   2.805  -5.043
  387   1HG1  ILE  86          HG12      ILE  86   2.156   2.941  -3.771
  388   2HG1  ILE  86          HG11      ILE  86   1.577   1.430  -4.465
  389   1HG2  ILE  86          HG21      ILE  86  -0.155   4.989  -4.567
  390   2HG2  ILE  86          HG22      ILE  86   0.914   4.618  -3.217
  391   3HG2  ILE  86          HG23      ILE  86  -0.833   4.486  -3.020
  392   1HD1  ILE  86          HD11      ILE  86   1.824   2.156  -6.574
  393   2HD1  ILE  86          HD12      ILE  86   2.964   3.278  -5.829
  394   3HD1  ILE  86          HD13      ILE  86   1.318   3.800  -6.184
  395    H    LEU  87           HN       LEU  87  -1.350   3.308  -1.124
  396    HA   LEU  87           HA       LEU  87  -4.136   3.372  -2.081
  397   1HB   LEU  87          HB2       LEU  87  -4.943   3.166   0.130
  398   2HB   LEU  87          HB1       LEU  87  -3.728   1.927  -0.049
  399    HG   LEU  87           HG       LEU  87  -3.473   2.815   2.119
  400   1HD1  LEU  87          HD11      LEU  87  -1.328   4.273   0.629
  401   2HD1  LEU  87          HD12      LEU  87  -1.395   2.514   0.671
  402   3HD1  LEU  87          HD13      LEU  87  -1.237   3.426   2.171
  403   1HD2  LEU  87          HD21      LEU  87  -2.831   5.568   1.603
  404   2HD2  LEU  87          HD22      LEU  87  -4.024   4.878   2.702
  405   3HD2  LEU  87          HD23      LEU  87  -4.452   5.186   1.019
  406    H    GLN  88           HN       GLN  88  -5.029   5.361  -2.160
  407    HA   GLN  88           HA       GLN  88  -3.399   7.593  -1.142
  408   1HB   GLN  88          HB2       GLN  88  -3.771   7.281  -3.705
  409   2HB   GLN  88          HB1       GLN  88  -5.371   7.930  -3.372
  410   1HG   GLN  88          HG2       GLN  88  -3.742   9.708  -2.086
  411   2HG   GLN  88          HG1       GLN  88  -2.790   9.273  -3.504
  412   1HE2  GLN  88          HE21      GLN  88  -3.586   9.749  -5.558
  413   2HE2  GLN  88          HE22      GLN  88  -4.857  10.892  -5.804
  414    H    ARG  89           HN       ARG  89  -4.253   8.168   0.710
  415    HA   ARG  89           HA       ARG  89  -6.703   9.530   0.857
  416   1HB   ARG  89          HB2       ARG  89  -7.425   7.038   0.691
  417   2HB   ARG  89          HB1       ARG  89  -6.888   6.937   2.362
  418   1HG   ARG  89          HG2       ARG  89  -8.439   9.093   2.564
  419   2HG   ARG  89          HG1       ARG  89  -9.234   8.307   1.199
  420   1HD   ARG  89          HD2       ARG  89 -10.166   6.781   2.525
  421   2HD   ARG  89          HD1       ARG  89  -8.616   6.400   3.276
  422    HE   ARG  89           HE       ARG  89  -9.307   8.724   4.462
  423   1HH1  ARG  89          HH11      ARG  89 -11.002   5.711   3.984
  424   2HH1  ARG  89          HH12      ARG  89 -11.939   5.864   5.432
  425   1HH2  ARG  89          HH21      ARG  89 -10.538   8.926   6.367
  426   2HH2  ARG  89          HH22      ARG  89 -11.678   7.690   6.784
  427    H    ARG  90           HN       ARG  90  -5.155   7.263   3.134
  428    HA   ARG  90           HA       ARG  90  -4.368   7.580   5.254
  429   1HB   ARG  90          HB2       ARG  90  -2.684   8.722   3.546
  430   2HB   ARG  90          HB1       ARG  90  -3.156  10.170   4.423
  431   1HG   ARG  90          HG2       ARG  90  -1.221   9.396   5.490
  432   2HG   ARG  90          HG1       ARG  90  -2.554   8.914   6.539
  433   1HD   ARG  90          HD2       ARG  90  -1.941   6.899   4.541
  434   2HD   ARG  90          HD1       ARG  90  -0.550   7.274   5.556
  435    HE   ARG  90           HE       ARG  90  -2.547   6.953   7.348
  436   1HH1  ARG  90          HH11      ARG  90  -1.368   4.988   4.717
  437   2HH1  ARG  90          HH12      ARG  90  -1.806   3.492   5.471
  438   1HH2  ARG  90          HH21      ARG  90  -3.126   4.987   8.343
  439   2HH2  ARG  90          HH22      ARG  90  -2.806   3.491   7.529
  Start of MODEL    3
    1    H    GLU  39           HN       GLU  39   7.715   0.811   4.829
    2    HA   GLU  39           HA       GLU  39   6.073  -1.366   4.525
    3   1HB   GLU  39          HB2       GLU  39   6.106  -0.435   7.274
    4   2HB   GLU  39          HB1       GLU  39   4.491  -0.338   6.588
    5   1HG   GLU  39          HG2       GLU  39   4.396  -2.635   6.183
    6   2HG   GLU  39          HG1       GLU  39   6.141  -2.826   6.353
    7    H    ILE  40           HN       ILE  40   4.874   1.536   6.153
    8    HA   ILE  40           HA       ILE  40   3.679   2.382   3.588
    9    HB   ILE  40           HB       ILE  40   2.038   1.714   5.298
   10   1HG1  ILE  40          HG12      ILE  40   2.015   4.717   4.955
   11   2HG1  ILE  40          HG11      ILE  40   1.583   3.586   3.677
   12   1HG2  ILE  40          HG21      ILE  40   3.181   3.951   6.964
   13   2HG2  ILE  40          HG22      ILE  40   3.400   2.229   7.274
   14   3HG2  ILE  40          HG23      ILE  40   1.792   2.946   7.373
   15   1HD1  ILE  40          HD11      ILE  40  -0.386   2.996   4.677
   16   2HD1  ILE  40          HD12      ILE  40  -0.249   4.684   5.173
   17   3HD1  ILE  40          HD13      ILE  40   0.189   3.396   6.296
   18    H    LEU  41           HN       LEU  41   4.136   4.404   2.844
   19    HA   LEU  41           HA       LEU  41   5.473   6.304   4.674
   20   1HB   LEU  41          HB2       LEU  41   6.334   5.262   2.020
   21   2HB   LEU  41          HB1       LEU  41   6.618   6.961   2.349
   22    HG   LEU  41           HG       LEU  41   7.685   5.977   4.577
   23   1HD1  LEU  41          HD11      LEU  41   8.909   3.895   4.057
   24   2HD1  LEU  41          HD12      LEU  41   7.967   3.743   2.574
   25   3HD1  LEU  41          HD13      LEU  41   7.162   3.665   4.141
   26   1HD2  LEU  41          HD21      LEU  41   9.454   5.634   2.242
   27   2HD2  LEU  41          HD22      LEU  41   9.659   6.620   3.691
   28   3HD2  LEU  41          HD23      LEU  41   8.633   7.190   2.375
   29    H    ILE  42           HN       ILE  42   4.651   8.369   4.555
   30    HA   ILE  42           HA       ILE  42   2.819   8.885   2.300
   31    HB   ILE  42           HB       ILE  42   2.586  10.253   4.967
   32   1HG1  ILE  42          HG12      ILE  42   0.599   8.178   4.563
   33   2HG1  ILE  42          HG11      ILE  42   2.220   7.496   4.607
   34   1HG2  ILE  42          HG21      ILE  42   1.046  10.130   2.464
   35   2HG2  ILE  42          HG22      ILE  42   1.199  11.430   3.645
   36   3HG2  ILE  42          HG23      ILE  42   0.095  10.089   3.949
   37   1HD1  ILE  42          HD11      ILE  42   1.857   7.460   6.814
   38   2HD1  ILE  42          HD12      ILE  42   0.626   8.721   6.740
   39   3HD1  ILE  42          HD13      ILE  42   2.336   9.155   6.724
   40    H    GLU  43           HN       GLU  43   3.204  10.575   1.085
   41    HA   GLU  43           HA       GLU  43   4.882  12.798   2.058
   42   1HB   GLU  43          HB2       GLU  43   5.145  11.114  -0.426
   43   2HB   GLU  43          HB1       GLU  43   5.639  12.801  -0.467
   44   1HG   GLU  43          HG2       GLU  43   6.693  11.206   1.772
   45   2HG   GLU  43          HG1       GLU  43   7.278  10.774   0.166
   46    H    GLY  44           HN       GLY  44   4.009  14.806   1.448
   47   1HA   GLY  44          HA2       GLY  44   2.437  16.276   0.618
   48   2HA   GLY  44          HA1       GLY  44   2.514  15.302  -0.843
   49    H    ASN  45           HN       ASN  45   0.936  13.667  -1.193
   50    HA   ASN  45           HA       ASN  45  -1.231  13.474   0.766
   51   1HB   ASN  45          HB2       ASN  45  -2.903  13.782  -1.126
   52   2HB   ASN  45          HB1       ASN  45  -2.066  15.230  -0.573
   53   1HD2  ASN  45          HD21      ASN  45  -0.553  16.207  -1.900
   54   2HD2  ASN  45          HD22      ASN  45  -0.417  15.831  -3.580
   55    H    ARG  46           HN       ARG  46   0.801  11.910  -1.360
   56    HA   ARG  46           HA       ARG  46  -1.022   9.606  -1.687
   57   1HB   ARG  46          HB2       ARG  46   1.565  10.004  -3.174
   58   2HB   ARG  46          HB1       ARG  46   0.175   9.032  -3.634
   59   1HG   ARG  46          HG2       ARG  46  -1.072  11.271  -3.815
   60   2HG   ARG  46          HG1       ARG  46   0.535  11.998  -3.808
   61   1HD   ARG  46          HD2       ARG  46   0.217  11.731  -6.059
   62   2HD   ARG  46          HD1       ARG  46   1.002  10.202  -5.666
   63    HE   ARG  46           HE       ARG  46  -1.701   9.749  -5.398
   64   1HH1  ARG  46          HH11      ARG  46   0.447  10.767  -7.955
   65   2HH1  ARG  46          HH12      ARG  46  -0.525  10.082  -9.214
   66   1HH2  ARG  46          HH21      ARG  46  -2.979   8.846  -7.053
   67   2HH2  ARG  46          HH22      ARG  46  -2.470   8.991  -8.702
   68    H    THR  47           HN       THR  47  -0.411   7.635  -0.823
   69    HA   THR  47           HA       THR  47   2.245   7.495   0.465
   70    HB   THR  47           HB       THR  47  -0.408   6.399   1.406
   71    HG1  THR  47           HG1      THR  47  -0.086   8.591   1.879
   72   1HG2  THR  47          HG21      THR  47   1.889   5.104   1.866
   73   2HG2  THR  47          HG22      THR  47   0.545   5.156   3.006
   74   3HG2  THR  47          HG23      THR  47   1.908   6.256   3.199
   75    H    ILE  48           HN       ILE  48   3.383   5.670   0.064
   76    HA   ILE  48           HA       ILE  48   2.124   3.590  -1.627
   77    HB   ILE  48           HB       ILE  48   5.052   4.337  -1.455
   78   1HG1  ILE  48          HG12      ILE  48   3.338   4.872  -3.855
   79   2HG1  ILE  48          HG11      ILE  48   3.334   6.014  -2.516
   80   1HG2  ILE  48          HG21      ILE  48   3.545   2.213  -2.824
   81   2HG2  ILE  48          HG22      ILE  48   5.224   2.253  -2.289
   82   3HG2  ILE  48          HG23      ILE  48   4.761   3.035  -3.800
   83   1HD1  ILE  48          HD11      ILE  48   5.079   6.000  -4.631
   84   2HD1  ILE  48          HD12      ILE  48   6.015   5.260  -3.332
   85   3HD1  ILE  48          HD13      ILE  48   5.301   6.857  -3.106
   86    H    ILE  49           HN       ILE  49   2.283   1.455  -0.928
   87    HA   ILE  49           HA       ILE  49   3.966   1.028   1.440
   88    HB   ILE  49           HB       ILE  49   1.733   0.967   2.252
   89   1HG1  ILE  49          HG12      ILE  49   2.780  -1.848   1.888
   90   2HG1  ILE  49          HG11      ILE  49   3.229  -0.731   3.173
   91   1HG2  ILE  49          HG21      ILE  49   0.069  -0.631   1.343
   92   2HG2  ILE  49          HG22      ILE  49   1.185  -0.961   0.019
   93   3HG2  ILE  49          HG23      ILE  49   0.513   0.656   0.222
   94   1HD1  ILE  49          HD11      ILE  49   1.069  -0.849   4.140
   95   2HD1  ILE  49          HD12      ILE  49   1.591  -2.502   3.814
   96   3HD1  ILE  49          HD13      ILE  49   0.425  -1.719   2.747
   97    H    ARG  50           HN       ARG  50   5.438  -0.352   1.215
   98    HA   ARG  50           HA       ARG  50   5.735  -1.911  -1.165
   99   1HB   ARG  50          HB2       ARG  50   7.414  -2.082   1.337
  100   2HB   ARG  50          HB1       ARG  50   7.879  -2.532  -0.298
  101   1HG   ARG  50          HG2       ARG  50   7.047   0.253  -0.056
  102   2HG   ARG  50          HG1       ARG  50   8.451  -0.157   0.931
  103   1HD   ARG  50          HD2       ARG  50   9.313  -1.303  -1.234
  104   2HD   ARG  50          HD1       ARG  50   8.120  -0.286  -2.040
  105    HE   ARG  50           HE       ARG  50   9.783   1.210  -0.272
  106   1HH1  ARG  50          HH11      ARG  50   9.655  -0.233  -3.447
  107   2HH1  ARG  50          HH12      ARG  50  10.810   0.863  -4.128
  108   1HH2  ARG  50          HH21      ARG  50  11.303   2.652  -1.166
  109   2HH2  ARG  50          HH22      ARG  50  11.747   2.500  -2.833
  110    H    ASN  51           HN       ASN  51   3.541  -2.952  -0.536
  111    HA   ASN  51           HA       ASN  51   3.840  -5.150   1.320
  112   1HB   ASN  51          HB2       ASN  51   1.714  -3.718   1.016
  113   2HB   ASN  51          HB1       ASN  51   1.442  -4.689  -0.428
  114   1HD2  ASN  51          HD21      ASN  51  -0.049  -4.467   2.114
  115   2HD2  ASN  51          HD22      ASN  51  -0.176  -6.084   2.711
  116    H    PHE  52           HN       PHE  52   5.273  -4.883  -1.310
  117    HA   PHE  52           HA       PHE  52   4.419  -6.501  -3.255
  118   1HB   PHE  52          HB2       PHE  52   6.590  -5.234  -3.233
  119   2HB   PHE  52          HB1       PHE  52   7.293  -6.626  -2.409
  120    HD1  PHE  52           HD1      PHE  52   8.827  -6.544  -4.489
  121    HD2  PHE  52           HD2      PHE  52   4.696  -7.577  -4.655
  122    HE1  PHE  52           HE1      PHE  52   9.183  -7.653  -6.657
  123    HE2  PHE  52           HE2      PHE  52   5.038  -8.679  -6.814
  124    HZ   PHE  52           HZ       PHE  52   7.293  -8.722  -7.823
  125    H    ARG  53           HN       ARG  53   5.985  -7.889  -0.303
  126    HA   ARG  53           HA       ARG  53   6.287 -10.463  -1.233
  127   1HB   ARG  53          HB2       ARG  53   5.461 -11.135   1.184
  128   2HB   ARG  53          HB1       ARG  53   6.989 -10.303   0.943
  129   1HG   ARG  53          HG2       ARG  53   4.900  -8.370   1.249
  130   2HG   ARG  53          HG1       ARG  53   4.824  -9.538   2.568
  131   1HD   ARG  53          HD2       ARG  53   7.512  -9.042   2.375
  132   2HD   ARG  53          HD1       ARG  53   6.810  -7.469   2.000
  133    HE   ARG  53           HE       ARG  53   6.783  -8.829   4.540
  134   1HH1  ARG  53          HH11      ARG  53   5.261  -6.381   2.569
  135   2HH1  ARG  53          HH12      ARG  53   4.598  -5.529   3.922
  136   1HH2  ARG  53          HH21      ARG  53   5.911  -7.707   6.318
  137   2HH2  ARG  53          HH22      ARG  53   4.968  -6.279   6.050
  138    H    GLU  54           HN       GLU  54   3.422  -9.715   0.722
  139    HA   GLU  54           HA       GLU  54   1.826 -11.818  -0.068
  140   1HB   GLU  54          HB2       GLU  54   1.223  -9.063   0.955
  141   2HB   GLU  54          HB1       GLU  54  -0.095 -10.108   0.446
  142   1HG   GLU  54          HG2       GLU  54   0.190 -10.320   2.808
  143   2HG   GLU  54          HG1       GLU  54   0.705 -11.821   2.040
  144    H    LEU  55           HN       LEU  55   2.057  -8.569  -1.417
  145    HA   LEU  55           HA       LEU  55   0.144  -8.662  -3.369
  146   1HB   LEU  55          HB2       LEU  55   2.483  -7.084  -2.829
  147   2HB   LEU  55          HB1       LEU  55   2.333  -7.357  -4.554
  148    HG   LEU  55           HG       LEU  55   0.021  -6.480  -4.470
  149   1HD1  LEU  55          HD11      LEU  55   0.706  -6.123  -1.572
  150   2HD1  LEU  55          HD12      LEU  55  -0.708  -6.895  -2.288
  151   3HD1  LEU  55          HD13      LEU  55  -0.526  -5.143  -2.366
  152   1HD2  LEU  55          HD21      LEU  55   0.657  -4.114  -4.045
  153   2HD2  LEU  55          HD22      LEU  55   1.769  -4.976  -5.107
  154   3HD2  LEU  55          HD23      LEU  55   2.203  -4.688  -3.421
  155    H    ALA  56           HN       ALA  56   3.500  -9.839  -3.683
  156    HA   ALA  56           HA       ALA  56   3.545 -10.547  -6.321
  157   1HB   ALA  56          HB1       ALA  56   5.273 -12.111  -5.783
  158   2HB   ALA  56          HB2       ALA  56   4.723 -12.227  -4.112
  159   3HB   ALA  56          HB3       ALA  56   5.447 -10.729  -4.700
  160    H    LYS  57           HN       LYS  57   2.510 -12.519  -3.543
  161    HA   LYS  57           HA       LYS  57   1.570 -14.737  -5.003
  162   1HB   LYS  57          HB2       LYS  57   0.252 -13.556  -2.541
  163   2HB   LYS  57          HB1       LYS  57   0.132 -15.218  -3.100
  164   1HG   LYS  57          HG2       LYS  57   2.112 -15.803  -2.210
  165   2HG   LYS  57          HG1       LYS  57   2.862 -14.251  -2.587
  166   1HD   LYS  57          HD2       LYS  57   2.733 -13.879  -0.377
  167   2HD   LYS  57          HD1       LYS  57   1.029 -13.541  -0.693
  168   1HE   LYS  57          HE2       LYS  57   1.028 -15.072   1.087
  169   2HE   LYS  57          HE1       LYS  57   0.632 -16.027  -0.341
  170   1HZ   LYS  57          HZ1       LYS  57   3.455 -15.849   0.303
  171   2HZ   LYS  57          HZ2       LYS  57   2.541 -17.178  -0.205
  172   3HZ   LYS  57          HZ3       LYS  57   2.512 -16.704   1.417
  173    H    ALA  58           HN       ALA  58   0.006 -11.760  -4.023
  174    HA   ALA  58           HA       ALA  58  -2.506 -12.050  -5.086
  175   1HB   ALA  58          HB1       ALA  58  -1.286  -9.381  -5.383
  176   2HB   ALA  58          HB2       ALA  58  -1.253 -10.085  -3.765
  177   3HB   ALA  58          HB3       ALA  58  -2.791  -9.866  -4.602
  178    H    VAL  59           HN       VAL  59   0.393 -10.756  -6.797
  179    HA   VAL  59           HA       VAL  59  -0.868 -10.051  -9.109
  180    HB   VAL  59           HB       VAL  59   1.068  -9.525  -9.931
  181   1HG1  VAL  59          HG11      VAL  59   2.707 -10.939  -7.895
  182   2HG1  VAL  59          HG12      VAL  59   1.598  -9.681  -7.353
  183   3HG1  VAL  59          HG13      VAL  59   2.852  -9.303  -8.529
  184   1HG2  VAL  59          HG21      VAL  59   2.821 -11.161 -10.531
  185   2HG2  VAL  59          HG22      VAL  59   1.218 -11.637 -11.090
  186   3HG2  VAL  59          HG23      VAL  59   1.922 -12.410  -9.671
  187    H    ASN  60           HN       ASN  60   0.451 -13.246  -8.345
  188    HA   ASN  60           HA       ASN  60  -0.239 -14.542 -10.697
  189   1HB   ASN  60          HB2       ASN  60  -0.582 -15.669  -7.904
  190   2HB   ASN  60          HB1       ASN  60  -0.373 -16.592  -9.390
  191   1HD2  ASN  60          HD21      ASN  60   1.177 -14.594  -7.011
  192   2HD2  ASN  60          HD22      ASN  60   2.802 -14.964  -7.463
  193    H    ARG  61           HN       ARG  61  -2.230 -13.494  -8.003
  194    HA   ARG  61           HA       ARG  61  -4.632 -14.484  -9.416
  195   1HB   ARG  61          HB2       ARG  61  -3.869 -14.456  -6.653
  196   2HB   ARG  61          HB1       ARG  61  -5.336 -13.507  -6.854
  197   1HG   ARG  61          HG2       ARG  61  -6.559 -15.342  -7.037
  198   2HG   ARG  61          HG1       ARG  61  -5.546 -15.941  -8.351
  199   1HD   ARG  61          HD2       ARG  61  -3.911 -16.502  -6.350
  200   2HD   ARG  61          HD1       ARG  61  -5.417 -16.505  -5.432
  201    HE   ARG  61           HE       ARG  61  -4.515 -18.513  -7.221
  202   1HH1  ARG  61          HH11      ARG  61  -7.406 -16.895  -6.123
  203   2HH1  ARG  61          HH12      ARG  61  -8.442 -18.236  -6.476
  204   1HH2  ARG  61          HH21      ARG  61  -5.876 -20.280  -7.686
  205   2HH2  ARG  61          HH22      ARG  61  -7.574 -20.159  -7.362
  206    H    ASP  62           HN       ASP  62  -3.085 -11.965  -9.973
  207    HA   ASP  62           HA       ASP  62  -3.721  -9.931 -10.895
  208   1HB   ASP  62          HB2       ASP  62  -6.311 -10.046  -9.349
  209   2HB   ASP  62          HB1       ASP  62  -5.936  -9.099 -10.783
  210    H    GLU  63           HN       GLU  63  -1.954  -9.429  -9.563
  211    HA   GLU  63           HA       GLU  63  -2.133  -8.421  -6.915
  212   1HB   GLU  63          HB2       GLU  63  -0.067  -7.170  -7.394
  213   2HB   GLU  63          HB1       GLU  63   0.063  -8.834  -7.912
  214   1HG   GLU  63          HG2       GLU  63  -0.308  -8.176 -10.218
  215   2HG   GLU  63          HG1       GLU  63  -0.542  -6.505  -9.713
  216    H    GLU  64           HN       GLU  64  -2.386  -7.067 -10.097
  217    HA   GLU  64           HA       GLU  64  -2.644  -4.370  -9.561
  218   1HB   GLU  64          HB2       GLU  64  -2.611  -5.053 -11.837
  219   2HB   GLU  64          HB1       GLU  64  -3.989  -6.118 -11.614
  220   1HG   GLU  64          HG2       GLU  64  -5.326  -3.982 -11.151
  221   2HG   GLU  64          HG1       GLU  64  -3.946  -3.132 -11.844
  222    H    PHE  65           HN       PHE  65  -5.131  -6.829  -9.597
  223    HA   PHE  65           HA       PHE  65  -7.347  -5.354  -8.910
  224   1HB   PHE  65          HB2       PHE  65  -6.723  -8.061  -9.203
  225   2HB   PHE  65          HB1       PHE  65  -7.340  -7.921  -7.562
  226    HD1  PHE  65           HD1      PHE  65  -9.601  -8.146  -7.254
  227    HD2  PHE  65           HD2      PHE  65  -8.164  -6.739 -11.005
  228    HE1  PHE  65           HE1      PHE  65 -11.903  -8.123  -8.123
  229    HE2  PHE  65           HE2      PHE  65 -10.463  -6.713 -11.880
  230    HZ   PHE  65           HZ       PHE  65 -12.337  -7.405 -10.439
  231    H    PHE  66           HN       PHE  66  -5.000  -6.942  -6.678
  232    HA   PHE  66           HA       PHE  66  -6.413  -6.218  -4.411
  233   1HB   PHE  66          HB2       PHE  66  -4.728  -7.805  -3.952
  234   2HB   PHE  66          HB1       PHE  66  -3.443  -6.711  -4.539
  235    HD1  PHE  66           HD1      PHE  66  -6.343  -6.708  -2.240
  236    HD2  PHE  66           HD2      PHE  66  -2.398  -5.331  -3.011
  237    HE1  PHE  66           HE1      PHE  66  -6.468  -5.284  -0.254
  238    HE2  PHE  66           HE2      PHE  66  -2.506  -3.936  -0.996
  239    HZ   PHE  66           HZ       PHE  66  -4.577  -3.862   0.317
  240    H    ALA  67           HN       ALA  67  -3.376  -4.365  -5.473
  241    HA   ALA  67           HA       ALA  67  -3.540  -2.467  -3.557
  242   1HB   ALA  67          HB1       ALA  67  -2.044  -1.368  -4.825
  243   2HB   ALA  67          HB2       ALA  67  -3.207  -1.137  -6.129
  244   3HB   ALA  67          HB3       ALA  67  -2.270  -2.629  -6.036
  245    H    LYS  68           HN       LYS  68  -5.517  -2.603  -6.522
  246    HA   LYS  68           HA       LYS  68  -7.043  -0.328  -6.254
  247   1HB   LYS  68          HB2       LYS  68  -7.219  -2.314  -7.951
  248   2HB   LYS  68          HB1       LYS  68  -8.393  -2.953  -6.810
  249   1HG   LYS  68          HG2       LYS  68  -9.877  -1.789  -8.001
  250   2HG   LYS  68          HG1       LYS  68  -9.269  -0.396  -7.103
  251   1HD   LYS  68          HD2       LYS  68  -8.961   0.441  -9.182
  252   2HD   LYS  68          HD1       LYS  68  -7.459  -0.481  -9.087
  253   1HE   LYS  68          HE2       LYS  68  -8.139  -1.984 -10.620
  254   2HE   LYS  68          HE1       LYS  68  -9.796  -2.001 -10.018
  255   1HZ   LYS  68          HZ1       LYS  68  -8.579  -0.318 -12.068
  256   2HZ   LYS  68          HZ2       LYS  68  -9.756   0.400 -11.089
  257   3HZ   LYS  68          HZ3       LYS  68 -10.134  -0.978 -11.993
  258    H    TYR  69           HN       TYR  69  -7.518  -3.423  -4.593
  259    HA   TYR  69           HA       TYR  69  -9.733  -3.051  -3.092
  260   1HB   TYR  69          HB2       TYR  69  -7.250  -4.592  -2.658
  261   2HB   TYR  69          HB1       TYR  69  -8.252  -4.311  -1.247
  262    HD1  TYR  69           HD1      TYR  69  -8.320  -5.708  -4.687
  263    HD2  TYR  69           HD2      TYR  69 -10.178  -5.593  -0.864
  264    HE1  TYR  69           HE1      TYR  69  -9.780  -7.574  -5.348
  265    HE2  TYR  69           HE2      TYR  69 -11.642  -7.459  -1.511
  266    HH   TYR  69           HH       TYR  69 -12.535  -8.431  -3.682
  267    H    LEU  70           HN       LEU  70  -6.437  -2.184  -2.047
  268    HA   LEU  70           HA       LEU  70  -7.111  -1.001   0.358
  269   1HB   LEU  70          HB2       LEU  70  -4.809  -1.067  -1.182
  270   2HB   LEU  70          HB1       LEU  70  -5.170   0.645  -1.060
  271    HG   LEU  70           HG       LEU  70  -5.284   0.400   1.419
  272   1HD1  LEU  70          HD11      LEU  70  -5.586  -2.229   0.992
  273   2HD1  LEU  70          HD12      LEU  70  -4.998  -1.549   2.509
  274   3HD1  LEU  70          HD13      LEU  70  -3.854  -2.175   1.321
  275   1HD2  LEU  70          HD21      LEU  70  -3.165   1.051   1.439
  276   2HD2  LEU  70          HD22      LEU  70  -3.015   0.505  -0.230
  277   3HD2  LEU  70          HD23      LEU  70  -2.612  -0.587   1.093
  278    H    LEU  71           HN       LEU  71  -7.157   0.451  -2.856
  279    HA   LEU  71           HA       LEU  71  -8.111   2.991  -2.140
  280   1HB   LEU  71          HB2       LEU  71  -7.496   3.030  -4.336
  281   2HB   LEU  71          HB1       LEU  71  -8.016   1.386  -4.631
  282    HG   LEU  71           HG       LEU  71 -10.044   3.569  -4.279
  283   1HD1  LEU  71          HD11      LEU  71  -9.027   4.608  -6.011
  284   2HD1  LEU  71          HD12      LEU  71  -9.925   3.408  -6.939
  285   3HD1  LEU  71          HD13      LEU  71  -8.222   3.141  -6.566
  286   1HD2  LEU  71          HD21      LEU  71  -9.997   0.775  -5.170
  287   2HD2  LEU  71          HD22      LEU  71 -10.947   1.857  -6.186
  288   3HD2  LEU  71          HD23      LEU  71 -11.307   1.722  -4.466
  289    H    LYS  72           HN       LYS  72  -9.782  -0.017  -3.074
  290    HA   LYS  72           HA       LYS  72 -12.412   0.829  -2.931
  291   1HB   LYS  72          HB2       LYS  72 -11.430  -1.507  -3.480
  292   2HB   LYS  72          HB1       LYS  72 -11.555  -1.803  -1.751
  293   1HG   LYS  72          HG2       LYS  72 -13.918  -1.535  -1.795
  294   2HG   LYS  72          HG1       LYS  72 -13.878  -0.942  -3.456
  295   1HD   LYS  72          HD2       LYS  72 -12.697  -3.299  -3.842
  296   2HD   LYS  72          HD1       LYS  72 -13.651  -3.711  -2.415
  297   1HE   LYS  72          HE2       LYS  72 -14.645  -2.660  -5.057
  298   2HE   LYS  72          HE1       LYS  72 -14.955  -4.243  -4.342
  299   1HZ   LYS  72          HZ1       LYS  72 -16.185  -3.144  -2.563
  300   2HZ   LYS  72          HZ2       LYS  72 -16.855  -2.791  -4.075
  301   3HZ   LYS  72          HZ3       LYS  72 -15.908  -1.637  -3.280
  302    H    GLU  73           HN       GLU  73 -10.311  -0.301  -0.326
  303    HA   GLU  73           HA       GLU  73 -12.212   0.030   1.754
  304   1HB   GLU  73          HB2       GLU  73  -9.197  -0.119   1.794
  305   2HB   GLU  73          HB1       GLU  73 -10.187  -0.074   3.247
  306   1HG   GLU  73          HG2       GLU  73 -10.383  -2.179   1.107
  307   2HG   GLU  73          HG1       GLU  73  -9.469  -2.346   2.605
  308    H    THR  74           HN       THR  74  -9.485   2.066   0.688
  309    HA   THR  74           HA       THR  74  -9.921   4.125   2.565
  310    HB   THR  74           HB       THR  74  -8.644   4.436  -0.153
  311    HG1  THR  74           HG1      THR  74  -7.633   3.328   2.239
  312   1HG2  THR  74          HG21      THR  74  -7.343   6.158   0.784
  313   2HG2  THR  74          HG22      THR  74  -7.893   5.785   2.418
  314   3HG2  THR  74          HG23      THR  74  -9.011   6.491   1.250
  315    H    GLY  75           HN       GLY  75 -10.417   4.415  -0.965
  316   1HA   GLY  75          HA2       GLY  75 -12.730   4.971  -1.702
  317   2HA   GLY  75          HA1       GLY  75 -12.771   6.095  -0.354
  318    H    SER  76           HN       SER  76 -10.061   7.072  -0.750
  319    HA   SER  76           HA       SER  76 -10.622   9.172  -2.531
  320   1HB   SER  76          HB2       SER  76  -7.865   9.191  -2.272
  321   2HB   SER  76          HB1       SER  76  -9.010   9.998  -1.203
  322    HG   SER  76           HG       SER  76  -8.683   8.527   0.285
  323    H    ALA  77           HN       ALA  77  -7.545   7.527  -3.087
  324    HA   ALA  77           HA       ALA  77  -8.440   6.424  -5.617
  325   1HB   ALA  77          HB1       ALA  77  -7.982   8.911  -5.991
  326   2HB   ALA  77          HB2       ALA  77  -7.190   7.770  -7.077
  327   3HB   ALA  77          HB3       ALA  77  -6.281   8.507  -5.759
  328    H    GLY  78           HN       GLY  78  -7.080   4.751  -6.312
  329   1HA   GLY  78          HA2       GLY  78  -4.563   4.474  -4.791
  330   2HA   GLY  78          HA1       GLY  78  -5.666   3.123  -4.955
  331    H    ASN  79           HN       ASN  79  -2.847   3.509  -5.743
  332    HA   ASN  79           HA       ASN  79  -3.083   2.759  -8.589
  333   1HB   ASN  79          HB2       ASN  79  -1.259   4.708  -7.225
  334   2HB   ASN  79          HB1       ASN  79  -0.664   3.821  -8.626
  335   1HD2  ASN  79          HD21      ASN  79  -0.751   6.465  -8.834
  336   2HD2  ASN  79          HD22      ASN  79  -2.046   6.975  -9.857
  337    H    LEU  80           HN       LEU  80  -1.910   0.968  -9.193
  338    HA   LEU  80           HA       LEU  80  -0.235  -0.334  -7.121
  339   1HB   LEU  80          HB2       LEU  80  -0.752  -2.424  -8.312
  340   2HB   LEU  80          HB1       LEU  80  -2.214  -1.617  -7.778
  341    HG   LEU  80           HG       LEU  80  -1.685  -0.675 -10.388
  342   1HD1  LEU  80          HD11      LEU  80  -2.053  -3.186 -11.322
  343   2HD1  LEU  80          HD12      LEU  80  -0.922  -3.480 -10.003
  344   3HD1  LEU  80          HD13      LEU  80  -0.502  -2.350 -11.288
  345   1HD2  LEU  80          HD21      LEU  80  -3.732  -2.762  -9.889
  346   2HD2  LEU  80          HD22      LEU  80  -3.863  -1.229 -10.744
  347   3HD2  LEU  80          HD23      LEU  80  -3.843  -1.257  -8.981
  348    H    GLU  81           HN       GLU  81   1.938  -0.771  -7.670
  349    HA   GLU  81           HA       GLU  81   2.642  -0.409 -10.529
  350   1HB   GLU  81          HB2       GLU  81   3.614   1.030  -8.148
  351   2HB   GLU  81          HB1       GLU  81   4.891   0.423  -9.193
  352   1HG   GLU  81          HG2       GLU  81   4.114   1.677 -11.033
  353   2HG   GLU  81          HG1       GLU  81   2.596   2.060 -10.223
  354    H    GLY  82           HN       GLY  82   4.064  -1.960 -11.308
  355   1HA   GLY  82          HA2       GLY  82   5.168  -3.988 -11.313
  356   2HA   GLY  82          HA1       GLY  82   6.122  -3.195 -10.082
  357    H    GLY  83           HN       GLY  83   5.111  -3.420  -7.744
  358   1HA   GLY  83          HA2       GLY  83   3.558  -5.835  -7.319
  359   2HA   GLY  83          HA1       GLY  83   5.249  -6.002  -6.938
  360    H    ARG  84           HN       ARG  84   4.231  -2.993  -6.368
  361    HA   ARG  84           HA       ARG  84   3.945  -3.298  -3.491
  362   1HB   ARG  84          HB2       ARG  84   4.519  -0.805  -3.599
  363   2HB   ARG  84          HB1       ARG  84   5.819  -1.893  -4.065
  364   1HG   ARG  84          HG2       ARG  84   4.141  -1.012  -6.294
  365   2HG   ARG  84          HG1       ARG  84   5.010   0.287  -5.476
  366   1HD   ARG  84          HD2       ARG  84   7.104  -0.989  -5.742
  367   2HD   ARG  84          HD1       ARG  84   6.216  -2.226  -6.627
  368    HE   ARG  84           HE       ARG  84   6.219  -0.867  -8.472
  369   1HH1  ARG  84          HH11      ARG  84   7.136   1.008  -5.676
  370   2HH1  ARG  84          HH12      ARG  84   7.586   2.400  -6.601
  371   1HH2  ARG  84          HH21      ARG  84   6.813   0.964  -9.692
  372   2HH2  ARG  84          HH22      ARG  84   7.403   2.375  -8.880
  373    H    LEU  85           HN       LEU  85   2.228  -2.314  -2.601
  374    HA   LEU  85           HA       LEU  85  -0.048  -1.614  -4.427
  375   1HB   LEU  85          HB2       LEU  85  -1.243  -2.912  -3.076
  376   2HB   LEU  85          HB1       LEU  85   0.222  -3.341  -2.225
  377    HG   LEU  85           HG       LEU  85  -0.507  -0.959  -1.026
  378   1HD1  LEU  85          HD11      LEU  85  -2.627  -0.621  -1.680
  379   2HD1  LEU  85          HD12      LEU  85  -2.970  -1.824  -0.436
  380   3HD1  LEU  85          HD13      LEU  85  -2.870  -2.305  -2.123
  381   1HD2  LEU  85          HD21      LEU  85  -0.687  -3.843  -0.363
  382   2HD2  LEU  85          HD22      LEU  85  -1.508  -2.700   0.700
  383   3HD2  LEU  85          HD23      LEU  85   0.226  -2.557   0.423
  384    H    ILE  86           HN       ILE  86  -0.836   0.512  -4.273
  385    HA   ILE  86           HA       ILE  86   0.286   2.218  -2.126
  386    HB   ILE  86           HB       ILE  86  -0.336   3.074  -4.952
  387   1HG1  ILE  86          HG12      ILE  86   2.465   3.159  -4.226
  388   2HG1  ILE  86          HG11      ILE  86   1.831   1.522  -4.098
  389   1HG2  ILE  86          HG21      ILE  86   0.495   5.157  -4.437
  390   2HG2  ILE  86          HG22      ILE  86   1.394   4.570  -3.040
  391   3HG2  ILE  86          HG23      ILE  86  -0.361   4.720  -2.960
  392   1HD1  ILE  86          HD11      ILE  86   1.296   1.427  -6.356
  393   2HD1  ILE  86          HD12      ILE  86   2.847   2.267  -6.321
  394   3HD1  ILE  86          HD13      ILE  86   1.354   3.180  -6.541
  395    H    LEU  87           HN       LEU  87  -1.084   3.555  -1.096
  396    HA   LEU  87           HA       LEU  87  -3.825   3.822  -2.133
  397   1HB   LEU  87          HB2       LEU  87  -4.719   3.673   0.077
  398   2HB   LEU  87          HB1       LEU  87  -3.704   2.277  -0.173
  399    HG   LEU  87           HG       LEU  87  -3.326   2.965   2.042
  400   1HD1  LEU  87          HD11      LEU  87  -1.008   4.292   0.707
  401   2HD1  LEU  87          HD12      LEU  87  -1.283   2.558   0.536
  402   3HD1  LEU  87          HD13      LEU  87  -1.041   3.259   2.134
  403   1HD2  LEU  87          HD21      LEU  87  -4.003   5.512   1.115
  404   2HD2  LEU  87          HD22      LEU  87  -2.357   5.651   1.735
  405   3HD2  LEU  87          HD23      LEU  87  -3.640   5.029   2.771
  406    H    GLN  88           HN       GLN  88  -4.563   5.850  -2.156
  407    HA   GLN  88           HA       GLN  88  -2.896   7.927  -0.903
  408   1HB   GLN  88          HB2       GLN  88  -2.637   8.001  -3.331
  409   2HB   GLN  88          HB1       GLN  88  -4.382   8.088  -3.531
  410   1HG   GLN  88          HG2       GLN  88  -3.871  10.202  -1.866
  411   2HG   GLN  88          HG1       GLN  88  -2.457  10.185  -2.918
  412   1HE2  GLN  88          HE21      GLN  88  -2.929  11.986  -4.080
  413   2HE2  GLN  88          HE22      GLN  88  -4.287  12.118  -5.139
  414    H    ARG  89           HN       ARG  89  -3.953   8.520   0.831
  415    HA   ARG  89           HA       ARG  89  -6.789   8.447   1.086
  416   1HB   ARG  89          HB2       ARG  89  -4.499   9.251   2.744
  417   2HB   ARG  89          HB1       ARG  89  -5.971  10.155   3.067
  418   1HG   ARG  89          HG2       ARG  89  -6.356   8.457   4.488
  419   2HG   ARG  89          HG1       ARG  89  -6.974   7.669   3.035
  420   1HD   ARG  89          HD2       ARG  89  -4.394   7.014   2.809
  421   2HD   ARG  89          HD1       ARG  89  -4.485   7.173   4.563
  422    HE   ARG  89           HE       ARG  89  -5.670   5.113   2.940
  423   1HH1  ARG  89          HH11      ARG  89  -5.813   6.797   5.994
  424   2HH1  ARG  89          HH12      ARG  89  -6.612   5.498   6.815
  425   1HH2  ARG  89          HH21      ARG  89  -6.724   3.406   4.018
  426   2HH2  ARG  89          HH22      ARG  89  -7.131   3.574   5.693
  427    H    ARG  90           HN       ARG  90  -8.177  10.321   1.530
  428    HA   ARG  90           HA       ARG  90  -8.255  12.161  -0.525
  429   1HB   ARG  90          HB2       ARG  90 -10.005  11.537   1.333
  430   2HB   ARG  90          HB1       ARG  90  -9.320  12.924   2.168
  431   1HG   ARG  90          HG2       ARG  90 -10.603  14.277   0.981
  432   2HG   ARG  90          HG1       ARG  90  -9.844  13.703  -0.506
  433   1HD   ARG  90          HD2       ARG  90 -11.530  12.232  -0.963
  434   2HD   ARG  90          HD1       ARG  90 -11.929  11.992   0.737
  435    HE   ARG  90           HE       ARG  90 -13.491  13.634   0.530
  436   1HH1  ARG  90          HH11      ARG  90 -11.124  14.066  -1.999
  437   2HH1  ARG  90          HH12      ARG  90 -11.977  15.377  -2.744
  438   1HH2  ARG  90          HH21      ARG  90 -14.613  15.357  -0.450
  439   2HH2  ARG  90          HH22      ARG  90 -13.957  16.110  -1.865
  Start of MODEL    4
    1    H    GLU  39           HN       GLU  39   6.521   1.941   6.695
    2    HA   GLU  39           HA       GLU  39   7.002  -0.090   4.699
    3   1HB   GLU  39          HB2       GLU  39   5.785  -1.116   6.782
    4   2HB   GLU  39          HB1       GLU  39   4.376  -0.295   6.124
    5   1HG   GLU  39          HG2       GLU  39   4.323  -1.615   4.230
    6   2HG   GLU  39          HG1       GLU  39   6.018  -2.077   4.382
    7    H    ILE  40           HN       ILE  40   4.623   2.160   6.069
    8    HA   ILE  40           HA       ILE  40   3.812   2.889   3.325
    9    HB   ILE  40           HB       ILE  40   2.310   3.522   5.868
   10   1HG1  ILE  40          HG12      ILE  40   1.078   1.409   4.359
   11   2HG1  ILE  40          HG11      ILE  40   2.725   0.944   4.769
   12   1HG2  ILE  40          HG21      ILE  40   1.840   3.846   2.979
   13   2HG2  ILE  40          HG22      ILE  40   1.280   4.818   4.341
   14   3HG2  ILE  40          HG23      ILE  40   0.458   3.311   3.934
   15   1HD1  ILE  40          HD11      ILE  40   2.313   1.051   7.053
   16   2HD1  ILE  40          HD12      ILE  40   0.847   0.329   6.388
   17   3HD1  ILE  40          HD13      ILE  40   0.864   2.034   6.841
   18    H    LEU  41           HN       LEU  41   4.174   4.948   2.630
   19    HA   LEU  41           HA       LEU  41   4.926   7.007   4.613
   20   1HB   LEU  41          HB2       LEU  41   6.466   5.912   2.363
   21   2HB   LEU  41          HB1       LEU  41   6.353   7.663   2.350
   22    HG   LEU  41           HG       LEU  41   7.271   6.143   4.781
   23   1HD1  LEU  41          HD11      LEU  41   9.556   7.136   3.791
   24   2HD1  LEU  41          HD12      LEU  41   8.718   6.759   2.284
   25   3HD1  LEU  41          HD13      LEU  41   8.998   5.492   3.480
   26   1HD2  LEU  41          HD21      LEU  41   6.484   8.639   4.716
   27   2HD2  LEU  41          HD22      LEU  41   8.082   8.909   4.022
   28   3HD2  LEU  41          HD23      LEU  41   7.927   8.179   5.620
   29    H    ILE  42           HN       ILE  42   3.908   8.967   4.262
   30    HA   ILE  42           HA       ILE  42   2.509   9.231   1.676
   31    HB   ILE  42           HB       ILE  42   0.951   8.903   3.544
   32   1HG1  ILE  42          HG12      ILE  42   0.800  11.779   2.637
   33   2HG1  ILE  42          HG11      ILE  42   0.461  10.428   1.560
   34   1HG2  ILE  42          HG21      ILE  42   1.425  11.530   4.750
   35   2HG2  ILE  42          HG22      ILE  42   2.709  10.355   5.029
   36   3HG2  ILE  42          HG23      ILE  42   1.054   9.982   5.507
   37   1HD1  ILE  42          HD11      ILE  42  -1.345  11.731   3.176
   38   2HD1  ILE  42          HD12      ILE  42  -1.007  10.237   4.050
   39   3HD1  ILE  42          HD13      ILE  42  -1.583  10.174   2.384
   40    H    GLU  43           HN       GLU  43   2.900  10.948   0.501
   41    HA   GLU  43           HA       GLU  43   4.111  13.355   1.700
   42   1HB   GLU  43          HB2       GLU  43   5.069  11.613  -0.520
   43   2HB   GLU  43          HB1       GLU  43   5.186  13.347  -0.787
   44   1HG   GLU  43          HG2       GLU  43   6.932  13.545   0.572
   45   2HG   GLU  43          HG1       GLU  43   6.178  12.556   1.823
   46    H    GLY  44           HN       GLY  44   3.160  15.251   0.917
   47   1HA   GLY  44          HA2       GLY  44   1.681  16.583  -0.240
   48   2HA   GLY  44          HA1       GLY  44   1.989  15.529  -1.611
   49    H    ASN  45           HN       ASN  45   0.524  13.855  -2.097
   50    HA   ASN  45           HA       ASN  45  -1.838  13.604  -0.383
   51   1HB   ASN  45          HB2       ASN  45  -2.095  14.135  -3.343
   52   2HB   ASN  45          HB1       ASN  45  -3.394  14.019  -2.159
   53   1HD2  ASN  45          HD21      ASN  45  -0.597  15.918  -3.126
   54   2HD2  ASN  45          HD22      ASN  45  -1.156  17.415  -2.469
   55    H    ARG  46           HN       ARG  46   0.527  12.004  -1.920
   56    HA   ARG  46           HA       ARG  46  -1.155   9.626  -2.424
   57   1HB   ARG  46          HB2       ARG  46   0.560   8.987  -4.116
   58   2HB   ARG  46          HB1       ARG  46  -0.283  10.475  -4.526
   59   1HG   ARG  46          HG2       ARG  46   2.111  10.989  -2.982
   60   2HG   ARG  46          HG1       ARG  46   2.456  10.083  -4.457
   61   1HD   ARG  46          HD2       ARG  46   1.033  11.812  -5.663
   62   2HD   ARG  46          HD1       ARG  46   1.117  12.761  -4.180
   63    HE   ARG  46           HE       ARG  46   3.680  11.918  -5.187
   64   1HH1  ARG  46          HH11      ARG  46   1.212  14.382  -5.314
   65   2HH1  ARG  46          HH12      ARG  46   2.296  15.616  -5.860
   66   1HH2  ARG  46          HH21      ARG  46   5.107  13.540  -5.908
   67   2HH2  ARG  46          HH22      ARG  46   4.507  15.139  -6.199
   68    H    THR  47           HN       THR  47  -0.480   7.733  -1.431
   69    HA   THR  47           HA       THR  47   2.094   7.843   0.024
   70    HB   THR  47           HB       THR  47  -0.445   6.423   0.851
   71    HG1  THR  47           HG1      THR  47  -0.869   8.508   1.228
   72   1HG2  THR  47          HG21      THR  47   1.613   7.020   2.841
   73   2HG2  THR  47          HG22      THR  47   2.021   5.768   1.667
   74   3HG2  THR  47          HG23      THR  47   0.570   5.612   2.656
   75    H    ILE  48           HN       ILE  48   3.411   6.098  -0.246
   76    HA   ILE  48           HA       ILE  48   2.403   3.862  -1.906
   77    HB   ILE  48           HB       ILE  48   4.831   3.563  -2.522
   78   1HG1  ILE  48          HG12      ILE  48   5.500   6.344  -1.890
   79   2HG1  ILE  48          HG11      ILE  48   5.277   5.345  -0.458
   80   1HG2  ILE  48          HG21      ILE  48   4.731   5.980  -3.785
   81   2HG2  ILE  48          HG22      ILE  48   3.040   5.716  -3.361
   82   3HG2  ILE  48          HG23      ILE  48   3.907   4.517  -4.323
   83   1HD1  ILE  48          HD11      ILE  48   7.572   5.276  -1.012
   84   2HD1  ILE  48          HD12      ILE  48   7.223   4.935  -2.706
   85   3HD1  ILE  48          HD13      ILE  48   6.891   3.717  -1.476
   86    H    ILE  49           HN       ILE  49   2.695   1.781  -1.101
   87    HA   ILE  49           HA       ILE  49   4.368   1.549   1.299
   88    HB   ILE  49           HB       ILE  49   2.123   1.531   2.130
   89   1HG1  ILE  49          HG12      ILE  49   3.302  -1.252   2.026
   90   2HG1  ILE  49          HG11      ILE  49   3.658  -0.006   3.218
   91   1HG2  ILE  49          HG21      ILE  49   0.906   0.981   0.138
   92   2HG2  ILE  49          HG22      ILE  49   0.493  -0.179   1.401
   93   3HG2  ILE  49          HG23      ILE  49   1.608  -0.637   0.113
   94   1HD1  ILE  49          HD11      ILE  49   0.908  -0.305   3.342
   95   2HD1  ILE  49          HD12      ILE  49   2.096  -0.937   4.482
   96   3HD1  ILE  49          HD13      ILE  49   1.525  -1.946   3.153
   97    H    ARG  50           HN       ARG  50   5.795   0.062   1.243
   98    HA   ARG  50           HA       ARG  50   6.140  -1.584  -1.065
   99   1HB   ARG  50          HB2       ARG  50   7.841  -0.548   0.785
  100   2HB   ARG  50          HB1       ARG  50   7.725  -2.209   1.349
  101   1HG   ARG  50          HG2       ARG  50   9.208  -2.809  -0.176
  102   2HG   ARG  50          HG1       ARG  50   8.082  -2.323  -1.444
  103   1HD   ARG  50          HD2       ARG  50   9.624  -0.169  -0.120
  104   2HD   ARG  50          HD1       ARG  50  10.523  -1.261  -1.173
  105    HE   ARG  50           HE       ARG  50   8.177  -0.360  -2.468
  106   1HH1  ARG  50          HH11      ARG  50  11.349   0.727  -1.498
  107   2HH1  ARG  50          HH12      ARG  50  11.467   1.907  -2.760
  108   1HH2  ARG  50          HH21      ARG  50   8.332   1.191  -4.130
  109   2HH2  ARG  50          HH22      ARG  50   9.755   2.170  -4.254
  110    H    ASN  51           HN       ASN  51   3.865  -2.490  -0.592
  111    HA   ASN  51           HA       ASN  51   3.866  -4.639   1.348
  112   1HB   ASN  51          HB2       ASN  51   1.882  -3.014   0.566
  113   2HB   ASN  51          HB1       ASN  51   1.616  -4.342  -0.559
  114   1HD2  ASN  51          HD21      ASN  51   0.298  -5.857   0.116
  115   2HD2  ASN  51          HD22      ASN  51  -0.033  -6.265   1.762
  116    H    PHE  52           HN       PHE  52   5.610  -4.655  -1.051
  117    HA   PHE  52           HA       PHE  52   4.843  -6.217  -3.090
  118   1HB   PHE  52          HB2       PHE  52   7.170  -5.284  -2.710
  119   2HB   PHE  52          HB1       PHE  52   7.497  -6.752  -1.788
  120    HD1  PHE  52           HD1      PHE  52   9.331  -6.871  -3.660
  121    HD2  PHE  52           HD2      PHE  52   5.165  -7.425  -4.361
  122    HE1  PHE  52           HE1      PHE  52   9.832  -8.078  -5.748
  123    HE2  PHE  52           HE2      PHE  52   5.648  -8.625  -6.437
  124    HZ   PHE  52           HZ       PHE  52   7.997  -8.957  -7.138
  125    H    ARG  53           HN       ARG  53   5.807  -7.613   0.095
  126    HA   ARG  53           HA       ARG  53   5.856 -10.271  -0.586
  127   1HB   ARG  53          HB2       ARG  53   4.450 -10.468   1.735
  128   2HB   ARG  53          HB1       ARG  53   6.184 -10.202   1.649
  129   1HG   ARG  53          HG2       ARG  53   5.957  -7.899   2.077
  130   2HG   ARG  53          HG1       ARG  53   4.221  -7.931   1.769
  131   1HD   ARG  53          HD2       ARG  53   5.730  -9.029   4.123
  132   2HD   ARG  53          HD1       ARG  53   4.443  -7.824   4.111
  133    HE   ARG  53           HE       ARG  53   4.148 -10.688   4.086
  134   1HH1  ARG  53          HH11      ARG  53   2.624  -7.636   3.346
  135   2HH1  ARG  53          HH12      ARG  53   1.017  -8.273   3.442
  136   1HH2  ARG  53          HH21      ARG  53   2.036 -11.527   4.210
  137   2HH2  ARG  53          HH22      ARG  53   0.682 -10.481   3.933
  138    H    GLU  54           HN       GLU  54   2.897  -8.904   0.797
  139    HA   GLU  54           HA       GLU  54   1.102 -10.812  -0.073
  140   1HB   GLU  54          HB2       GLU  54   0.880  -8.549   1.392
  141   2HB   GLU  54          HB1       GLU  54   0.147  -8.004  -0.110
  142   1HG   GLU  54          HG2       GLU  54  -1.064 -10.419   0.267
  143   2HG   GLU  54          HG1       GLU  54  -0.863  -9.841   1.921
  144    H    LEU  55           HN       LEU  55   2.148  -7.832  -1.631
  145    HA   LEU  55           HA       LEU  55   0.589  -7.761  -3.866
  146   1HB   LEU  55          HB2       LEU  55   3.004  -6.577  -2.992
  147   2HB   LEU  55          HB1       LEU  55   3.269  -7.122  -4.635
  148    HG   LEU  55           HG       LEU  55   2.483  -4.740  -4.371
  149   1HD1  LEU  55          HD11      LEU  55   2.063  -6.520  -6.351
  150   2HD1  LEU  55          HD12      LEU  55   1.599  -4.820  -6.433
  151   3HD1  LEU  55          HD13      LEU  55   0.405  -6.041  -5.991
  152   1HD2  LEU  55          HD21      LEU  55   0.220  -4.278  -3.861
  153   2HD2  LEU  55          HD22      LEU  55   0.818  -5.317  -2.569
  154   3HD2  LEU  55          HD23      LEU  55  -0.202  -5.989  -3.841
  155    H    ALA  56           HN       ALA  56   3.654  -9.595  -3.564
  156    HA   ALA  56           HA       ALA  56   3.797 -10.595  -6.139
  157   1HB   ALA  56          HB1       ALA  56   5.014 -12.548  -5.024
  158   2HB   ALA  56          HB2       ALA  56   4.725 -11.699  -3.505
  159   3HB   ALA  56          HB3       ALA  56   5.677 -10.932  -4.777
  160    H    LYS  57           HN       LYS  57   2.394 -12.182  -3.253
  161    HA   LYS  57           HA       LYS  57   1.301 -14.396  -4.586
  162   1HB   LYS  57          HB2       LYS  57   0.886 -13.056  -2.024
  163   2HB   LYS  57          HB1       LYS  57  -0.605 -13.739  -2.656
  164   1HG   LYS  57          HG2       LYS  57   1.874 -15.398  -2.585
  165   2HG   LYS  57          HG1       LYS  57   0.924 -15.160  -1.117
  166   1HD   LYS  57          HD2       LYS  57  -1.029 -16.091  -2.164
  167   2HD   LYS  57          HD1       LYS  57  -0.204 -16.178  -3.722
  168   1HE   LYS  57          HE2       LYS  57   1.443 -17.738  -2.660
  169   2HE   LYS  57          HE1       LYS  57   0.412 -17.756  -1.231
  170   1HZ   LYS  57          HZ1       LYS  57   0.027 -19.031  -3.810
  171   2HZ   LYS  57          HZ2       LYS  57  -1.358 -18.341  -3.128
  172   3HZ   LYS  57          HZ3       LYS  57  -0.492 -19.514  -2.273
  173    H    ALA  58           HN       ALA  58  -0.043 -11.233  -3.910
  174    HA   ALA  58           HA       ALA  58  -2.522 -11.422  -5.057
  175   1HB   ALA  58          HB1       ALA  58  -1.536  -9.495  -3.749
  176   2HB   ALA  58          HB2       ALA  58  -2.568  -9.070  -5.115
  177   3HB   ALA  58          HB3       ALA  58  -0.815  -8.960  -5.267
  178    H    VAL  59           HN       VAL  59   0.527 -10.471  -6.750
  179    HA   VAL  59           HA       VAL  59  -0.635  -9.940  -9.164
  180    HB   VAL  59           HB       VAL  59   1.414  -9.368  -9.596
  181   1HG1  VAL  59          HG11      VAL  59   3.310  -9.904  -8.413
  182   2HG1  VAL  59          HG12      VAL  59   2.836 -11.586  -8.198
  183   3HG1  VAL  59          HG13      VAL  59   2.065 -10.324  -7.246
  184   1HG2  VAL  59          HG21      VAL  59   1.950 -12.267 -10.209
  185   2HG2  VAL  59          HG22      VAL  59   2.689 -10.852 -10.958
  186   3HG2  VAL  59          HG23      VAL  59   0.980 -11.200 -11.225
  187    H    ASN  60           HN       ASN  60   0.489 -13.119  -8.068
  188    HA   ASN  60           HA       ASN  60  -0.182 -14.577 -10.322
  189   1HB   ASN  60          HB2       ASN  60  -0.557 -15.340  -7.415
  190   2HB   ASN  60          HB1       ASN  60  -0.648 -16.474  -8.759
  191   1HD2  ASN  60          HD21      ASN  60   1.181 -17.282  -9.605
  192   2HD2  ASN  60          HD22      ASN  60   2.771 -16.878  -9.063
  193    H    ARG  61           HN       ARG  61  -2.242 -13.157  -7.861
  194    HA   ARG  61           HA       ARG  61  -4.605 -14.090  -9.386
  195   1HB   ARG  61          HB2       ARG  61  -4.033 -14.227  -6.606
  196   2HB   ARG  61          HB1       ARG  61  -5.360 -13.093  -6.816
  197   1HG   ARG  61          HG2       ARG  61  -6.489 -15.070  -6.580
  198   2HG   ARG  61          HG1       ARG  61  -6.346 -14.969  -8.337
  199   1HD   ARG  61          HD2       ARG  61  -4.148 -16.301  -7.974
  200   2HD   ARG  61          HD1       ARG  61  -4.851 -16.702  -6.408
  201    HE   ARG  61           HE       ARG  61  -6.343 -18.089  -7.463
  202   1HH1  ARG  61          HH11      ARG  61  -4.790 -16.061  -9.842
  203   2HH1  ARG  61          HH12      ARG  61  -5.440 -16.931 -11.191
  204   1HH2  ARG  61          HH21      ARG  61  -7.200 -19.234  -9.237
  205   2HH2  ARG  61          HH22      ARG  61  -6.808 -18.731 -10.847
  206    H    ASP  62           HN       ASP  62  -2.976 -11.716  -9.959
  207    HA   ASP  62           HA       ASP  62  -3.496  -9.649 -10.892
  208   1HB   ASP  62          HB2       ASP  62  -6.014  -9.547  -9.232
  209   2HB   ASP  62          HB1       ASP  62  -5.627  -8.629 -10.683
  210    H    GLU  63           HN       GLU  63  -1.629  -9.281  -9.630
  211    HA   GLU  63           HA       GLU  63  -1.520  -8.331  -6.986
  212   1HB   GLU  63          HB2       GLU  63   0.428  -6.912  -7.776
  213   2HB   GLU  63          HB1       GLU  63   0.588  -8.627  -8.072
  214   1HG   GLU  63          HG2       GLU  63  -0.039  -8.295 -10.405
  215   2HG   GLU  63          HG1       GLU  63  -0.281  -6.577 -10.102
  216    H    GLU  64           HN       GLU  64  -2.082  -6.853 -10.048
  217    HA   GLU  64           HA       GLU  64  -2.325  -4.186  -9.308
  218   1HB   GLU  64          HB2       GLU  64  -3.858  -3.960 -11.290
  219   2HB   GLU  64          HB1       GLU  64  -2.331  -4.758 -11.637
  220   1HG   GLU  64          HG2       GLU  64  -3.533  -6.945 -11.380
  221   2HG   GLU  64          HG1       GLU  64  -5.035  -6.024 -11.314
  222    H    PHE  65           HN       PHE  65  -4.781  -6.689  -9.454
  223    HA   PHE  65           HA       PHE  65  -6.999  -5.293  -8.617
  224   1HB   PHE  65          HB2       PHE  65  -6.911  -7.690  -9.400
  225   2HB   PHE  65          HB1       PHE  65  -6.354  -8.126  -7.788
  226    HD1  PHE  65           HD1      PHE  65  -8.994  -5.767  -8.956
  227    HD2  PHE  65           HD2      PHE  65  -8.042  -9.261  -6.719
  228    HE1  PHE  65           HE1      PHE  65 -11.328  -5.909  -8.190
  229    HE2  PHE  65           HE2      PHE  65 -10.374  -9.409  -5.950
  230    HZ   PHE  65           HZ       PHE  65 -12.021  -7.731  -6.685
  231    H    PHE  66           HN       PHE  66  -4.557  -6.964  -6.566
  232    HA   PHE  66           HA       PHE  66  -5.843  -6.457  -4.185
  233   1HB   PHE  66          HB2       PHE  66  -3.995  -7.888  -3.892
  234   2HB   PHE  66          HB1       PHE  66  -2.862  -6.689  -4.576
  235    HD1  PHE  66           HD1      PHE  66  -1.888  -5.076  -3.182
  236    HD2  PHE  66           HD2      PHE  66  -5.387  -7.139  -1.933
  237    HE1  PHE  66           HE1      PHE  66  -1.969  -3.726  -1.140
  238    HE2  PHE  66           HE2      PHE  66  -5.450  -5.817   0.127
  239    HZ   PHE  66           HZ       PHE  66  -3.784  -4.068   0.472
  240    H    ALA  67           HN       ALA  67  -3.068  -4.339  -5.371
  241    HA   ALA  67           HA       ALA  67  -3.194  -2.499  -3.393
  242   1HB   ALA  67          HB1       ALA  67  -1.689  -1.656  -4.849
  243   2HB   ALA  67          HB2       ALA  67  -3.052  -0.835  -5.609
  244   3HB   ALA  67          HB3       ALA  67  -2.494  -2.387  -6.238
  245    H    LYS  68           HN       LYS  68  -5.401  -2.721  -6.179
  246    HA   LYS  68           HA       LYS  68  -7.066  -0.577  -5.745
  247   1HB   LYS  68          HB2       LYS  68  -7.198  -2.739  -7.358
  248   2HB   LYS  68          HB1       LYS  68  -8.432  -3.178  -6.185
  249   1HG   LYS  68          HG2       LYS  68  -9.827  -1.480  -6.807
  250   2HG   LYS  68          HG1       LYS  68  -8.507  -0.451  -7.366
  251   1HD   LYS  68          HD2       LYS  68  -8.479  -1.383  -9.433
  252   2HD   LYS  68          HD1       LYS  68  -8.913  -2.985  -8.834
  253   1HE   LYS  68          HE2       LYS  68 -11.123  -2.618  -9.080
  254   2HE   LYS  68          HE1       LYS  68 -11.005  -0.936  -8.564
  255   1HZ   LYS  68          HZ1       LYS  68 -10.731  -0.218 -10.666
  256   2HZ   LYS  68          HZ2       LYS  68 -11.511  -1.665 -11.064
  257   3HZ   LYS  68          HZ3       LYS  68  -9.825  -1.564 -11.144
  258    H    TYR  69           HN       TYR  69  -7.178  -3.731  -4.104
  259    HA   TYR  69           HA       TYR  69  -9.281  -3.494  -2.412
  260   1HB   TYR  69          HB2       TYR  69  -6.708  -4.937  -2.228
  261   2HB   TYR  69          HB1       TYR  69  -7.561  -4.680  -0.714
  262    HD1  TYR  69           HD1      TYR  69  -7.026  -7.154  -2.872
  263    HD2  TYR  69           HD2      TYR  69 -10.342  -4.958  -1.369
  264    HE1  TYR  69           HE1      TYR  69  -8.498  -9.061  -3.355
  265    HE2  TYR  69           HE2      TYR  69 -11.825  -6.859  -1.847
  266    HH   TYR  69           HH       TYR  69 -10.994  -9.797  -2.202
  267    H    LEU  70           HN       LEU  70  -5.985  -2.328  -1.801
  268    HA   LEU  70           HA       LEU  70  -6.385  -1.199   0.698
  269   1HB   LEU  70          HB2       LEU  70  -4.385  -1.044  -1.187
  270   2HB   LEU  70          HB1       LEU  70  -4.954   0.613  -1.109
  271    HG   LEU  70           HG       LEU  70  -3.147   0.423   0.433
  272   1HD1  LEU  70          HD11      LEU  70  -5.797   1.012   1.298
  273   2HD1  LEU  70          HD12      LEU  70  -4.273   1.714   1.832
  274   3HD1  LEU  70          HD13      LEU  70  -4.908   0.277   2.631
  275   1HD2  LEU  70          HD21      LEU  70  -2.679  -1.362   1.716
  276   2HD2  LEU  70          HD22      LEU  70  -3.768  -2.202   0.613
  277   3HD2  LEU  70          HD23      LEU  70  -4.366  -1.615   2.164
  278    H    LEU  71           HN       LEU  71  -7.083   0.140  -2.472
  279    HA   LEU  71           HA       LEU  71  -8.233   2.575  -1.681
  280   1HB   LEU  71          HB2       LEU  71  -7.595   1.728  -4.049
  281   2HB   LEU  71          HB1       LEU  71  -9.189   0.999  -4.056
  282    HG   LEU  71           HG       LEU  71  -8.541   3.936  -3.876
  283   1HD1  LEU  71          HD11      LEU  71  -9.472   4.128  -6.009
  284   2HD1  LEU  71          HD12      LEU  71 -10.231   2.538  -5.920
  285   3HD1  LEU  71          HD13      LEU  71  -8.482   2.671  -6.099
  286   1HD2  LEU  71          HD21      LEU  71 -11.098   4.117  -4.036
  287   2HD2  LEU  71          HD22      LEU  71 -10.387   3.742  -2.466
  288   3HD2  LEU  71          HD23      LEU  71 -11.111   2.459  -3.435
  289    H    LYS  72           HN       LYS  72  -9.662  -0.626  -2.374
  290    HA   LYS  72           HA       LYS  72 -12.330  -0.042  -1.908
  291   1HB   LYS  72          HB2       LYS  72 -10.750  -2.530  -1.235
  292   2HB   LYS  72          HB1       LYS  72 -12.496  -2.431  -1.074
  293   1HG   LYS  72          HG2       LYS  72 -11.440  -1.607  -3.687
  294   2HG   LYS  72          HG1       LYS  72 -11.209  -3.308  -3.279
  295   1HD   LYS  72          HD2       LYS  72 -13.801  -2.893  -2.523
  296   2HD   LYS  72          HD1       LYS  72 -13.660  -1.839  -3.931
  297   1HE   LYS  72          HE2       LYS  72 -12.876  -4.750  -3.887
  298   2HE   LYS  72          HE1       LYS  72 -14.425  -4.142  -4.472
  299   1HZ   LYS  72          HZ1       LYS  72 -12.821  -4.521  -6.265
  300   2HZ   LYS  72          HZ2       LYS  72 -11.776  -3.381  -5.580
  301   3HZ   LYS  72          HZ3       LYS  72 -13.285  -2.897  -6.171
  302    H    GLU  73           HN       GLU  73  -9.815  -0.913   0.415
  303    HA   GLU  73           HA       GLU  73 -11.349  -0.903   2.743
  304   1HB   GLU  73          HB2       GLU  73  -8.608  -1.075   2.068
  305   2HB   GLU  73          HB1       GLU  73  -8.748   0.187   3.285
  306   1HG   GLU  73          HG2       GLU  73 -10.298  -2.186   3.934
  307   2HG   GLU  73          HG1       GLU  73  -8.575  -2.513   3.752
  308    H    THR  74           HN       THR  74  -9.356   1.786   1.469
  309    HA   THR  74           HA       THR  74 -10.425   3.646   3.363
  310    HB   THR  74           HB       THR  74  -8.822   4.141   0.847
  311    HG1  THR  74           HG1      THR  74  -8.084   3.701   3.539
  312   1HG2  THR  74          HG21      THR  74 -10.052   5.998   2.594
  313   2HG2  THR  74          HG22      THR  74  -8.962   6.306   1.241
  314   3HG2  THR  74          HG23      THR  74  -8.310   6.058   2.861
  315    H    GLY  75           HN       GLY  75 -10.505   3.875  -0.205
  316   1HA   GLY  75          HA2       GLY  75 -12.827   3.865  -1.185
  317   2HA   GLY  75          HA1       GLY  75 -13.214   5.026   0.073
  318    H    SER  76           HN       SER  76 -10.576   6.377  -0.237
  319    HA   SER  76           HA       SER  76 -11.345   8.386  -2.012
  320   1HB   SER  76          HB2       SER  76  -8.700   7.665  -0.770
  321   2HB   SER  76          HB1       SER  76  -8.838   9.021  -1.889
  322    HG   SER  76           HG       SER  76  -9.587  10.129  -0.285
  323    H    ALA  77           HN       ALA  77  -8.149   7.414  -2.845
  324    HA   ALA  77           HA       ALA  77  -9.076   6.200  -5.358
  325   1HB   ALA  77          HB1       ALA  77  -6.977   7.621  -6.272
  326   2HB   ALA  77          HB2       ALA  77  -7.575   8.723  -5.033
  327   3HB   ALA  77          HB3       ALA  77  -8.642   8.198  -6.335
  328    H    GLY  78           HN       GLY  78  -7.568   4.673  -6.253
  329   1HA   GLY  78          HA2       GLY  78  -5.235   4.185  -4.509
  330   2HA   GLY  78          HA1       GLY  78  -6.291   2.873  -4.975
  331    H    ASN  79           HN       ASN  79  -3.471   3.114  -5.369
  332    HA   ASN  79           HA       ASN  79  -3.331   2.927  -8.307
  333   1HB   ASN  79          HB2       ASN  79  -1.810   4.595  -6.428
  334   2HB   ASN  79          HB1       ASN  79  -0.781   3.633  -7.486
  335   1HD2  ASN  79          HD21      ASN  79  -0.351   6.057  -7.966
  336   2HD2  ASN  79          HD22      ASN  79  -1.215   6.692  -9.320
  337    H    LEU  80           HN       LEU  80  -2.261   1.136  -9.048
  338    HA   LEU  80           HA       LEU  80  -1.007  -0.664  -7.035
  339   1HB   LEU  80          HB2       LEU  80  -1.703  -2.496  -8.537
  340   2HB   LEU  80          HB1       LEU  80  -3.080  -1.571  -7.964
  341    HG   LEU  80           HG       LEU  80  -2.522  -0.296 -10.313
  342   1HD1  LEU  80          HD11      LEU  80  -2.495  -2.589 -11.769
  343   2HD1  LEU  80          HD12      LEU  80  -1.377  -2.983 -10.463
  344   3HD1  LEU  80          HD13      LEU  80  -1.093  -1.564 -11.469
  345   1HD2  LEU  80          HD21      LEU  80  -4.461  -1.474 -11.210
  346   2HD2  LEU  80          HD22      LEU  80  -4.722  -0.996  -9.533
  347   3HD2  LEU  80          HD23      LEU  80  -4.335  -2.670  -9.923
  348    H    GLU  81           HN       GLU  81   1.037  -1.397  -7.494
  349    HA   GLU  81           HA       GLU  81   2.166  -0.813 -10.168
  350   1HB   GLU  81          HB2       GLU  81   3.057   0.002  -7.465
  351   2HB   GLU  81          HB1       GLU  81   4.320  -0.691  -8.474
  352   1HG   GLU  81          HG2       GLU  81   2.589   1.417  -9.644
  353   2HG   GLU  81          HG1       GLU  81   3.808   1.891  -8.462
  354    H    GLY  82           HN       GLY  82   3.376  -2.569 -10.982
  355   1HA   GLY  82          HA2       GLY  82   2.945  -5.120  -9.951
  356   2HA   GLY  82          HA1       GLY  82   4.199  -4.708 -11.096
  357    H    GLY  83           HN       GLY  83   3.529  -4.639  -7.534
  358   1HA   GLY  83          HA2       GLY  83   5.332  -6.197  -6.506
  359   2HA   GLY  83          HA1       GLY  83   6.438  -4.981  -7.081
  360    H    ARG  84           HN       ARG  84   4.174  -3.147  -6.323
  361    HA   ARG  84           HA       ARG  84   4.446  -2.938  -3.435
  362   1HB   ARG  84          HB2       ARG  84   4.694  -0.445  -3.881
  363   2HB   ARG  84          HB1       ARG  84   6.079  -1.410  -4.371
  364   1HG   ARG  84          HG2       ARG  84   4.490  -1.334  -6.632
  365   2HG   ARG  84          HG1       ARG  84   4.345   0.285  -5.950
  366   1HD   ARG  84          HD2       ARG  84   6.209   0.509  -7.285
  367   2HD   ARG  84          HD1       ARG  84   6.934   0.123  -5.725
  368    HE   ARG  84           HE       ARG  84   6.665  -2.302  -6.866
  369   1HH1  ARG  84          HH11      ARG  84   8.051   0.693  -8.002
  370   2HH1  ARG  84          HH12      ARG  84   9.209  -0.086  -9.025
  371   1HH2  ARG  84          HH21      ARG  84   8.190  -3.328  -8.209
  372   2HH2  ARG  84          HH22      ARG  84   9.289  -2.369  -9.143
  373    H    LEU  85           HN       LEU  85   2.654  -2.060  -2.518
  374    HA   LEU  85           HA       LEU  85   0.227  -1.673  -4.277
  375   1HB   LEU  85          HB2       LEU  85  -0.768  -2.980  -2.742
  376   2HB   LEU  85          HB1       LEU  85   0.733  -3.130  -1.853
  377    HG   LEU  85           HG       LEU  85  -0.051  -0.794  -0.856
  378   1HD1  LEU  85          HD11      LEU  85  -2.223  -0.284  -0.975
  379   2HD1  LEU  85          HD12      LEU  85  -2.730  -1.972  -0.990
  380   3HD1  LEU  85          HD13      LEU  85  -2.145  -1.212  -2.468
  381   1HD2  LEU  85          HD21      LEU  85  -1.570  -2.547   0.656
  382   2HD2  LEU  85          HD22      LEU  85   0.131  -2.149   0.895
  383   3HD2  LEU  85          HD23      LEU  85  -0.319  -3.559  -0.065
  384    H    ILE  86           HN       ILE  86  -0.684   0.402  -4.193
  385    HA   ILE  86           HA       ILE  86   0.504   2.335  -2.290
  386    HB   ILE  86           HB       ILE  86  -0.445   2.880  -5.109
  387   1HG1  ILE  86          HG12      ILE  86   2.400   3.249  -4.561
  388   2HG1  ILE  86          HG11      ILE  86   1.885   1.575  -4.377
  389   1HG2  ILE  86          HG21      ILE  86   1.284   4.698  -3.489
  390   2HG2  ILE  86          HG22      ILE  86  -0.466   4.707  -3.272
  391   3HG2  ILE  86          HG23      ILE  86   0.229   5.073  -4.851
  392   1HD1  ILE  86          HD11      ILE  86   1.176   1.442  -6.609
  393   2HD1  ILE  86          HD12      ILE  86   2.730   2.274  -6.653
  394   3HD1  ILE  86          HD13      ILE  86   1.234   3.192  -6.816
  395    H    LEU  87           HN       LEU  87  -0.884   3.647  -1.210
  396    HA   LEU  87           HA       LEU  87  -3.742   3.500  -1.933
  397   1HB   LEU  87          HB2       LEU  87  -3.459   2.337   0.136
  398   2HB   LEU  87          HB1       LEU  87  -2.387   3.574   0.762
  399    HG   LEU  87           HG       LEU  87  -4.532   5.101   0.499
  400   1HD1  LEU  87          HD11      LEU  87  -6.451   4.079   0.081
  401   2HD1  LEU  87          HD12      LEU  87  -6.186   2.951   1.409
  402   3HD1  LEU  87          HD13      LEU  87  -5.562   2.582  -0.200
  403   1HD2  LEU  87          HD21      LEU  87  -3.514   3.379   2.641
  404   2HD2  LEU  87          HD22      LEU  87  -5.177   3.919   2.862
  405   3HD2  LEU  87          HD23      LEU  87  -3.888   5.102   2.647
  406    H    GLN  88           HN       GLN  88  -4.755   5.412  -2.157
  407    HA   GLN  88           HA       GLN  88  -3.215   7.841  -1.504
  408   1HB   GLN  88          HB2       GLN  88  -5.381   7.831  -3.578
  409   2HB   GLN  88          HB1       GLN  88  -4.030   8.940  -3.392
  410   1HG   GLN  88          HG2       GLN  88  -3.007   6.321  -3.859
  411   2HG   GLN  88          HG1       GLN  88  -4.230   6.688  -5.074
  412   1HE2  GLN  88          HE21      GLN  88  -2.761   6.854  -6.739
  413   2HE2  GLN  88          HE22      GLN  88  -1.645   8.166  -6.875
  414    H    ARG  89           HN       ARG  89  -3.967   8.491   0.372
  415    HA   ARG  89           HA       ARG  89  -6.771   8.251   1.053
  416   1HB   ARG  89          HB2       ARG  89  -4.406   8.302   2.505
  417   2HB   ARG  89          HB1       ARG  89  -5.161   9.843   2.884
  418   1HG   ARG  89          HG2       ARG  89  -6.856   8.888   4.032
  419   2HG   ARG  89          HG1       ARG  89  -6.908   7.466   2.987
  420   1HD   ARG  89          HD2       ARG  89  -6.146   6.704   5.089
  421   2HD   ARG  89          HD1       ARG  89  -4.724   6.766   4.047
  422    HE   ARG  89           HE       ARG  89  -3.849   8.406   5.387
  423   1HH1  ARG  89          HH11      ARG  89  -7.230   8.003   6.145
  424   2HH1  ARG  89          HH12      ARG  89  -7.168   9.023   7.542
  425   1HH2  ARG  89          HH21      ARG  89  -3.764   9.749   7.225
  426   2HH2  ARG  89          HH22      ARG  89  -5.201  10.016   8.155
  427    H    ARG  90           HN       ARG  90  -4.596  10.734  -0.053
  428    HA   ARG  90           HA       ARG  90  -6.538  12.836   0.510
  429   1HB   ARG  90          HB2       ARG  90  -3.688  12.803  -0.419
  430   2HB   ARG  90          HB1       ARG  90  -4.672  14.240  -0.654
  431   1HG   ARG  90          HG2       ARG  90  -5.175  14.050   1.860
  432   2HG   ARG  90          HG1       ARG  90  -3.781  12.970   1.903
  433   1HD   ARG  90          HD2       ARG  90  -2.860  15.108   0.441
  434   2HD   ARG  90          HD1       ARG  90  -3.900  15.874   1.641
  435    HE   ARG  90           HE       ARG  90  -1.382  14.559   2.105
  436   1HH1  ARG  90          HH11      ARG  90  -4.395  15.578   3.543
  437   2HH1  ARG  90          HH12      ARG  90  -3.755  15.627   5.151
  438   1HH2  ARG  90          HH21      ARG  90  -0.540  14.620   4.220
  439   2HH2  ARG  90          HH22      ARG  90  -1.567  15.082   5.536
  Start of MODEL    5
    1    H    GLU  39           HN       GLU  39   6.594   0.920   7.061
    2    HA   GLU  39           HA       GLU  39   7.459   0.090   4.386
    3   1HB   GLU  39          HB2       GLU  39   5.619  -1.498   4.448
    4   2HB   GLU  39          HB1       GLU  39   6.616  -1.670   5.886
    5   1HG   GLU  39          HG2       GLU  39   4.810   0.035   6.845
    6   2HG   GLU  39          HG1       GLU  39   3.825  -0.743   5.608
    7    H    ILE  40           HN       ILE  40   5.160   2.102   6.053
    8    HA   ILE  40           HA       ILE  40   3.854   2.770   3.495
    9    HB   ILE  40           HB       ILE  40   2.343   1.999   5.258
   10   1HG1  ILE  40          HG12      ILE  40   1.778   3.931   3.627
   11   2HG1  ILE  40          HG11      ILE  40   0.700   3.632   4.983
   12   1HG2  ILE  40          HG21      ILE  40   3.416   4.305   6.872
   13   2HG2  ILE  40          HG22      ILE  40   3.637   2.588   7.206
   14   3HG2  ILE  40          HG23      ILE  40   2.031   3.308   7.317
   15   1HD1  ILE  40          HD11      ILE  40   2.614   5.883   4.554
   16   2HD1  ILE  40          HD12      ILE  40   2.084   5.458   6.179
   17   3HD1  ILE  40          HD13      ILE  40   0.901   5.930   4.962
   18    H    LEU  41           HN       LEU  41   4.082   4.797   2.662
   19    HA   LEU  41           HA       LEU  41   5.269   6.894   4.372
   20   1HB   LEU  41          HB2       LEU  41   6.239   5.741   1.834
   21   2HB   LEU  41          HB1       LEU  41   6.218   7.493   1.887
   22    HG   LEU  41           HG       LEU  41   7.411   6.766   4.294
   23   1HD1  LEU  41          HD11      LEU  41   7.602   4.459   3.394
   24   2HD1  LEU  41          HD12      LEU  41   9.155   5.216   3.749
   25   3HD1  LEU  41          HD13      LEU  41   8.592   5.097   2.081
   26   1HD2  LEU  41          HD21      LEU  41   8.110   8.663   3.054
   27   2HD2  LEU  41          HD22      LEU  41   8.544   7.675   1.658
   28   3HD2  LEU  41          HD23      LEU  41   9.496   7.575   3.138
   29    H    ILE  42           HN       ILE  42   4.251   8.856   4.193
   30    HA   ILE  42           HA       ILE  42   2.293   9.085   2.001
   31    HB   ILE  42           HB       ILE  42   0.881  10.393   3.409
   32   1HG1  ILE  42          HG12      ILE  42   1.864  10.485   5.955
   33   2HG1  ILE  42          HG11      ILE  42   3.337  10.698   5.016
   34   1HG2  ILE  42          HG21      ILE  42   0.150   8.414   4.125
   35   2HG2  ILE  42          HG22      ILE  42   1.081   8.714   5.591
   36   3HG2  ILE  42          HG23      ILE  42   1.786   7.775   4.277
   37   1HD1  ILE  42          HD11      ILE  42   2.440  12.633   3.937
   38   2HD1  ILE  42          HD12      ILE  42   2.230  12.813   5.679
   39   3HD1  ILE  42          HD13      ILE  42   0.858  12.362   4.666
   40    H    GLU  43           HN       GLU  43   2.480  10.704   0.646
   41    HA   GLU  43           HA       GLU  43   4.039  13.106   1.352
   42   1HB   GLU  43          HB2       GLU  43   4.564  11.091  -0.705
   43   2HB   GLU  43          HB1       GLU  43   4.374  12.695  -1.399
   44   1HG   GLU  43          HG2       GLU  43   6.329  13.412  -0.593
   45   2HG   GLU  43          HG1       GLU  43   6.095  12.614   0.961
   46    H    GLY  44           HN       GLY  44   2.985  14.998   0.646
   47   1HA   GLY  44          HA2       GLY  44   1.234  16.271  -0.159
   48   2HA   GLY  44          HA1       GLY  44   1.372  15.253  -1.584
   49    H    ASN  45           HN       ASN  45  -0.076  13.512  -1.868
   50    HA   ASN  45           HA       ASN  45  -2.186  13.201   0.148
   51   1HB   ASN  45          HB2       ASN  45  -3.883  13.221  -1.746
   52   2HB   ASN  45          HB1       ASN  45  -3.195  14.777  -1.290
   53   1HD2  ASN  45          HD21      ASN  45  -2.860  12.120  -3.587
   54   2HD2  ASN  45          HD22      ASN  45  -2.274  13.088  -4.893
   55    H    ARG  46           HN       ARG  46  -0.047  11.730  -1.965
   56    HA   ARG  46           HA       ARG  46  -1.622   9.236  -2.102
   57   1HB   ARG  46          HB2       ARG  46  -0.017   8.624  -3.907
   58   2HB   ARG  46          HB1       ARG  46  -0.942  10.073  -4.278
   59   1HG   ARG  46          HG2       ARG  46   1.518  10.740  -2.930
   60   2HG   ARG  46          HG1       ARG  46   1.823   9.762  -4.366
   61   1HD   ARG  46          HD2       ARG  46   0.083  12.222  -4.341
   62   2HD   ARG  46          HD1       ARG  46   1.794  12.234  -4.763
   63    HE   ARG  46           HE       ARG  46   0.667  10.335  -6.389
   64   1HH1  ARG  46          HH11      ARG  46   0.155  13.737  -5.803
   65   2HH1  ARG  46          HH12      ARG  46  -0.390  14.061  -7.414
   66   1HH2  ARG  46          HH21      ARG  46  -0.050  10.759  -8.508
   67   2HH2  ARG  46          HH22      ARG  46  -0.509  12.368  -8.949
   68    H    THR  47           HN       THR  47  -0.808   7.396  -1.143
   69    HA   THR  47           HA       THR  47   1.857   7.577   0.123
   70    HB   THR  47           HB       THR  47  -0.659   6.257   1.145
   71    HG1  THR  47           HG1      THR  47   0.405   8.702   1.539
   72   1HG2  THR  47          HG21      THR  47   1.740   5.237   1.652
   73   2HG2  THR  47          HG22      THR  47   0.425   5.250   2.826
   74   3HG2  THR  47          HG23      THR  47   1.683   6.482   2.900
   75    H    ILE  48           HN       ILE  48   3.169   5.859  -0.187
   76    HA   ILE  48           HA       ILE  48   2.108   3.569  -1.741
   77    HB   ILE  48           HB       ILE  48   4.978   4.511  -1.634
   78   1HG1  ILE  48          HG12      ILE  48   3.890   5.038  -4.187
   79   2HG1  ILE  48          HG11      ILE  48   2.743   5.691  -3.022
   80   1HG2  ILE  48          HG21      ILE  48   3.757   2.172  -2.624
   81   2HG2  ILE  48          HG22      ILE  48   5.437   2.681  -2.795
   82   3HG2  ILE  48          HG23      ILE  48   4.252   3.124  -4.023
   83   1HD1  ILE  48          HD11      ILE  48   4.236   7.432  -3.551
   84   2HD1  ILE  48          HD12      ILE  48   5.643   6.387  -3.352
   85   3HD1  ILE  48          HD13      ILE  48   4.693   6.864  -1.946
   86    H    ILE  49           HN       ILE  49   2.455   1.520  -0.906
   87    HA   ILE  49           HA       ILE  49   4.233   1.356   1.425
   88    HB   ILE  49           HB       ILE  49   1.986   1.329   2.296
   89   1HG1  ILE  49          HG12      ILE  49   2.952  -1.525   2.349
   90   2HG1  ILE  49          HG11      ILE  49   3.800  -0.233   3.194
   91   1HG2  ILE  49          HG21      ILE  49   0.819   0.599   0.287
   92   2HG2  ILE  49          HG22      ILE  49   0.374  -0.391   1.679
   93   3HG2  ILE  49          HG23      ILE  49   1.503  -1.016   0.476
   94   1HD1  ILE  49          HD11      ILE  49   2.199  -1.604   4.566
   95   2HD1  ILE  49          HD12      ILE  49   0.897  -0.842   3.652
   96   3HD1  ILE  49          HD13      ILE  49   1.976   0.144   4.637
   97    H    ARG  50           HN       ARG  50   5.625  -0.217   1.444
   98    HA   ARG  50           HA       ARG  50   5.940  -1.862  -0.883
   99   1HB   ARG  50          HB2       ARG  50   7.458  -1.614   1.708
  100   2HB   ARG  50          HB1       ARG  50   7.873  -2.824   0.502
  101   1HG   ARG  50          HG2       ARG  50   8.040  -0.879  -1.141
  102   2HG   ARG  50          HG1       ARG  50   8.026   0.161   0.285
  103   1HD   ARG  50          HD2       ARG  50  10.033  -0.763   1.105
  104   2HD   ARG  50          HD1       ARG  50   9.948  -2.129  -0.006
  105    HE   ARG  50           HE       ARG  50  11.102   0.412  -0.523
  106   1HH1  ARG  50          HH11      ARG  50   9.325  -2.179  -2.042
  107   2HH1  ARG  50          HH12      ARG  50   9.937  -1.838  -3.626
  108   1HH2  ARG  50          HH21      ARG  50  11.908   0.863  -2.606
  109   2HH2  ARG  50          HH22      ARG  50  11.404  -0.113  -3.947
  110    H    ASN  51           HN       ASN  51   3.734  -2.846  -0.512
  111    HA   ASN  51           HA       ASN  51   3.790  -4.998   1.455
  112   1HB   ASN  51          HB2       ASN  51   1.789  -3.332   0.962
  113   2HB   ASN  51          HB1       ASN  51   1.416  -4.523  -0.280
  114   1HD2  ASN  51          HD21      ASN  51  -0.096  -5.854   0.379
  115   2HD2  ASN  51          HD22      ASN  51  -0.255  -6.519   1.965
  116    H    PHE  52           HN       PHE  52   5.414  -5.049  -0.943
  117    HA   PHE  52           HA       PHE  52   4.523  -6.464  -3.049
  118   1HB   PHE  52          HB2       PHE  52   6.948  -5.714  -2.508
  119   2HB   PHE  52          HB1       PHE  52   7.127  -7.347  -1.876
  120    HD1  PHE  52           HD1      PHE  52   8.912  -6.841  -3.946
  121    HD2  PHE  52           HD2      PHE  52   4.776  -7.778  -4.311
  122    HE1  PHE  52           HE1      PHE  52   9.294  -7.693  -6.226
  123    HE2  PHE  52           HE2      PHE  52   5.137  -8.623  -6.578
  124    HZ   PHE  52           HZ       PHE  52   7.414  -8.586  -7.543
  125    H    ARG  53           HN       ARG  53   5.420  -8.066   0.065
  126    HA   ARG  53           HA       ARG  53   5.332 -10.686  -0.714
  127   1HB   ARG  53          HB2       ARG  53   5.058  -9.306   1.732
  128   2HB   ARG  53          HB1       ARG  53   3.722 -10.446   1.665
  129   1HG   ARG  53          HG2       ARG  53   5.096 -12.052   2.308
  130   2HG   ARG  53          HG1       ARG  53   6.011 -11.844   0.814
  131   1HD   ARG  53          HD2       ARG  53   6.457 -10.188   3.292
  132   2HD   ARG  53          HD1       ARG  53   7.353 -11.663   2.932
  133    HE   ARG  53           HE       ARG  53   7.657 -10.132   0.699
  134   1HH1  ARG  53          HH11      ARG  53   8.270  -9.643   4.099
  135   2HH1  ARG  53          HH12      ARG  53   9.593  -8.558   3.832
  136   1HH2  ARG  53          HH21      ARG  53   9.397  -8.705   0.345
  137   2HH2  ARG  53          HH22      ARG  53  10.232  -8.024   1.701
  138    H    GLU  54           HN       GLU  54   2.431  -9.189   0.673
  139    HA   GLU  54           HA       GLU  54   0.550 -11.002  -0.219
  140   1HB   GLU  54          HB2       GLU  54   0.465  -8.107   0.513
  141   2HB   GLU  54          HB1       GLU  54  -0.944  -8.796  -0.281
  142   1HG   GLU  54          HG2       GLU  54  -0.193 -10.584   1.766
  143   2HG   GLU  54          HG1       GLU  54  -0.158  -8.960   2.452
  144    H    LEU  55           HN       LEU  55   1.773  -8.078  -1.757
  145    HA   LEU  55           HA       LEU  55   0.261  -7.968  -4.029
  146   1HB   LEU  55          HB2       LEU  55   2.522  -6.696  -3.108
  147   2HB   LEU  55          HB1       LEU  55   3.084  -7.484  -4.569
  148    HG   LEU  55           HG       LEU  55   0.872  -6.395  -5.566
  149   1HD1  LEU  55          HD11      LEU  55   1.332  -5.036  -3.009
  150   2HD1  LEU  55          HD12      LEU  55  -0.127  -5.147  -3.995
  151   3HD1  LEU  55          HD13      LEU  55   1.121  -3.967  -4.396
  152   1HD2  LEU  55          HD21      LEU  55   2.632  -5.697  -6.763
  153   2HD2  LEU  55          HD22      LEU  55   3.669  -5.559  -5.343
  154   3HD2  LEU  55          HD23      LEU  55   2.554  -4.255  -5.752
  155    H    ALA  56           HN       ALA  56   3.263  -9.906  -3.643
  156    HA   ALA  56           HA       ALA  56   3.454 -10.915  -6.196
  157   1HB   ALA  56          HB1       ALA  56   5.244 -11.580  -4.957
  158   2HB   ALA  56          HB2       ALA  56   4.284 -13.053  -4.830
  159   3HB   ALA  56          HB3       ALA  56   4.276 -11.879  -3.514
  160    H    LYS  57           HN       LYS  57   1.686 -12.306  -3.425
  161    HA   LYS  57           HA       LYS  57   0.525 -14.443  -4.866
  162   1HB   LYS  57          HB2       LYS  57   0.407 -13.548  -2.258
  163   2HB   LYS  57          HB1       LYS  57  -1.230 -13.259  -2.829
  164   1HG   LYS  57          HG2       LYS  57  -1.684 -15.479  -3.087
  165   2HG   LYS  57          HG1       LYS  57   0.003 -15.904  -3.386
  166   1HD   LYS  57          HD2       LYS  57   0.541 -15.710  -1.070
  167   2HD   LYS  57          HD1       LYS  57  -1.032 -14.995  -0.705
  168   1HE   LYS  57          HE2       LYS  57  -2.145 -17.069  -1.229
  169   2HE   LYS  57          HE1       LYS  57  -0.627 -17.789  -1.766
  170   1HZ   LYS  57          HZ1       LYS  57  -1.548 -18.224   0.624
  171   2HZ   LYS  57          HZ2       LYS  57  -0.797 -16.750   0.970
  172   3HZ   LYS  57          HZ3       LYS  57   0.113 -18.039   0.364
  173    H    ALA  58           HN       ALA  58  -0.648 -11.202  -4.153
  174    HA   ALA  58           HA       ALA  58  -3.090 -11.234  -5.407
  175   1HB   ALA  58          HB1       ALA  58  -3.006  -8.876  -5.409
  176   2HB   ALA  58          HB2       ALA  58  -1.244  -8.863  -5.461
  177   3HB   ALA  58          HB3       ALA  58  -2.080  -9.397  -4.003
  178    H    VAL  59           HN       VAL  59   0.048 -10.365  -6.917
  179    HA   VAL  59           HA       VAL  59  -0.921  -9.684  -9.363
  180    HB   VAL  59           HB       VAL  59   1.125  -9.301  -9.904
  181   1HG1  VAL  59          HG11      VAL  59   3.048 -10.149  -8.412
  182   2HG1  VAL  59          HG12      VAL  59   1.773 -10.794  -7.387
  183   3HG1  VAL  59          HG13      VAL  59   1.853  -9.066  -7.704
  184   1HG2  VAL  59          HG21      VAL  59   2.718 -11.082 -10.503
  185   2HG2  VAL  59          HG22      VAL  59   1.108 -11.374 -11.161
  186   3HG2  VAL  59          HG23      VAL  59   1.657 -12.271  -9.746
  187    H    ASN  60           HN       ASN  60   0.035 -12.950  -8.355
  188    HA   ASN  60           HA       ASN  60  -0.556 -14.281 -10.707
  189   1HB   ASN  60          HB2       ASN  60   0.311 -15.246  -8.489
  190   2HB   ASN  60          HB1       ASN  60  -1.380 -15.348  -8.005
  191   1HD2  ASN  60          HD21      ASN  60   0.377 -16.020 -11.016
  192   2HD2  ASN  60          HD22      ASN  60  -0.221 -17.630 -11.204
  193    H    ARG  61           HN       ARG  61  -2.703 -12.914  -8.288
  194    HA   ARG  61           HA       ARG  61  -5.014 -13.739  -9.948
  195   1HB   ARG  61          HB2       ARG  61  -4.907 -13.021  -7.014
  196   2HB   ARG  61          HB1       ARG  61  -6.387 -13.349  -7.905
  197   1HG   ARG  61          HG2       ARG  61  -5.787 -15.614  -8.248
  198   2HG   ARG  61          HG1       ARG  61  -4.141 -15.331  -7.677
  199   1HD   ARG  61          HD2       ARG  61  -4.922 -14.939  -5.442
  200   2HD   ARG  61          HD1       ARG  61  -6.603 -14.999  -5.972
  201    HE   ARG  61           HE       ARG  61  -6.507 -17.285  -5.916
  202   1HH1  ARG  61          HH11      ARG  61  -3.258 -16.016  -5.794
  203   2HH1  ARG  61          HH12      ARG  61  -2.538 -17.552  -5.448
  204   1HH2  ARG  61          HH21      ARG  61  -5.561 -19.306  -5.459
  205   2HH2  ARG  61          HH22      ARG  61  -3.845 -19.420  -5.258
  206    H    ASP  62           HN       ASP  62  -3.258 -11.384 -10.359
  207    HA   ASP  62           HA       ASP  62  -3.654  -9.282 -11.285
  208   1HB   ASP  62          HB2       ASP  62  -6.304  -9.151  -9.846
  209   2HB   ASP  62          HB1       ASP  62  -5.777  -8.237 -11.255
  210    H    GLU  63           HN       GLU  63  -1.906  -8.981  -9.881
  211    HA   GLU  63           HA       GLU  63  -2.017  -8.106  -7.209
  212   1HB   GLU  63          HB2       GLU  63   0.063  -6.767  -7.779
  213   2HB   GLU  63          HB1       GLU  63   0.161  -8.483  -8.090
  214   1HG   GLU  63          HG2       GLU  63  -0.163  -8.120 -10.457
  215   2HG   GLU  63          HG1       GLU  63  -0.434  -6.405 -10.182
  216    H    GLU  64           HN       GLU  64  -2.200  -6.525 -10.278
  217    HA   GLU  64           HA       GLU  64  -2.360  -3.864  -9.521
  218   1HB   GLU  64          HB2       GLU  64  -2.927  -5.357 -11.860
  219   2HB   GLU  64          HB1       GLU  64  -4.317  -4.323 -11.572
  220   1HG   GLU  64          HG2       GLU  64  -1.517  -3.253 -11.569
  221   2HG   GLU  64          HG1       GLU  64  -2.460  -3.415 -13.049
  222    H    PHE  65           HN       PHE  65  -4.932  -6.208  -9.831
  223    HA   PHE  65           HA       PHE  65  -7.105  -4.703  -9.050
  224   1HB   PHE  65          HB2       PHE  65  -6.834  -7.229  -9.833
  225   2HB   PHE  65          HB1       PHE  65  -6.932  -7.521  -8.100
  226    HD1  PHE  65           HD1      PHE  65  -8.949  -6.689  -6.848
  227    HD2  PHE  65           HD2      PHE  65  -8.748  -6.761 -11.099
  228    HE1  PHE  65           HE1      PHE  65 -11.402  -6.527  -6.963
  229    HE2  PHE  65           HE2      PHE  65 -11.200  -6.599 -11.221
  230    HZ   PHE  65           HZ       PHE  65 -12.530  -6.481  -9.152
  231    H    PHE  66           HN       PHE  66  -4.863  -6.609  -6.966
  232    HA   PHE  66           HA       PHE  66  -6.245  -6.128  -4.636
  233   1HB   PHE  66          HB2       PHE  66  -4.484  -7.672  -4.312
  234   2HB   PHE  66          HB1       PHE  66  -3.257  -6.483  -4.836
  235    HD1  PHE  66           HD1      PHE  66  -2.376  -4.931  -3.300
  236    HD2  PHE  66           HD2      PHE  66  -5.969  -7.017  -2.405
  237    HE1  PHE  66           HE1      PHE  66  -2.592  -3.680  -1.204
  238    HE2  PHE  66           HE2      PHE  66  -6.165  -5.798  -0.289
  239    HZ   PHE  66           HZ       PHE  66  -4.513  -4.081   0.260
  240    H    ALA  67           HN       ALA  67  -3.255  -4.144  -5.496
  241    HA   ALA  67           HA       ALA  67  -3.459  -2.401  -3.446
  242   1HB   ALA  67          HB1       ALA  67  -1.852  -2.299  -5.452
  243   2HB   ALA  67          HB2       ALA  67  -2.331  -0.769  -4.722
  244   3HB   ALA  67          HB3       ALA  67  -3.079  -1.298  -6.229
  245    H    LYS  68           HN       LYS  68  -5.424  -2.299  -6.429
  246    HA   LYS  68           HA       LYS  68  -6.935  -0.045  -5.976
  247   1HB   LYS  68          HB2       LYS  68  -7.181  -2.351  -7.571
  248   2HB   LYS  68          HB1       LYS  68  -8.692  -2.239  -6.678
  249   1HG   LYS  68          HG2       LYS  68  -9.401  -0.507  -7.885
  250   2HG   LYS  68          HG1       LYS  68  -7.843   0.315  -7.781
  251   1HD   LYS  68          HD2       LYS  68  -6.987  -0.858  -9.640
  252   2HD   LYS  68          HD1       LYS  68  -8.296  -2.039  -9.595
  253   1HE   LYS  68          HE2       LYS  68  -8.669  -0.520 -11.424
  254   2HE   LYS  68          HE1       LYS  68  -9.886  -0.235 -10.181
  255   1HZ   LYS  68          HZ1       LYS  68  -9.032   1.790  -9.675
  256   2HZ   LYS  68          HZ2       LYS  68  -8.559   1.727 -11.298
  257   3HZ   LYS  68          HZ3       LYS  68  -7.444   1.368 -10.077
  258    H    TYR  69           HN       TYR  69  -7.445  -3.261  -4.564
  259    HA   TYR  69           HA       TYR  69  -9.647  -2.956  -3.012
  260   1HB   TYR  69          HB2       TYR  69  -7.210  -4.625  -2.749
  261   2HB   TYR  69          HB1       TYR  69  -8.211  -4.453  -1.319
  262    HD1  TYR  69           HD1      TYR  69  -7.581  -6.842  -3.421
  263    HD2  TYR  69           HD2      TYR  69 -10.916  -4.355  -2.532
  264    HE1  TYR  69           HE1      TYR  69  -9.097  -8.584  -4.261
  265    HE2  TYR  69           HE2      TYR  69 -12.440  -6.091  -3.370
  266    HH   TYR  69           HH       TYR  69 -11.591  -8.520  -5.282
  267    H    LEU  70           HN       LEU  70  -6.312  -2.315  -1.959
  268    HA   LEU  70           HA       LEU  70  -6.824  -1.366   0.570
  269   1HB   LEU  70          HB2       LEU  70  -4.628  -1.318  -1.118
  270   2HB   LEU  70          HB1       LEU  70  -4.951   0.381  -0.838
  271    HG   LEU  70           HG       LEU  70  -4.123  -1.728   1.119
  272   1HD1  LEU  70          HD11      LEU  70  -2.957   0.587  -0.086
  273   2HD1  LEU  70          HD12      LEU  70  -2.217  -0.610   0.974
  274   3HD1  LEU  70          HD13      LEU  70  -3.019   0.801   1.662
  275   1HD2  LEU  70          HD21      LEU  70  -4.638   0.406   2.726
  276   2HD2  LEU  70          HD22      LEU  70  -5.683  -1.005   2.560
  277   3HD2  LEU  70          HD23      LEU  70  -6.015   0.453   1.626
  278    H    LEU  71           HN       LEU  71  -6.998   0.373  -2.469
  279    HA   LEU  71           HA       LEU  71  -7.868   2.858  -1.505
  280   1HB   LEU  71          HB2       LEU  71  -7.699   3.370  -3.672
  281   2HB   LEU  71          HB1       LEU  71  -7.349   1.689  -4.009
  282    HG   LEU  71           HG       LEU  71  -9.883   1.363  -4.191
  283   1HD1  LEU  71          HD11      LEU  71 -11.304   3.108  -4.170
  284   2HD1  LEU  71          HD12      LEU  71 -10.138   4.202  -4.914
  285   3HD1  LEU  71          HD13      LEU  71 -10.044   3.857  -3.187
  286   1HD2  LEU  71          HD21      LEU  71  -7.964   1.941  -6.037
  287   2HD2  LEU  71          HD22      LEU  71  -9.177   3.177  -6.372
  288   3HD2  LEU  71          HD23      LEU  71  -9.623   1.472  -6.410
  289    H    LYS  72           HN       LYS  72  -9.617  -0.014  -2.678
  290    HA   LYS  72           HA       LYS  72 -12.229   0.851  -2.432
  291   1HB   LYS  72          HB2       LYS  72 -11.111  -1.506  -3.047
  292   2HB   LYS  72          HB1       LYS  72 -11.604  -1.870  -1.399
  293   1HG   LYS  72          HG2       LYS  72 -13.882  -0.796  -2.312
  294   2HG   LYS  72          HG1       LYS  72 -13.234  -1.444  -3.820
  295   1HD   LYS  72          HD2       LYS  72 -12.805  -3.527  -2.139
  296   2HD   LYS  72          HD1       LYS  72 -14.278  -2.841  -1.449
  297   1HE   LYS  72          HE2       LYS  72 -14.895  -2.800  -4.080
  298   2HE   LYS  72          HE1       LYS  72 -13.842  -4.214  -4.020
  299   1HZ   LYS  72          HZ1       LYS  72 -16.227  -4.711  -3.665
  300   2HZ   LYS  72          HZ2       LYS  72 -16.179  -3.811  -2.234
  301   3HZ   LYS  72          HZ3       LYS  72 -15.240  -5.209  -2.383
  302    H    GLU  73           HN       GLU  73 -10.126  -0.529   0.053
  303    HA   GLU  73           HA       GLU  73 -11.871  -0.591   2.197
  304   1HB   GLU  73          HB2       GLU  73  -9.220  -1.094   1.862
  305   2HB   GLU  73          HB1       GLU  73  -9.158   0.359   2.848
  306   1HG   GLU  73          HG2       GLU  73 -10.067  -0.662   4.666
  307   2HG   GLU  73          HG1       GLU  73 -10.985  -1.815   3.698
  308    H    THR  74           HN       THR  74  -9.633   2.089   1.429
  309    HA   THR  74           HA       THR  74 -10.796   3.827   3.356
  310    HB   THR  74           HB       THR  74  -8.518   4.214   2.781
  311    HG1  THR  74           HG1      THR  74 -10.005   6.279   1.539
  312   1HG2  THR  74          HG21      THR  74  -8.803   3.326   0.369
  313   2HG2  THR  74          HG22      THR  74  -7.615   4.586   0.696
  314   3HG2  THR  74          HG23      THR  74  -9.171   5.006  -0.019
  315    H    GLY  75           HN       GLY  75 -10.853   3.980  -0.227
  316   1HA   GLY  75          HA2       GLY  75 -13.023   4.265  -1.315
  317   2HA   GLY  75          HA1       GLY  75 -13.481   5.305   0.024
  318    H    SER  76           HN       SER  76 -10.351   5.441  -1.573
  319    HA   SER  76           HA       SER  76 -11.129   8.051  -2.698
  320   1HB   SER  76          HB2       SER  76  -8.680   7.211  -1.209
  321   2HB   SER  76          HB1       SER  76  -8.512   8.427  -2.472
  322    HG   SER  76           HG       SER  76  -9.036   9.667  -0.819
  323    H    ALA  77           HN       ALA  77  -7.970   6.680  -3.306
  324    HA   ALA  77           HA       ALA  77  -8.806   5.498  -5.835
  325   1HB   ALA  77          HB1       ALA  77  -8.516   7.495  -6.882
  326   2HB   ALA  77          HB2       ALA  77  -6.829   6.983  -6.863
  327   3HB   ALA  77          HB3       ALA  77  -7.422   8.110  -5.643
  328    H    GLY  78           HN       GLY  78  -7.331   3.887  -6.519
  329   1HA   GLY  78          HA2       GLY  78  -4.860   3.743  -4.902
  330   2HA   GLY  78          HA1       GLY  78  -5.876   2.338  -5.113
  331    H    ASN  79           HN       ASN  79  -3.046   2.947  -5.791
  332    HA   ASN  79           HA       ASN  79  -3.120   2.151  -8.636
  333   1HB   ASN  79          HB2       ASN  79  -1.771   4.403  -7.312
  334   2HB   ASN  79          HB1       ASN  79  -0.699   3.435  -8.317
  335   1HD2  ASN  79          HD21      ASN  79  -0.517   4.149 -10.298
  336   2HD2  ASN  79          HD22      ASN  79  -1.736   4.965 -11.211
  337    H    LEU  80           HN       LEU  80  -1.776   0.444  -9.168
  338    HA   LEU  80           HA       LEU  80  -0.032  -0.594  -7.013
  339   1HB   LEU  80          HB2       LEU  80  -1.940  -2.069  -7.537
  340   2HB   LEU  80          HB1       LEU  80  -1.418  -2.133  -9.210
  341    HG   LEU  80           HG       LEU  80   0.791  -2.860  -7.556
  342   1HD1  LEU  80          HD11      LEU  80  -0.578  -5.098  -6.907
  343   2HD1  LEU  80          HD12      LEU  80  -1.803  -3.860  -6.642
  344   3HD1  LEU  80          HD13      LEU  80  -0.259  -3.764  -5.801
  345   1HD2  LEU  80          HD21      LEU  80   1.096  -4.219  -9.278
  346   2HD2  LEU  80          HD22      LEU  80  -0.425  -3.637  -9.956
  347   3HD2  LEU  80          HD23      LEU  80  -0.407  -5.068  -8.932
  348    H    GLU  81           HN       GLU  81   2.036  -1.071  -7.488
  349    HA   GLU  81           HA       GLU  81   2.951  -0.761 -10.290
  350   1HB   GLU  81          HB2       GLU  81   4.046   0.181  -7.661
  351   2HB   GLU  81          HB1       GLU  81   5.190  -0.284  -8.914
  352   1HG   GLU  81          HG2       GLU  81   4.330   1.376 -10.404
  353   2HG   GLU  81          HG1       GLU  81   3.011   1.753  -9.296
  354    H    GLY  82           HN       GLY  82   4.210  -2.541 -11.015
  355   1HA   GLY  82          HA2       GLY  82   3.939  -5.021  -9.880
  356   2HA   GLY  82          HA1       GLY  82   5.268  -4.584 -10.929
  357    H    GLY  83           HN       GLY  83   4.288  -4.476  -7.437
  358   1HA   GLY  83          HA2       GLY  83   6.185  -5.897  -6.297
  359   2HA   GLY  83          HA1       GLY  83   7.143  -4.505  -6.700
  360    H    ARG  84           HN       ARG  84   4.599  -3.022  -6.091
  361    HA   ARG  84           HA       ARG  84   4.559  -2.986  -3.178
  362   1HB   ARG  84          HB2       ARG  84   4.682  -0.487  -3.392
  363   2HB   ARG  84          HB1       ARG  84   6.153  -1.287  -3.927
  364   1HG   ARG  84          HG2       ARG  84   4.727  -1.116  -6.249
  365   2HG   ARG  84          HG1       ARG  84   4.263   0.367  -5.413
  366   1HD   ARG  84          HD2       ARG  84   7.133  -0.474  -5.662
  367   2HD   ARG  84          HD1       ARG  84   6.325   0.443  -6.933
  368    HE   ARG  84           HE       ARG  84   5.817   1.923  -4.749
  369   1HH1  ARG  84          HH11      ARG  84   8.773   0.558  -6.007
  370   2HH1  ARG  84          HH12      ARG  84   9.775   1.813  -5.359
  371   1HH2  ARG  84          HH21      ARG  84   7.133   3.573  -3.897
  372   2HH2  ARG  84          HH22      ARG  84   8.845   3.525  -4.162
  373    H    LEU  85           HN       LEU  85   2.648  -2.249  -2.393
  374    HA   LEU  85           HA       LEU  85   0.341  -1.908  -4.303
  375   1HB   LEU  85          HB2       LEU  85  -0.793  -3.212  -2.868
  376   2HB   LEU  85          HB1       LEU  85   0.699  -3.502  -1.998
  377    HG   LEU  85           HG       LEU  85   0.099  -1.328  -0.717
  378   1HD1  LEU  85          HD11      LEU  85  -2.683  -1.751  -0.790
  379   2HD1  LEU  85          HD12      LEU  85  -2.133  -1.553  -2.454
  380   3HD1  LEU  85          HD13      LEU  85  -1.778  -0.311  -1.257
  381   1HD2  LEU  85          HD21      LEU  85  -0.089  -2.895   0.838
  382   2HD2  LEU  85          HD22      LEU  85  -0.623  -4.089  -0.346
  383   3HD2  LEU  85          HD23      LEU  85  -1.796  -3.017   0.421
  384    H    ILE  86           HN       ILE  86  -0.633   0.158  -4.251
  385    HA   ILE  86           HA       ILE  86   0.315   2.027  -2.156
  386    HB   ILE  86           HB       ILE  86  -0.301   2.698  -5.035
  387   1HG1  ILE  86          HG12      ILE  86   2.361   3.228  -4.657
  388   2HG1  ILE  86          HG11      ILE  86   2.146   1.754  -3.719
  389   1HG2  ILE  86          HG21      ILE  86  -0.562   4.430  -3.115
  390   2HG2  ILE  86          HG22      ILE  86   0.261   4.880  -4.606
  391   3HG2  ILE  86          HG23      ILE  86   1.199   4.470  -3.173
  392   1HD1  ILE  86          HD11      ILE  86   1.520   0.517  -5.588
  393   2HD1  ILE  86          HD12      ILE  86   2.837   1.539  -6.165
  394   3HD1  ILE  86          HD13      ILE  86   1.166   1.960  -6.538
  395    H    LEU  87           HN       LEU  87  -1.160   3.289  -1.180
  396    HA   LEU  87           HA       LEU  87  -3.923   3.249  -2.224
  397   1HB   LEU  87          HB2       LEU  87  -4.145   1.990  -0.284
  398   2HB   LEU  87          HB1       LEU  87  -2.847   2.830   0.538
  399    HG   LEU  87           HG       LEU  87  -5.346   4.344  -0.052
  400   1HD1  LEU  87          HD11      LEU  87  -6.353   3.527   2.038
  401   2HD1  LEU  87          HD12      LEU  87  -5.076   2.317   2.162
  402   3HD1  LEU  87          HD13      LEU  87  -6.216   2.262   0.817
  403   1HD2  LEU  87          HD21      LEU  87  -3.814   5.702   0.982
  404   2HD2  LEU  87          HD22      LEU  87  -3.128   4.388   1.937
  405   3HD2  LEU  87          HD23      LEU  87  -4.692   5.076   2.377
  406    H    GLN  88           HN       GLN  88  -4.833   5.214  -2.400
  407    HA   GLN  88           HA       GLN  88  -3.302   7.503  -1.354
  408   1HB   GLN  88          HB2       GLN  88  -4.845   7.259  -3.932
  409   2HB   GLN  88          HB1       GLN  88  -4.341   8.804  -3.264
  410   1HG   GLN  88          HG2       GLN  88  -2.348   8.580  -4.183
  411   2HG   GLN  88          HG1       GLN  88  -2.091   7.067  -3.314
  412   1HE2  GLN  88          HE21      GLN  88  -3.836   5.370  -4.410
  413   2HE2  GLN  88          HE22      GLN  88  -3.521   5.155  -6.095
  414    H    ARG  89           HN       ARG  89  -4.280   8.113   0.397
  415    HA   ARG  89           HA       ARG  89  -7.219   8.413   0.369
  416   1HB   ARG  89          HB2       ARG  89  -6.026   6.870   2.080
  417   2HB   ARG  89          HB1       ARG  89  -5.536   8.367   2.861
  418   1HG   ARG  89          HG2       ARG  89  -8.383   8.273   2.255
  419   2HG   ARG  89          HG1       ARG  89  -7.852   6.984   3.335
  420   1HD   ARG  89          HD2       ARG  89  -7.575   8.397   5.038
  421   2HD   ARG  89          HD1       ARG  89  -6.689   9.546   4.037
  422    HE   ARG  89           HE       ARG  89  -8.582  10.799   3.979
  423   1HH1  ARG  89          HH11      ARG  89  -9.521   7.471   4.464
  424   2HH1  ARG  89          HH12      ARG  89 -11.210   7.835   4.569
  425   1HH2  ARG  89          HH21      ARG  89 -10.804  11.276   4.117
  426   2HH2  ARG  89          HH22      ARG  89 -11.939   9.992   4.371
  427    H    ARG  90           HN       ARG  90  -7.953  10.221   1.926
  428    HA   ARG  90           HA       ARG  90  -6.735  12.655   1.016
  429   1HB   ARG  90          HB2       ARG  90  -9.196  11.881   2.433
  430   2HB   ARG  90          HB1       ARG  90  -8.545  13.444   2.909
  431   1HG   ARG  90          HG2       ARG  90  -8.459  13.329   0.089
  432   2HG   ARG  90          HG1       ARG  90 -10.049  12.756   0.592
  433   1HD   ARG  90          HD2       ARG  90 -10.666  14.868   0.893
  434   2HD   ARG  90          HD1       ARG  90  -9.477  15.000   2.187
  435    HE   ARG  90           HE       ARG  90  -9.270  16.065  -0.479
  436   1HH1  ARG  90          HH11      ARG  90  -7.501  15.058   2.356
  437   2HH1  ARG  90          HH12      ARG  90  -6.122  16.041   1.997
  438   1HH2  ARG  90          HH21      ARG  90  -7.456  17.356  -0.954
  439   2HH2  ARG  90          HH22      ARG  90  -6.095  17.346   0.118
  Start of MODEL    6
    1    H    GLU  39           HN       GLU  39   4.628  -0.176   6.758
    2    HA   GLU  39           HA       GLU  39   6.944   0.338   5.041
    3   1HB   GLU  39          HB2       GLU  39   5.129  -2.000   4.906
    4   2HB   GLU  39          HB1       GLU  39   5.529  -1.235   3.374
    5   1HG   GLU  39          HG2       GLU  39   7.170  -2.823   3.540
    6   2HG   GLU  39          HG1       GLU  39   7.975  -1.415   4.229
    7    H    ILE  40           HN       ILE  40   4.544   1.842   6.127
    8    HA   ILE  40           HA       ILE  40   3.308   2.623   3.563
    9    HB   ILE  40           HB       ILE  40   2.351   3.236   6.365
   10   1HG1  ILE  40          HG12      ILE  40   0.782   1.372   4.718
   11   2HG1  ILE  40          HG11      ILE  40   2.353   0.748   5.210
   12   1HG2  ILE  40          HG21      ILE  40   0.930   3.462   3.716
   13   2HG2  ILE  40          HG22      ILE  40   1.624   4.809   4.618
   14   3HG2  ILE  40          HG23      ILE  40   0.280   3.891   5.298
   15   1HD1  ILE  40          HD11      ILE  40   1.137   1.959   7.467
   16   2HD1  ILE  40          HD12      ILE  40   1.535   0.262   7.200
   17   3HD1  ILE  40          HD13      ILE  40  -0.039   0.888   6.706
   18    H    LEU  41           HN       LEU  41   3.666   4.636   2.776
   19    HA   LEU  41           HA       LEU  41   4.875   6.652   4.570
   20   1HB   LEU  41          HB2       LEU  41   6.038   5.383   2.266
   21   2HB   LEU  41          HB1       LEU  41   5.792   7.086   1.922
   22    HG   LEU  41           HG       LEU  41   7.271   6.072   4.349
   23   1HD1  LEU  41          HD11      LEU  41   8.339   6.998   1.686
   24   2HD1  LEU  41          HD12      LEU  41   8.483   5.383   2.382
   25   3HD1  LEU  41          HD13      LEU  41   9.312   6.745   3.135
   26   1HD2  LEU  41          HD21      LEU  41   6.540   8.726   3.278
   27   2HD2  LEU  41          HD22      LEU  41   8.177   8.555   3.910
   28   3HD2  LEU  41          HD23      LEU  41   6.791   8.202   4.943
   29    H    ILE  42           HN       ILE  42   3.910   8.668   4.397
   30    HA   ILE  42           HA       ILE  42   2.071   8.989   2.109
   31    HB   ILE  42           HB       ILE  42   1.707  10.395   4.742
   32   1HG1  ILE  42          HG12      ILE  42  -0.148   8.212   4.380
   33   2HG1  ILE  42          HG11      ILE  42   1.503   7.606   4.389
   34   1HG2  ILE  42          HG21      ILE  42  -0.751  10.026   3.671
   35   2HG2  ILE  42          HG22      ILE  42   0.236  10.152   2.215
   36   3HG2  ILE  42          HG23      ILE  42   0.249  11.454   3.406
   37   1HD1  ILE  42          HD11      ILE  42   0.557   9.489   6.505
   38   2HD1  ILE  42          HD12      ILE  42   1.892   8.336   6.550
   39   3HD1  ILE  42          HD13      ILE  42   0.224   7.761   6.605
   40    H    GLU  43           HN       GLU  43   2.340  10.666   0.851
   41    HA   GLU  43           HA       GLU  43   3.843  13.029   1.776
   42   1HB   GLU  43          HB2       GLU  43   4.469  11.136  -0.380
   43   2HB   GLU  43          HB1       GLU  43   4.370  12.796  -0.950
   44   1HG   GLU  43          HG2       GLU  43   5.988  13.436   0.824
   45   2HG   GLU  43          HG1       GLU  43   6.161  11.725   1.216
   46    H    GLY  44           HN       GLY  44   2.836  14.954   1.111
   47   1HA   GLY  44          HA2       GLY  44   1.175  16.292   0.235
   48   2HA   GLY  44          HA1       GLY  44   1.323  15.285  -1.198
   49    H    ASN  45           HN       ASN  45  -0.132  13.526  -1.497
   50    HA   ASN  45           HA       ASN  45  -2.291  13.245   0.456
   51   1HB   ASN  45          HB2       ASN  45  -4.011  13.467  -1.335
   52   2HB   ASN  45          HB1       ASN  45  -3.138  14.960  -1.001
   53   1HD2  ASN  45          HD21      ASN  45  -3.231  12.181  -3.172
   54   2HD2  ASN  45          HD22      ASN  45  -2.623  13.017  -4.557
   55    H    ARG  46           HN       ARG  46  -0.151  11.763  -1.609
   56    HA   ARG  46           HA       ARG  46  -1.812   9.336  -1.873
   57   1HB   ARG  46          HB2       ARG  46  -0.247   8.739  -3.709
   58   2HB   ARG  46          HB1       ARG  46  -1.101  10.244  -4.020
   59   1HG   ARG  46          HG2       ARG  46   0.838  11.531  -3.420
   60   2HG   ARG  46          HG1       ARG  46   1.697  10.072  -2.924
   61   1HD   ARG  46          HD2       ARG  46   2.238   9.528  -5.035
   62   2HD   ARG  46          HD1       ARG  46   0.652   9.982  -5.659
   63    HE   ARG  46           HE       ARG  46   1.809  12.367  -5.129
   64   1HH1  ARG  46          HH11      ARG  46   2.844   9.570  -6.941
   65   2HH1  ARG  46          HH12      ARG  46   3.805  10.489  -8.050
   66   1HH2  ARG  46          HH21      ARG  46   3.071  13.577  -6.587
   67   2HH2  ARG  46          HH22      ARG  46   3.935  12.764  -7.849
   68    H    THR  47           HN       THR  47  -1.042   7.429  -0.979
   69    HA   THR  47           HA       THR  47   1.612   7.542   0.316
   70    HB   THR  47           HB       THR  47  -0.941   6.203   1.215
   71    HG1  THR  47           HG1      THR  47  -0.690   8.473   1.650
   72   1HG2  THR  47          HG21      THR  47   0.091   5.044   2.831
   73   2HG2  THR  47          HG22      THR  47   1.358   6.249   3.040
   74   3HG2  THR  47          HG23      THR  47   1.446   5.101   1.706
   75    H    ILE  48           HN       ILE  48   2.932   5.856  -0.071
   76    HA   ILE  48           HA       ILE  48   1.964   3.695  -1.839
   77    HB   ILE  48           HB       ILE  48   4.376   3.425  -2.431
   78   1HG1  ILE  48          HG12      ILE  48   5.245   6.048  -1.597
   79   2HG1  ILE  48          HG11      ILE  48   4.750   5.104  -0.195
   80   1HG2  ILE  48          HG21      ILE  48   4.357   6.015  -3.382
   81   2HG2  ILE  48          HG22      ILE  48   2.651   5.661  -3.113
   82   3HG2  ILE  48          HG23      ILE  48   3.615   4.615  -4.155
   83   1HD1  ILE  48          HD11      ILE  48   6.401   3.536  -0.503
   84   2HD1  ILE  48          HD12      ILE  48   7.203   5.018  -1.025
   85   3HD1  ILE  48          HD13      ILE  48   6.565   3.892  -2.223
   86    H    ILE  49           HN       ILE  49   2.218   1.576  -1.184
   87    HA   ILE  49           HA       ILE  49   3.613   1.182   1.379
   88    HB   ILE  49           HB       ILE  49   1.279  -0.416   0.349
   89   1HG1  ILE  49          HG12      ILE  49   1.444   1.546   2.639
   90   2HG1  ILE  49          HG11      ILE  49   0.672   1.867   1.088
   91   1HG2  ILE  49          HG21      ILE  49   2.695  -0.550   3.003
   92   2HG2  ILE  49          HG22      ILE  49   2.888  -1.711   1.690
   93   3HG2  ILE  49          HG23      ILE  49   1.326  -1.538   2.492
   94   1HD1  ILE  49          HD11      ILE  49  -1.054   1.342   2.599
   95   2HD1  ILE  49          HD12      ILE  49  -0.187  -0.063   3.220
   96   3HD1  ILE  49          HD13      ILE  49  -0.846  -0.084   1.583
   97    H    ARG  50           HN       ARG  50   5.209  -0.157   1.402
   98    HA   ARG  50           HA       ARG  50   5.933  -1.590  -1.018
   99   1HB   ARG  50          HB2       ARG  50   7.465  -1.551   1.582
  100   2HB   ARG  50          HB1       ARG  50   8.080  -1.893  -0.030
  101   1HG   ARG  50          HG2       ARG  50   6.907   0.724   0.033
  102   2HG   ARG  50          HG1       ARG  50   8.089   0.555   1.331
  103   1HD   ARG  50          HD2       ARG  50   9.781   0.678  -0.106
  104   2HD   ARG  50          HD1       ARG  50   9.095  -0.601  -1.107
  105    HE   ARG  50           HE       ARG  50   7.663   1.718  -1.641
  106   1HH1  ARG  50          HH11      ARG  50  10.934   0.553  -1.988
  107   2HH1  ARG  50          HH12      ARG  50  11.269   1.532  -3.376
  108   1HH2  ARG  50          HH21      ARG  50   8.102   3.007  -3.468
  109   2HH2  ARG  50          HH22      ARG  50   9.661   2.927  -4.216
  110    H    ASN  51           HN       ASN  51   3.704  -2.700  -0.211
  111    HA   ASN  51           HA       ASN  51   4.294  -4.895   1.567
  112   1HB   ASN  51          HB2       ASN  51   2.167  -3.685   1.827
  113   2HB   ASN  51          HB1       ASN  51   1.704  -4.190   0.209
  114   1HD2  ASN  51          HD21      ASN  51   2.464  -5.331   3.437
  115   2HD2  ASN  51          HD22      ASN  51   1.571  -6.806   3.329
  116    H    PHE  52           HN       PHE  52   5.575  -4.762  -1.001
  117    HA   PHE  52           HA       PHE  52   4.619  -6.243  -3.010
  118   1HB   PHE  52          HB2       PHE  52   6.993  -5.325  -2.818
  119   2HB   PHE  52          HB1       PHE  52   7.394  -6.847  -2.028
  120    HD1  PHE  52           HD1      PHE  52   9.020  -6.871  -4.095
  121    HD2  PHE  52           HD2      PHE  52   4.795  -7.355  -4.369
  122    HE1  PHE  52           HE1      PHE  52   9.275  -7.962  -6.288
  123    HE2  PHE  52           HE2      PHE  52   5.033  -8.438  -6.549
  124    HZ   PHE  52           HZ       PHE  52   7.289  -8.748  -7.518
  125    H    ARG  53           HN       ARG  53   5.945  -7.778  -0.017
  126    HA   ARG  53           HA       ARG  53   6.012 -10.386  -0.830
  127   1HB   ARG  53          HB2       ARG  53   5.510  -9.042   1.720
  128   2HB   ARG  53          HB1       ARG  53   4.797 -10.646   1.635
  129   1HG   ARG  53          HG2       ARG  53   6.800 -11.358   2.307
  130   2HG   ARG  53          HG1       ARG  53   7.290 -11.098   0.633
  131   1HD   ARG  53          HD2       ARG  53   7.553  -8.598   1.715
  132   2HD   ARG  53          HD1       ARG  53   8.021  -9.637   3.059
  133    HE   ARG  53           HE       ARG  53   9.282 -10.348   0.582
  134   1HH1  ARG  53          HH11      ARG  53   9.464  -8.256   3.369
  135   2HH1  ARG  53          HH12      ARG  53  11.175  -8.022   3.238
  136   1HH2  ARG  53          HH21      ARG  53  11.532 -10.042   0.408
  137   2HH2  ARG  53          HH22      ARG  53  12.350  -9.035   1.556
  138    H    GLU  54           HN       GLU  54   3.145  -9.295   0.949
  139    HA   GLU  54           HA       GLU  54   1.402 -11.279   0.162
  140   1HB   GLU  54          HB2       GLU  54   1.200  -8.691   1.435
  141   2HB   GLU  54          HB1       GLU  54  -0.158  -8.940   0.347
  142   1HG   GLU  54          HG2       GLU  54  -1.141 -10.184   1.882
  143   2HG   GLU  54          HG1       GLU  54   0.189 -11.338   1.786
  144    H    LEU  55           HN       LEU  55   1.997  -8.135  -1.320
  145    HA   LEU  55           HA       LEU  55   0.180  -8.136  -3.364
  146   1HB   LEU  55          HB2       LEU  55   1.791  -6.314  -2.768
  147   2HB   LEU  55          HB1       LEU  55   3.032  -7.205  -3.625
  148    HG   LEU  55           HG       LEU  55   1.823  -6.958  -5.719
  149   1HD1  LEU  55          HD11      LEU  55  -0.156  -5.262  -5.593
  150   2HD1  LEU  55          HD12      LEU  55  -0.284  -5.836  -3.930
  151   3HD1  LEU  55          HD13      LEU  55  -0.432  -6.974  -5.270
  152   1HD2  LEU  55          HD21      LEU  55   3.168  -5.157  -5.710
  153   2HD2  LEU  55          HD22      LEU  55   2.662  -4.657  -4.096
  154   3HD2  LEU  55          HD23      LEU  55   1.662  -4.265  -5.495
  155    H    ALA  56           HN       ALA  56   3.429  -9.620  -3.468
  156    HA   ALA  56           HA       ALA  56   3.507 -10.490  -6.065
  157   1HB   ALA  56          HB1       ALA  56   5.033 -12.240  -5.304
  158   2HB   ALA  56          HB2       ALA  56   4.525 -11.966  -3.637
  159   3HB   ALA  56          HB3       ALA  56   5.388 -10.704  -4.515
  160    H    LYS  57           HN       LYS  57   2.273 -12.270  -3.226
  161    HA   LYS  57           HA       LYS  57   1.269 -14.492  -4.625
  162   1HB   LYS  57          HB2       LYS  57   1.309 -13.899  -2.035
  163   2HB   LYS  57          HB1       LYS  57  -0.326 -13.341  -2.364
  164   1HG   LYS  57          HG2       LYS  57  -0.330 -15.793  -3.550
  165   2HG   LYS  57          HG1       LYS  57   0.734 -16.058  -2.168
  166   1HD   LYS  57          HD2       LYS  57  -1.006 -15.105  -0.691
  167   2HD   LYS  57          HD1       LYS  57  -2.073 -14.951  -2.090
  168   1HE   LYS  57          HE2       LYS  57  -2.726 -16.956  -1.076
  169   2HE   LYS  57          HE1       LYS  57  -1.704 -17.458  -2.422
  170   1HZ   LYS  57          HZ1       LYS  57  -0.830 -17.224   0.409
  171   2HZ   LYS  57          HZ2       LYS  57   0.133 -17.733  -0.886
  172   3HZ   LYS  57          HZ3       LYS  57  -1.184 -18.672  -0.394
  173    H    ALA  58           HN       ALA  58  -0.207 -11.426  -3.780
  174    HA   ALA  58           HA       ALA  58  -2.706 -11.674  -4.886
  175   1HB   ALA  58          HB1       ALA  58  -1.468  -9.714  -3.596
  176   2HB   ALA  58          HB2       ALA  58  -2.915  -9.435  -4.563
  177   3HB   ALA  58          HB3       ALA  58  -1.324  -9.075  -5.232
  178    H    VAL  59           HN       VAL  59   0.260 -10.526  -6.564
  179    HA   VAL  59           HA       VAL  59  -0.908  -9.890  -8.937
  180    HB   VAL  59           HB       VAL  59   1.052  -9.461  -9.753
  181   1HG1  VAL  59          HG11      VAL  59   1.832 -10.407  -7.036
  182   2HG1  VAL  59          HG12      VAL  59   1.892  -8.792  -7.731
  183   3HG1  VAL  59          HG13      VAL  59   3.096  -9.994  -8.189
  184   1HG2  VAL  59          HG21      VAL  59   2.841 -11.147 -10.110
  185   2HG2  VAL  59          HG22      VAL  59   1.268 -11.652 -10.729
  186   3HG2  VAL  59          HG23      VAL  59   1.875 -12.319  -9.213
  187    H    ASN  60           HN       ASN  60   0.319 -13.095  -8.037
  188    HA   ASN  60           HA       ASN  60  -0.326 -14.441 -10.370
  189   1HB   ASN  60          HB2       ASN  60   0.657 -15.267  -8.042
  190   2HB   ASN  60          HB1       ASN  60  -1.019 -15.731  -7.764
  191   1HD2  ASN  60          HD21      ASN  60   1.252 -15.844 -10.493
  192   2HD2  ASN  60          HD22      ASN  60   0.964 -17.503 -10.881
  193    H    ARG  61           HN       ARG  61  -2.384 -13.286  -7.768
  194    HA   ARG  61           HA       ARG  61  -4.754 -14.278  -9.229
  195   1HB   ARG  61          HB2       ARG  61  -4.412 -13.446  -6.348
  196   2HB   ARG  61          HB1       ARG  61  -5.971 -13.802  -7.078
  197   1HG   ARG  61          HG2       ARG  61  -4.642 -16.038  -7.737
  198   2HG   ARG  61          HG1       ARG  61  -3.810 -15.619  -6.239
  199   1HD   ARG  61          HD2       ARG  61  -5.657 -17.079  -5.740
  200   2HD   ARG  61          HD1       ARG  61  -6.003 -15.473  -5.107
  201    HE   ARG  61           HE       ARG  61  -7.295 -16.769  -7.391
  202   1HH1  ARG  61          HH11      ARG  61  -7.057 -14.004  -5.262
  203   2HH1  ARG  61          HH12      ARG  61  -8.593 -13.362  -5.732
  204   1HH2  ARG  61          HH21      ARG  61  -9.310 -15.915  -8.004
  205   2HH2  ARG  61          HH22      ARG  61  -9.870 -14.442  -7.286
  206    H    ASP  62           HN       ASP  62  -3.144 -11.806  -9.796
  207    HA   ASP  62           HA       ASP  62  -3.719  -9.793 -10.796
  208   1HB   ASP  62          HB2       ASP  62  -6.343  -9.817  -9.305
  209   2HB   ASP  62          HB1       ASP  62  -5.917  -8.902 -10.747
  210    H    GLU  63           HN       GLU  63  -1.968  -9.275  -9.441
  211    HA   GLU  63           HA       GLU  63  -2.168  -8.207  -6.823
  212   1HB   GLU  63          HB2       GLU  63  -0.108  -6.928  -7.346
  213   2HB   GLU  63          HB1       GLU  63   0.034  -8.624  -7.742
  214   1HG   GLU  63          HG2       GLU  63  -0.313  -8.129 -10.097
  215   2HG   GLU  63          HG1       GLU  63  -0.540  -6.426  -9.709
  216    H    GLU  64           HN       GLU  64  -2.394  -6.939 -10.039
  217    HA   GLU  64           HA       GLU  64  -2.715  -4.231  -9.624
  218   1HB   GLU  64          HB2       GLU  64  -2.895  -5.702 -11.807
  219   2HB   GLU  64          HB1       GLU  64  -4.619  -5.603 -11.478
  220   1HG   GLU  64          HG2       GLU  64  -4.083  -3.029 -11.290
  221   2HG   GLU  64          HG1       GLU  64  -2.715  -3.482 -12.306
  222    H    PHE  65           HN       PHE  65  -5.122  -6.757  -9.471
  223    HA   PHE  65           HA       PHE  65  -7.354  -5.297  -8.760
  224   1HB   PHE  65          HB2       PHE  65  -6.885  -7.911  -9.196
  225   2HB   PHE  65          HB1       PHE  65  -6.999  -7.928  -7.440
  226    HD1  PHE  65           HD1      PHE  65  -9.061  -8.423  -6.585
  227    HD2  PHE  65           HD2      PHE  65  -8.821  -6.376 -10.308
  228    HE1  PHE  65           HE1      PHE  65 -11.516  -8.437  -6.746
  229    HE2  PHE  65           HE2      PHE  65 -11.275  -6.385 -10.476
  230    HZ   PHE  65           HZ       PHE  65 -12.627  -7.416  -8.693
  231    H    PHE  66           HN       PHE  66  -4.878  -6.779  -6.581
  232    HA   PHE  66           HA       PHE  66  -6.167  -6.079  -4.248
  233   1HB   PHE  66          HB2       PHE  66  -4.280  -7.441  -3.832
  234   2HB   PHE  66          HB1       PHE  66  -3.176  -6.262  -4.591
  235    HD1  PHE  66           HD1      PHE  66  -2.217  -4.578  -3.255
  236    HD2  PHE  66           HD2      PHE  66  -5.792  -6.508  -2.004
  237    HE1  PHE  66           HE1      PHE  66  -2.359  -3.075  -1.309
  238    HE2  PHE  66           HE2      PHE  66  -5.916  -5.041  -0.047
  239    HZ   PHE  66           HZ       PHE  66  -4.242  -3.287   0.245
  240    H    ALA  67           HN       ALA  67  -3.362  -4.056  -5.524
  241    HA   ALA  67           HA       ALA  67  -3.596  -2.043  -3.736
  242   1HB   ALA  67          HB1       ALA  67  -3.499  -1.073  -6.550
  243   2HB   ALA  67          HB2       ALA  67  -2.272  -2.249  -6.079
  244   3HB   ALA  67          HB3       ALA  67  -2.423  -0.730  -5.195
  245    H    LYS  68           HN       LYS  68  -5.715  -2.515  -6.582
  246    HA   LYS  68           HA       LYS  68  -7.389  -0.339  -6.360
  247   1HB   LYS  68          HB2       LYS  68  -7.511  -2.511  -7.875
  248   2HB   LYS  68          HB1       LYS  68  -8.643  -3.045  -6.640
  249   1HG   LYS  68          HG2       LYS  68 -10.268  -1.791  -7.477
  250   2HG   LYS  68          HG1       LYS  68  -9.241  -0.356  -7.486
  251   1HD   LYS  68          HD2       LYS  68  -8.602  -2.315  -9.573
  252   2HD   LYS  68          HD1       LYS  68 -10.212  -1.603  -9.711
  253   1HE   LYS  68          HE2       LYS  68  -8.689   0.587  -9.168
  254   2HE   LYS  68          HE1       LYS  68  -7.567  -0.395 -10.109
  255   1HZ   LYS  68          HZ1       LYS  68  -9.765  -0.609 -11.586
  256   2HZ   LYS  68          HZ2       LYS  68  -8.609   0.603 -11.818
  257   3HZ   LYS  68          HZ3       LYS  68 -10.013   0.934 -10.936
  258    H    TYR  69           HN       TYR  69  -7.525  -3.351  -4.486
  259    HA   TYR  69           HA       TYR  69  -9.640  -3.005  -2.822
  260   1HB   TYR  69          HB2       TYR  69  -7.010  -4.345  -2.478
  261   2HB   TYR  69          HB1       TYR  69  -7.987  -4.090  -1.043
  262    HD1  TYR  69           HD1      TYR  69  -8.860  -6.148  -0.440
  263    HD2  TYR  69           HD2      TYR  69  -8.961  -4.993  -4.533
  264    HE1  TYR  69           HE1      TYR  69 -10.169  -8.161  -0.969
  265    HE2  TYR  69           HE2      TYR  69 -10.270  -7.003  -5.074
  266    HH   TYR  69           HH       TYR  69 -10.443  -9.517  -3.677
  267    H    LEU  70           HN       LEU  70  -6.350  -1.797  -2.330
  268    HA   LEU  70           HA       LEU  70  -6.630  -0.514   0.084
  269   1HB   LEU  70          HB2       LEU  70  -5.152   0.322  -2.401
  270   2HB   LEU  70          HB1       LEU  70  -5.105   1.283  -0.944
  271    HG   LEU  70           HG       LEU  70  -4.268  -1.605  -1.049
  272   1HD1  LEU  70          HD11      LEU  70  -2.364   0.695  -0.926
  273   2HD1  LEU  70          HD12      LEU  70  -2.928   0.069  -2.475
  274   3HD1  LEU  70          HD13      LEU  70  -2.063  -0.985  -1.360
  275   1HD2  LEU  70          HD21      LEU  70  -3.182   0.190   0.993
  276   2HD2  LEU  70          HD22      LEU  70  -3.815  -1.451   1.140
  277   3HD2  LEU  70          HD23      LEU  70  -4.922  -0.078   1.110
  278    H    LEU  71           HN       LEU  71  -7.511   0.647  -3.112
  279    HA   LEU  71           HA       LEU  71  -8.660   3.101  -2.281
  280   1HB   LEU  71          HB2       LEU  71  -8.045   2.893  -4.570
  281   2HB   LEU  71          HB1       LEU  71  -8.978   1.428  -4.768
  282    HG   LEU  71           HG       LEU  71  -9.883   3.605  -5.794
  283   1HD1  LEU  71          HD11      LEU  71 -12.008   2.449  -4.115
  284   2HD1  LEU  71          HD12      LEU  71 -11.066   1.303  -5.070
  285   3HD1  LEU  71          HD13      LEU  71 -11.910   2.631  -5.868
  286   1HD2  LEU  71          HD21      LEU  71 -11.144   4.089  -3.146
  287   2HD2  LEU  71          HD22      LEU  71 -10.859   5.200  -4.485
  288   3HD2  LEU  71          HD23      LEU  71  -9.525   4.724  -3.434
  289    H    LYS  72           HN       LYS  72 -10.019  -0.108  -3.063
  290    HA   LYS  72           HA       LYS  72 -12.704   0.392  -2.680
  291   1HB   LYS  72          HB2       LYS  72 -11.096  -2.041  -1.880
  292   2HB   LYS  72          HB1       LYS  72 -12.852  -1.988  -1.883
  293   1HG   LYS  72          HG2       LYS  72 -11.307  -1.322  -4.354
  294   2HG   LYS  72          HG1       LYS  72 -11.628  -2.999  -3.908
  295   1HD   LYS  72          HD2       LYS  72 -13.775  -0.899  -4.166
  296   2HD   LYS  72          HD1       LYS  72 -13.297  -1.973  -5.481
  297   1HE   LYS  72          HE2       LYS  72 -14.436  -2.774  -2.807
  298   2HE   LYS  72          HE1       LYS  72 -15.242  -2.874  -4.372
  299   1HZ   LYS  72          HZ1       LYS  72 -12.913  -4.455  -3.437
  300   2HZ   LYS  72          HZ2       LYS  72 -13.428  -4.432  -5.048
  301   3HZ   LYS  72          HZ3       LYS  72 -14.455  -5.026  -3.842
  302    H    GLU  73           HN       GLU  73 -10.267  -0.406  -0.243
  303    HA   GLU  73           HA       GLU  73 -12.082  -0.171   1.960
  304   1HB   GLU  73          HB2       GLU  73 -10.015  -1.568   1.991
  305   2HB   GLU  73          HB1       GLU  73  -9.062  -0.092   1.996
  306   1HG   GLU  73          HG2       GLU  73  -9.155  -0.100   4.202
  307   2HG   GLU  73          HG1       GLU  73 -10.890   0.188   4.092
  308    H    THR  74           HN       THR  74  -9.459   1.880   0.707
  309    HA   THR  74           HA       THR  74  -9.740   3.960   2.565
  310    HB   THR  74           HB       THR  74  -8.757   4.110  -0.291
  311    HG1  THR  74           HG1      THR  74  -7.605   2.601   0.949
  312   1HG2  THR  74          HG21      THR  74  -9.233   6.278   1.114
  313   2HG2  THR  74          HG22      THR  74  -7.779   6.117   0.130
  314   3HG2  THR  74          HG23      THR  74  -7.701   5.844   1.870
  315    H    GLY  75           HN       GLY  75 -10.659   4.198  -0.881
  316   1HA   GLY  75          HA2       GLY  75 -13.101   4.687  -1.264
  317   2HA   GLY  75          HA1       GLY  75 -12.904   5.916  -0.026
  318    H    SER  76           HN       SER  76 -10.418   6.964  -0.799
  319    HA   SER  76           HA       SER  76 -11.205   8.822  -2.740
  320   1HB   SER  76          HB2       SER  76  -8.849   8.308  -1.126
  321   2HB   SER  76          HB1       SER  76  -8.410   8.868  -2.740
  322    HG   SER  76           HG       SER  76  -9.747  10.188  -0.695
  323    H    ALA  77           HN       ALA  77  -8.241   6.960  -3.257
  324    HA   ALA  77           HA       ALA  77  -9.204   5.668  -5.632
  325   1HB   ALA  77          HB1       ALA  77  -8.338   6.953  -7.292
  326   2HB   ALA  77          HB2       ALA  77  -7.006   7.536  -6.294
  327   3HB   ALA  77          HB3       ALA  77  -8.616   8.234  -6.111
  328    H    GLY  78           HN       GLY  78  -7.578   4.215  -6.548
  329   1HA   GLY  78          HA2       GLY  78  -5.202   3.944  -4.810
  330   2HA   GLY  78          HA1       GLY  78  -6.192   2.553  -5.201
  331    H    ASN  79           HN       ASN  79  -3.341   3.106  -5.695
  332    HA   ASN  79           HA       ASN  79  -3.326   2.688  -8.620
  333   1HB   ASN  79          HB2       ASN  79  -2.449   4.967  -7.607
  334   2HB   ASN  79          HB1       ASN  79  -1.027   4.005  -7.214
  335   1HD2  ASN  79          HD21      ASN  79   0.131   5.392  -8.647
  336   2HD2  ASN  79          HD22      ASN  79   0.068   5.130 -10.353
  337    H    LEU  80           HN       LEU  80  -2.060   0.983  -9.310
  338    HA   LEU  80           HA       LEU  80  -0.556  -0.468  -7.219
  339   1HB   LEU  80          HB2       LEU  80  -2.357  -1.804  -8.083
  340   2HB   LEU  80          HB1       LEU  80  -1.902  -1.438  -9.737
  341    HG   LEU  80           HG       LEU  80   0.359  -2.608  -8.482
  342   1HD1  LEU  80          HD11      LEU  80  -2.229  -3.889  -7.771
  343   2HD1  LEU  80          HD12      LEU  80  -0.751  -3.723  -6.824
  344   3HD1  LEU  80          HD13      LEU  80  -0.832  -4.903  -8.132
  345   1HD2  LEU  80          HD21      LEU  80  -1.391  -3.054 -10.782
  346   2HD2  LEU  80          HD22      LEU  80  -0.624  -4.515 -10.162
  347   3HD2  LEU  80          HD23      LEU  80   0.365  -3.142 -10.654
  348    H    GLU  81           HN       GLU  81   1.531  -0.965  -7.528
  349    HA   GLU  81           HA       GLU  81   2.797  -0.259 -10.110
  350   1HB   GLU  81          HB2       GLU  81   3.560   0.261  -7.261
  351   2HB   GLU  81          HB1       GLU  81   4.853  -0.101  -8.397
  352   1HG   GLU  81          HG2       GLU  81   3.389   1.785  -9.740
  353   2HG   GLU  81          HG1       GLU  81   3.271   2.320  -8.064
  354    H    GLY  82           HN       GLY  82   4.113  -1.946 -10.940
  355   1HA   GLY  82          HA2       GLY  82   3.680  -4.564 -10.110
  356   2HA   GLY  82          HA1       GLY  82   5.032  -4.047 -11.094
  357    H    GLY  83           HN       GLY  83   4.009  -4.191  -7.619
  358   1HA   GLY  83          HA2       GLY  83   5.851  -5.760  -6.576
  359   2HA   GLY  83          HA1       GLY  83   6.846  -4.362  -6.847
  360    H    ARG  84           HN       ARG  84   4.474  -2.767  -6.178
  361    HA   ARG  84           HA       ARG  84   4.276  -3.031  -3.276
  362   1HB   ARG  84          HB2       ARG  84   5.051  -0.664  -5.018
  363   2HB   ARG  84          HB1       ARG  84   4.401  -0.441  -3.399
  364   1HG   ARG  84          HG2       ARG  84   6.525  -0.511  -2.734
  365   2HG   ARG  84          HG1       ARG  84   6.397  -2.256  -2.966
  366   1HD   ARG  84          HD2       ARG  84   8.367  -1.490  -4.091
  367   2HD   ARG  84          HD1       ARG  84   7.173  -1.938  -5.308
  368    HE   ARG  84           HE       ARG  84   6.760   0.712  -5.004
  369   1HH1  ARG  84          HH11      ARG  84   9.628  -1.185  -5.603
  370   2HH1  ARG  84          HH12      ARG  84  10.424   0.071  -6.490
  371   1HH2  ARG  84          HH21      ARG  84   7.806   2.364  -6.172
  372   2HH2  ARG  84          HH22      ARG  84   9.390   2.086  -6.813
  373    H    LEU  85           HN       LEU  85   2.338  -2.320  -2.527
  374    HA   LEU  85           HA       LEU  85   0.202  -1.715  -4.576
  375   1HB   LEU  85          HB2       LEU  85  -1.308  -2.269  -2.560
  376   2HB   LEU  85          HB1       LEU  85  -0.525  -3.581  -3.405
  377    HG   LEU  85           HG       LEU  85   1.292  -3.262  -1.492
  378   1HD1  LEU  85          HD11      LEU  85  -1.105  -2.725   0.160
  379   2HD1  LEU  85          HD12      LEU  85  -0.336  -1.351  -0.634
  380   3HD1  LEU  85          HD13      LEU  85   0.592  -2.364   0.470
  381   1HD2  LEU  85          HD21      LEU  85  -1.015  -4.692  -0.432
  382   2HD2  LEU  85          HD22      LEU  85   0.586  -5.287  -0.868
  383   3HD2  LEU  85          HD23      LEU  85  -0.650  -5.096  -2.110
  384    H    ILE  86           HN       ILE  86  -0.726   0.317  -4.437
  385    HA   ILE  86           HA       ILE  86   0.138   2.063  -2.208
  386    HB   ILE  86           HB       ILE  86  -0.524   2.819  -5.056
  387   1HG1  ILE  86          HG12      ILE  86   2.106   3.435  -4.705
  388   2HG1  ILE  86          HG11      ILE  86   1.968   1.971  -3.736
  389   1HG2  ILE  86          HG21      ILE  86  -0.094   5.005  -4.569
  390   2HG2  ILE  86          HG22      ILE  86   0.936   4.612  -3.193
  391   3HG2  ILE  86          HG23      ILE  86  -0.816   4.482  -3.048
  392   1HD1  ILE  86          HD11      ILE  86   1.382   0.671  -5.575
  393   2HD1  ILE  86          HD12      ILE  86   2.644   1.743  -6.187
  394   3HD1  ILE  86          HD13      ILE  86   0.950   2.077  -6.548
  395    H    LEU  87           HN       LEU  87  -1.321   3.279  -1.160
  396    HA   LEU  87           HA       LEU  87  -4.119   3.197  -2.085
  397   1HB   LEU  87          HB2       LEU  87  -4.870   3.056   0.150
  398   2HB   LEU  87          HB1       LEU  87  -3.585   1.879   0.021
  399    HG   LEU  87           HG       LEU  87  -3.357   2.907   2.129
  400   1HD1  LEU  87          HD11      LEU  87  -1.322   4.382   0.499
  401   2HD1  LEU  87          HD12      LEU  87  -1.280   2.631   0.697
  402   3HD1  LEU  87          HD13      LEU  87  -1.161   3.682   2.107
  403   1HD2  LEU  87          HD21      LEU  87  -2.884   5.659   1.458
  404   2HD2  LEU  87          HD22      LEU  87  -4.030   4.961   2.601
  405   3HD2  LEU  87          HD23      LEU  87  -4.483   5.154   0.909
  406    H    GLN  88           HN       GLN  88  -5.111   5.140  -2.251
  407    HA   GLN  88           HA       GLN  88  -3.597   7.487  -1.307
  408   1HB   GLN  88          HB2       GLN  88  -4.697   6.879  -3.932
  409   2HB   GLN  88          HB1       GLN  88  -5.279   8.418  -3.313
  410   1HG   GLN  88          HG2       GLN  88  -3.235   9.391  -3.413
  411   2HG   GLN  88          HG1       GLN  88  -2.379   7.882  -3.099
  412   1HE2  GLN  88          HE21      GLN  88  -3.482  10.066  -5.457
  413   2HE2  GLN  88          HE22      GLN  88  -2.965   9.189  -6.853
  414    H    ARG  89           HN       ARG  89  -4.548   8.067   0.511
  415    HA   ARG  89           HA       ARG  89  -7.475   8.033   0.678
  416   1HB   ARG  89          HB2       ARG  89  -5.820   7.084   2.464
  417   2HB   ARG  89          HB1       ARG  89  -5.681   8.765   2.962
  418   1HG   ARG  89          HG2       ARG  89  -7.850   8.869   3.707
  419   2HG   ARG  89          HG1       ARG  89  -8.390   7.565   2.649
  420   1HD   ARG  89          HD2       ARG  89  -7.964   6.010   4.192
  421   2HD   ARG  89          HD1       ARG  89  -6.372   6.683   4.542
  422    HE   ARG  89           HE       ARG  89  -7.274   7.586   6.419
  423   1HH1  ARG  89          HH11      ARG  89  -9.842   7.185   4.089
  424   2HH1  ARG  89          HH12      ARG  89 -11.072   7.766   5.159
  425   1HH2  ARG  89          HH21      ARG  89  -8.892   8.350   7.828
  426   2HH2  ARG  89          HH22      ARG  89 -10.533   8.428   7.281
  427    H    ARG  90           HN       ARG  90  -5.562  10.128  -0.637
  428    HA   ARG  90           HA       ARG  90  -5.639  12.360  -1.051
  429   1HB   ARG  90          HB2       ARG  90  -8.258  11.644  -0.423
  430   2HB   ARG  90          HB1       ARG  90  -7.951  13.067   0.564
  431   1HG   ARG  90          HG2       ARG  90  -7.093  13.249  -2.247
  432   2HG   ARG  90          HG1       ARG  90  -8.833  13.161  -1.970
  433   1HD   ARG  90          HD2       ARG  90  -8.245  15.464  -1.985
  434   2HD   ARG  90          HD1       ARG  90  -8.563  15.022  -0.309
  435    HE   ARG  90           HE       ARG  90  -5.873  14.691  -0.592
  436   1HH1  ARG  90          HH11      ARG  90  -8.083  17.336  -1.139
  437   2HH1  ARG  90          HH12      ARG  90  -6.907  18.556  -0.786
  438   1HH2  ARG  90          HH21      ARG  90  -4.324  16.296  -0.125
  439   2HH2  ARG  90          HH22      ARG  90  -4.773  17.966  -0.211
  Start of MODEL    7
    1    H    GLU  39           HN       GLU  39   7.266   0.544   6.259
    2    HA   GLU  39           HA       GLU  39   6.104  -1.164   4.204
    3   1HB   GLU  39          HB2       GLU  39   5.876  -1.191   6.919
    4   2HB   GLU  39          HB1       GLU  39   4.415  -0.322   6.468
    5   1HG   GLU  39          HG2       GLU  39   3.471  -2.301   6.157
    6   2HG   GLU  39          HG1       GLU  39   4.478  -2.460   4.719
    7    H    ILE  40           HN       ILE  40   4.763   1.578   6.053
    8    HA   ILE  40           HA       ILE  40   3.421   2.466   3.581
    9    HB   ILE  40           HB       ILE  40   1.919   1.836   5.421
   10   1HG1  ILE  40          HG12      ILE  40   1.385   4.663   5.614
   11   2HG1  ILE  40          HG11      ILE  40   1.907   4.259   3.983
   12   1HG2  ILE  40          HG21      ILE  40   1.859   3.123   7.494
   13   2HG2  ILE  40          HG22      ILE  40   3.270   4.042   6.971
   14   3HG2  ILE  40          HG23      ILE  40   3.412   2.313   7.291
   15   1HD1  ILE  40          HD11      ILE  40  -0.239   2.706   5.377
   16   2HD1  ILE  40          HD12      ILE  40   0.120   2.794   3.653
   17   3HD1  ILE  40          HD13      ILE  40  -0.583   4.184   4.480
   18    H    LEU  41           HN       LEU  41   3.849   4.448   2.766
   19    HA   LEU  41           HA       LEU  41   5.322   6.385   4.451
   20   1HB   LEU  41          HB2       LEU  41   6.261   5.021   2.127
   21   2HB   LEU  41          HB1       LEU  41   6.011   6.701   1.692
   22    HG   LEU  41           HG       LEU  41   7.371   6.766   4.147
   23   1HD1  LEU  41          HD11      LEU  41   9.473   5.484   3.258
   24   2HD1  LEU  41          HD12      LEU  41   8.266   4.525   2.400
   25   3HD1  LEU  41          HD13      LEU  41   8.215   4.636   4.159
   26   1HD2  LEU  41          HD21      LEU  41   9.051   7.892   2.913
   27   2HD2  LEU  41          HD22      LEU  41   7.516   8.281   2.138
   28   3HD2  LEU  41          HD23      LEU  41   8.591   7.085   1.414
   29    H    ILE  42           HN       ILE  42   4.453   8.458   4.340
   30    HA   ILE  42           HA       ILE  42   2.467   8.863   2.195
   31    HB   ILE  42           HB       ILE  42   2.377  10.170   4.909
   32   1HG1  ILE  42          HG12      ILE  42   0.373   8.102   4.281
   33   2HG1  ILE  42          HG11      ILE  42   2.005   7.491   4.525
   34   1HG2  ILE  42          HG21      ILE  42  -0.076   9.826   3.350
   35   2HG2  ILE  42          HG22      ILE  42   1.128  10.870   2.594
   36   3HG2  ILE  42          HG23      ILE  42   0.534  11.237   4.213
   37   1HD1  ILE  42          HD11      ILE  42   0.161   8.800   6.443
   38   2HD1  ILE  42          HD12      ILE  42   1.899   9.010   6.662
   39   3HD1  ILE  42          HD13      ILE  42   1.201   7.391   6.650
   40    H    GLU  43           HN       GLU  43   2.699  10.533   0.922
   41    HA   GLU  43           HA       GLU  43   4.349  12.840   1.737
   42   1HB   GLU  43          HB2       GLU  43   4.639  10.997  -0.581
   43   2HB   GLU  43          HB1       GLU  43   4.779  12.710  -0.948
   44   1HG   GLU  43          HG2       GLU  43   6.331  11.896   1.379
   45   2HG   GLU  43          HG1       GLU  43   6.807  11.079  -0.110
   46    H    GLY  44           HN       GLY  44   3.367  14.802   1.149
   47   1HA   GLY  44          HA2       GLY  44   1.668  16.193   0.433
   48   2HA   GLY  44          HA1       GLY  44   1.737  15.242  -1.042
   49    H    ASN  45           HN       ASN  45   0.181  13.630  -1.414
   50    HA   ASN  45           HA       ASN  45  -1.896  13.287   0.634
   51   1HB   ASN  45          HB2       ASN  45  -2.635  13.803  -2.239
   52   2HB   ASN  45          HB1       ASN  45  -3.684  13.803  -0.825
   53   1HD2  ASN  45          HD21      ASN  45  -1.527  15.616  -2.775
   54   2HD2  ASN  45          HD22      ASN  45  -1.694  17.124  -1.949
   55    H    ARG  46           HN       ARG  46   0.144  11.843  -1.570
   56    HA   ARG  46           HA       ARG  46  -1.549   9.439  -1.850
   57   1HB   ARG  46          HB2       ARG  46  -0.113   8.866  -3.739
   58   2HB   ARG  46          HB1       ARG  46  -0.755  10.488  -3.954
   59   1HG   ARG  46          HG2       ARG  46   1.476  11.243  -2.867
   60   2HG   ARG  46          HG1       ARG  46   2.030   9.628  -3.312
   61   1HD   ARG  46          HD2       ARG  46   2.523  11.392  -5.007
   62   2HD   ARG  46          HD1       ARG  46   1.584  10.032  -5.621
   63    HE   ARG  46           HE       ARG  46  -0.042  12.222  -4.737
   64   1HH1  ARG  46          HH11      ARG  46   1.810  10.954  -7.409
   65   2HH1  ARG  46          HH12      ARG  46   0.917  11.830  -8.607
   66   1HH2  ARG  46          HH21      ARG  46  -1.218  13.374  -6.312
   67   2HH2  ARG  46          HH22      ARG  46  -0.801  13.205  -7.984
   68    H    THR  47           HN       THR  47  -0.818   7.500  -0.997
   69    HA   THR  47           HA       THR  47   1.829   7.538   0.319
   70    HB   THR  47           HB       THR  47  -0.715   6.127   1.146
   71    HG1  THR  47           HG1      THR  47   0.578   8.441   2.061
   72   1HG2  THR  47          HG21      THR  47   0.343   5.004   2.751
   73   2HG2  THR  47          HG22      THR  47   1.482   6.313   3.062
   74   3HG2  THR  47          HG23      THR  47   1.751   5.213   1.711
   75    H    ILE  48           HN       ILE  48   3.136   5.832  -0.118
   76    HA   ILE  48           HA       ILE  48   2.124   3.742  -1.949
   77    HB   ILE  48           HB       ILE  48   4.976   4.645  -1.472
   78   1HG1  ILE  48          HG12      ILE  48   4.627   5.477  -3.925
   79   2HG1  ILE  48          HG11      ILE  48   2.919   5.457  -3.501
   80   1HG2  ILE  48          HG21      ILE  48   4.293   3.212  -3.937
   81   2HG2  ILE  48          HG22      ILE  48   4.135   2.259  -2.461
   82   3HG2  ILE  48          HG23      ILE  48   5.674   3.024  -2.856
   83   1HD1  ILE  48          HD11      ILE  48   4.359   7.620  -3.218
   84   2HD1  ILE  48          HD12      ILE  48   4.826   6.854  -1.699
   85   3HD1  ILE  48          HD13      ILE  48   3.127   7.193  -2.029
   86    H    ILE  49           HN       ILE  49   2.332   1.587  -1.320
   87    HA   ILE  49           HA       ILE  49   3.719   1.151   1.237
   88    HB   ILE  49           HB       ILE  49   1.349  -0.402   0.232
   89   1HG1  ILE  49          HG12      ILE  49   1.561   1.620   2.461
   90   2HG1  ILE  49          HG11      ILE  49   0.761   1.891   0.917
   91   1HG2  ILE  49          HG21      ILE  49   2.684  -0.501   2.926
   92   2HG2  ILE  49          HG22      ILE  49   2.996  -1.652   1.627
   93   3HG2  ILE  49          HG23      ILE  49   1.385  -1.538   2.335
   94   1HD1  ILE  49          HD11      ILE  49  -0.819   0.070   1.474
   95   2HD1  ILE  49          HD12      ILE  49  -0.887   1.433   2.591
   96   3HD1  ILE  49          HD13      ILE  49  -0.059  -0.052   3.061
   97    H    ARG  50           HN       ARG  50   5.302  -0.168   1.224
   98    HA   ARG  50           HA       ARG  50   5.971  -1.644  -1.181
   99   1HB   ARG  50          HB2       ARG  50   7.489  -0.346   0.720
  100   2HB   ARG  50          HB1       ARG  50   7.687  -2.034   1.171
  101   1HG   ARG  50          HG2       ARG  50   8.972  -2.487  -0.603
  102   2HG   ARG  50          HG1       ARG  50   7.984  -1.516  -1.694
  103   1HD   ARG  50          HD2       ARG  50   9.502   0.032   0.280
  104   2HD   ARG  50          HD1       ARG  50  10.497  -0.867  -0.864
  105    HE   ARG  50           HE       ARG  50   8.537   0.442  -2.332
  106   1HH1  ARG  50          HH11      ARG  50  11.241   1.280  -0.291
  107   2HH1  ARG  50          HH12      ARG  50  11.556   2.774  -1.109
  108   1HH2  ARG  50          HH21      ARG  50   8.951   2.404  -3.411
  109   2HH2  ARG  50          HH22      ARG  50  10.257   3.411  -2.881
  110    H    ASN  51           HN       ASN  51   3.706  -2.666  -0.302
  111    HA   ASN  51           HA       ASN  51   4.239  -4.861   1.480
  112   1HB   ASN  51          HB2       ASN  51   2.107  -3.449   1.500
  113   2HB   ASN  51          HB1       ASN  51   1.645  -4.359   0.072
  114   1HD2  ASN  51          HD21      ASN  51   1.519  -4.242   3.384
  115   2HD2  ASN  51          HD22      ASN  51   1.054  -5.875   3.697
  116    H    PHE  52           HN       PHE  52   5.552  -4.795  -1.042
  117    HA   PHE  52           HA       PHE  52   4.625  -6.259  -3.071
  118   1HB   PHE  52          HB2       PHE  52   6.972  -5.374  -2.878
  119   2HB   PHE  52          HB1       PHE  52   7.364  -6.822  -1.955
  120    HD1  PHE  52           HD1      PHE  52   9.081  -7.122  -3.849
  121    HD2  PHE  52           HD2      PHE  52   4.873  -7.403  -4.447
  122    HE1  PHE  52           HE1      PHE  52   9.451  -8.370  -5.940
  123    HE2  PHE  52           HE2      PHE  52   5.226  -8.643  -6.527
  124    HZ   PHE  52           HZ       PHE  52   7.529  -9.133  -7.280
  125    H    ARG  53           HN       ARG  53   5.808  -7.825  -0.033
  126    HA   ARG  53           HA       ARG  53   5.841 -10.432  -0.856
  127   1HB   ARG  53          HB2       ARG  53   5.169  -9.098   1.685
  128   2HB   ARG  53          HB1       ARG  53   4.563 -10.740   1.533
  129   1HG   ARG  53          HG2       ARG  53   6.689 -11.652   1.396
  130   2HG   ARG  53          HG1       ARG  53   7.421 -10.119   0.916
  131   1HD   ARG  53          HD2       ARG  53   7.997 -10.701   3.218
  132   2HD   ARG  53          HD1       ARG  53   7.039  -9.222   3.147
  133    HE   ARG  53           HE       ARG  53   5.203 -11.197   3.542
  134   1HH1  ARG  53          HH11      ARG  53   8.091 -10.171   5.211
  135   2HH1  ARG  53          HH12      ARG  53   7.522 -10.677   6.766
  136   1HH2  ARG  53          HH21      ARG  53   4.454 -11.863   5.586
  137   2HH2  ARG  53          HH22      ARG  53   5.457 -11.639   6.979
  138    H    GLU  54           HN       GLU  54   2.933  -9.263   0.801
  139    HA   GLU  54           HA       GLU  54   1.161 -11.185  -0.074
  140   1HB   GLU  54          HB2       GLU  54   0.737  -9.429   1.685
  141   2HB   GLU  54          HB1       GLU  54   0.456  -8.281   0.382
  142   1HG   GLU  54          HG2       GLU  54  -1.192 -10.387  -0.267
  143   2HG   GLU  54          HG1       GLU  54  -1.294 -10.312   1.492
  144    H    LEU  55           HN       LEU  55   1.926  -8.054  -1.503
  145    HA   LEU  55           HA       LEU  55   0.198  -7.971  -3.619
  146   1HB   LEU  55          HB2       LEU  55   1.867  -6.224  -2.923
  147   2HB   LEU  55          HB1       LEU  55   3.090  -7.150  -3.770
  148    HG   LEU  55           HG       LEU  55   2.155  -5.185  -5.029
  149   1HD1  LEU  55          HD11      LEU  55   3.235  -7.310  -6.003
  150   2HD1  LEU  55          HD12      LEU  55   2.345  -6.241  -7.087
  151   3HD1  LEU  55          HD13      LEU  55   1.596  -7.728  -6.504
  152   1HD2  LEU  55          HD21      LEU  55  -0.243  -6.898  -5.560
  153   2HD2  LEU  55          HD22      LEU  55  -0.010  -5.178  -5.871
  154   3HD2  LEU  55          HD23      LEU  55  -0.228  -5.754  -4.218
  155    H    ALA  56           HN       ALA  56   3.399  -9.566  -3.617
  156    HA   ALA  56           HA       ALA  56   3.537 -10.417  -6.216
  157   1HB   ALA  56          HB1       ALA  56   4.432 -11.895  -3.742
  158   2HB   ALA  56          HB2       ALA  56   5.375 -10.724  -4.663
  159   3HB   ALA  56          HB3       ALA  56   4.938 -12.271  -5.388
  160    H    LYS  57           HN       LYS  57   2.188 -12.206  -3.437
  161    HA   LYS  57           HA       LYS  57   1.128 -14.361  -4.883
  162   1HB   LYS  57          HB2       LYS  57  -0.207 -12.999  -2.527
  163   2HB   LYS  57          HB1       LYS  57  -0.446 -14.660  -3.052
  164   1HG   LYS  57          HG2       LYS  57   2.121 -14.861  -2.625
  165   2HG   LYS  57          HG1       LYS  57   1.857 -13.442  -1.609
  166   1HD   LYS  57          HD2       LYS  57  -0.158 -15.471  -1.152
  167   2HD   LYS  57          HD1       LYS  57   1.469 -16.105  -0.897
  168   1HE   LYS  57          HE2       LYS  57   0.332 -13.611   0.368
  169   2HE   LYS  57          HE1       LYS  57   0.508 -15.175   1.162
  170   1HZ   LYS  57          HZ1       LYS  57   2.923 -14.119  -0.041
  171   2HZ   LYS  57          HZ2       LYS  57   2.698 -14.874   1.455
  172   3HZ   LYS  57          HZ3       LYS  57   2.332 -13.233   1.273
  173    H    ALA  58           HN       ALA  58  -0.250 -11.237  -4.074
  174    HA   ALA  58           HA       ALA  58  -2.719 -11.394  -5.258
  175   1HB   ALA  58          HB1       ALA  58  -2.855  -9.120  -5.015
  176   2HB   ALA  58          HB2       ALA  58  -1.175  -8.859  -5.481
  177   3HB   ALA  58          HB3       ALA  58  -1.556  -9.501  -3.884
  178    H    VAL  59           HN       VAL  59   0.332 -10.321  -6.860
  179    HA   VAL  59           HA       VAL  59  -0.798  -9.660  -9.252
  180    HB   VAL  59           HB       VAL  59   1.201  -9.095  -9.814
  181   1HG1  VAL  59          HG11      VAL  59   2.598 -10.978  -7.943
  182   2HG1  VAL  59          HG12      VAL  59   1.765  -9.543  -7.352
  183   3HG1  VAL  59          HG13      VAL  59   3.094  -9.380  -8.491
  184   1HG2  VAL  59          HG21      VAL  59   2.799 -10.743 -10.717
  185   2HG2  VAL  59          HG22      VAL  59   1.153 -11.002 -11.296
  186   3HG2  VAL  59          HG23      VAL  59   1.820 -12.043 -10.038
  187    H    ASN  60           HN       ASN  60   0.350 -12.890  -8.336
  188    HA   ASN  60           HA       ASN  60  -0.266 -14.213 -10.689
  189   1HB   ASN  60          HB2       ASN  60   0.400 -14.975  -8.089
  190   2HB   ASN  60          HB1       ASN  60  -1.174 -15.717  -8.360
  191   1HD2  ASN  60          HD21      ASN  60  -0.480 -17.793  -8.496
  192   2HD2  ASN  60          HD22      ASN  60   0.522 -18.387  -9.772
  193    H    ARG  61           HN       ARG  61  -2.369 -13.008  -8.147
  194    HA   ARG  61           HA       ARG  61  -4.713 -13.906  -9.713
  195   1HB   ARG  61          HB2       ARG  61  -4.623 -13.056  -6.815
  196   2HB   ARG  61          HB1       ARG  61  -6.018 -13.699  -7.670
  197   1HG   ARG  61          HG2       ARG  61  -4.764 -15.813  -8.014
  198   2HG   ARG  61          HG1       ARG  61  -3.471 -15.158  -7.007
  199   1HD   ARG  61          HD2       ARG  61  -4.965 -14.994  -5.120
  200   2HD   ARG  61          HD1       ARG  61  -6.332 -15.494  -6.116
  201    HE   ARG  61           HE       ARG  61  -4.337 -17.188  -4.929
  202   1HH1  ARG  61          HH11      ARG  61  -6.676 -16.899  -7.504
  203   2HH1  ARG  61          HH12      ARG  61  -6.859 -18.610  -7.699
  204   1HH2  ARG  61          HH21      ARG  61  -4.580 -19.438  -5.181
  205   2HH2  ARG  61          HH22      ARG  61  -5.669 -20.052  -6.380
  206    H    ASP  62           HN       ASP  62  -3.048 -11.475 -10.179
  207    HA   ASP  62           HA       ASP  62  -3.553  -9.406 -11.110
  208   1HB   ASP  62          HB2       ASP  62  -6.178  -9.396  -9.620
  209   2HB   ASP  62          HB1       ASP  62  -5.721  -8.443 -11.027
  210    H    GLU  63           HN       GLU  63  -1.787  -8.994  -9.737
  211    HA   GLU  63           HA       GLU  63  -1.915  -8.064  -7.076
  212   1HB   GLU  63          HB2       GLU  63   0.141  -6.776  -7.548
  213   2HB   GLU  63          HB1       GLU  63   0.269  -8.423  -8.114
  214   1HG   GLU  63          HG2       GLU  63   1.155  -7.302  -9.891
  215   2HG   GLU  63          HG1       GLU  63  -0.535  -7.368 -10.385
  216    H    GLU  64           HN       GLU  64  -2.236  -6.587 -10.184
  217    HA   GLU  64           HA       GLU  64  -2.533  -3.921  -9.517
  218   1HB   GLU  64          HB2       GLU  64  -4.061  -3.773 -11.526
  219   2HB   GLU  64          HB1       GLU  64  -2.503  -4.525 -11.829
  220   1HG   GLU  64          HG2       GLU  64  -3.639  -6.747 -11.541
  221   2HG   GLU  64          HG1       GLU  64  -5.170  -5.874 -11.525
  222    H    PHE  65           HN       PHE  65  -4.943  -6.450  -9.637
  223    HA   PHE  65           HA       PHE  65  -7.205  -5.093  -8.877
  224   1HB   PHE  65          HB2       PHE  65  -6.889  -7.565  -9.556
  225   2HB   PHE  65          HB1       PHE  65  -6.609  -7.852  -7.842
  226    HD1  PHE  65           HD1      PHE  65  -8.397  -7.946  -6.314
  227    HD2  PHE  65           HD2      PHE  65  -9.074  -6.632 -10.305
  228    HE1  PHE  65           HE1      PHE  65 -10.826  -8.077  -5.941
  229    HE2  PHE  65           HE2      PHE  65 -11.504  -6.759  -9.939
  230    HZ   PHE  65           HZ       PHE  65 -12.382  -7.481  -7.754
  231    H    PHE  66           HN       PHE  66  -4.757  -6.626  -6.707
  232    HA   PHE  66           HA       PHE  66  -6.145  -6.048  -4.390
  233   1HB   PHE  66          HB2       PHE  66  -4.286  -7.430  -3.948
  234   2HB   PHE  66          HB1       PHE  66  -3.147  -6.246  -4.648
  235    HD1  PHE  66           HD1      PHE  66  -2.271  -4.523  -3.300
  236    HD2  PHE  66           HD2      PHE  66  -5.767  -6.615  -2.094
  237    HE1  PHE  66           HE1      PHE  66  -2.475  -3.060  -1.334
  238    HE2  PHE  66           HE2      PHE  66  -5.959  -5.186  -0.117
  239    HZ   PHE  66           HZ       PHE  66  -4.362  -3.373   0.204
  240    H    ALA  67           HN       ALA  67  -3.362  -3.973  -5.592
  241    HA   ALA  67           HA       ALA  67  -3.536  -2.043  -3.706
  242   1HB   ALA  67          HB1       ALA  67  -2.303  -0.760  -5.110
  243   2HB   ALA  67          HB2       ALA  67  -3.488  -0.863  -6.412
  244   3HB   ALA  67          HB3       ALA  67  -2.332  -2.173  -6.166
  245    H    LYS  68           HN       LYS  68  -5.701  -2.326  -6.550
  246    HA   LYS  68           HA       LYS  68  -7.328  -0.136  -6.133
  247   1HB   LYS  68          HB2       LYS  68  -8.344  -2.910  -6.796
  248   2HB   LYS  68          HB1       LYS  68  -9.148  -1.389  -7.146
  249   1HG   LYS  68          HG2       LYS  68  -7.463  -0.796  -8.744
  250   2HG   LYS  68          HG1       LYS  68  -6.495  -2.204  -8.308
  251   1HD   LYS  68          HD2       LYS  68  -8.661  -3.522  -8.960
  252   2HD   LYS  68          HD1       LYS  68  -9.037  -2.055  -9.867
  253   1HE   LYS  68          HE2       LYS  68  -6.304  -3.116 -10.192
  254   2HE   LYS  68          HE1       LYS  68  -7.600  -4.108 -10.859
  255   1HZ   LYS  68          HZ1       LYS  68  -8.045  -2.608 -12.455
  256   2HZ   LYS  68          HZ2       LYS  68  -6.453  -2.110 -12.180
  257   3HZ   LYS  68          HZ3       LYS  68  -7.735  -1.272 -11.464
  258    H    TYR  69           HN       TYR  69  -7.530  -3.284  -4.533
  259    HA   TYR  69           HA       TYR  69  -9.677  -3.107  -2.911
  260   1HB   TYR  69          HB2       TYR  69  -7.091  -4.531  -2.662
  261   2HB   TYR  69          HB1       TYR  69  -8.039  -4.367  -1.197
  262    HD1  TYR  69           HD1      TYR  69  -7.299  -6.839  -3.127
  263    HD2  TYR  69           HD2      TYR  69 -10.800  -4.549  -2.349
  264    HE1  TYR  69           HE1      TYR  69  -8.690  -8.750  -3.792
  265    HE2  TYR  69           HE2      TYR  69 -12.199  -6.455  -3.014
  266    HH   TYR  69           HH       TYR  69 -11.723  -9.169  -3.039
  267    H    LEU  70           HN       LEU  70  -6.405  -2.354  -1.718
  268    HA   LEU  70           HA       LEU  70  -7.150  -1.312   0.710
  269   1HB   LEU  70          HB2       LEU  70  -5.168   0.289   0.492
  270   2HB   LEU  70          HB1       LEU  70  -4.851  -1.432   0.421
  271    HG   LEU  70           HG       LEU  70  -4.930  -1.118  -2.138
  272   1HD1  LEU  70          HD11      LEU  70  -5.287   0.945  -2.903
  273   2HD1  LEU  70          HD12      LEU  70  -3.831   1.473  -2.080
  274   3HD1  LEU  70          HD13      LEU  70  -5.379   1.556  -1.254
  275   1HD2  LEU  70          HD21      LEU  70  -2.577   0.248  -0.957
  276   2HD2  LEU  70          HD22      LEU  70  -2.655  -1.059  -2.135
  277   3HD2  LEU  70          HD23      LEU  70  -2.936  -1.396  -0.428
  278    H    LEU  71           HN       LEU  71  -7.063   0.378  -2.366
  279    HA   LEU  71           HA       LEU  71  -7.939   2.892  -1.509
  280   1HB   LEU  71          HB2       LEU  71  -7.511   3.261  -3.669
  281   2HB   LEU  71          HB1       LEU  71  -7.498   1.542  -4.004
  282    HG   LEU  71           HG       LEU  71  -9.997   1.658  -4.268
  283   1HD1  LEU  71          HD11      LEU  71 -10.849   3.513  -3.291
  284   2HD1  LEU  71          HD12      LEU  71 -10.602   4.175  -4.907
  285   3HD1  LEU  71          HD13      LEU  71  -9.420   4.487  -3.635
  286   1HD2  LEU  71          HD21      LEU  71  -7.948   2.321  -6.046
  287   2HD2  LEU  71          HD22      LEU  71  -9.211   3.521  -6.318
  288   3HD2  LEU  71          HD23      LEU  71  -9.586   1.802  -6.446
  289    H    LYS  72           HN       LYS  72  -9.701   0.025  -2.678
  290    HA   LYS  72           HA       LYS  72 -12.304   0.956  -2.543
  291   1HB   LYS  72          HB2       LYS  72 -11.163  -1.474  -2.986
  292   2HB   LYS  72          HB1       LYS  72 -11.886  -1.741  -1.405
  293   1HG   LYS  72          HG2       LYS  72 -13.416  -0.656  -3.754
  294   2HG   LYS  72          HG1       LYS  72 -13.303  -2.376  -3.375
  295   1HD   LYS  72          HD2       LYS  72 -14.050  -1.441  -0.974
  296   2HD   LYS  72          HD1       LYS  72 -14.796  -0.219  -2.008
  297   1HE   LYS  72          HE2       LYS  72 -16.056  -1.857  -3.178
  298   2HE   LYS  72          HE1       LYS  72 -15.144  -3.175  -2.445
  299   1HZ   LYS  72          HZ1       LYS  72 -17.508  -2.386  -1.559
  300   2HZ   LYS  72          HZ2       LYS  72 -16.526  -1.384  -0.615
  301   3HZ   LYS  72          HZ3       LYS  72 -16.333  -3.063  -0.547
  302    H    GLU  73           HN       GLU  73 -10.311  -0.408   0.039
  303    HA   GLU  73           HA       GLU  73 -12.191  -0.263   2.111
  304   1HB   GLU  73          HB2       GLU  73  -9.181  -0.018   2.227
  305   2HB   GLU  73          HB1       GLU  73 -10.216  -0.264   3.627
  306   1HG   GLU  73          HG2       GLU  73 -10.877  -2.415   2.860
  307   2HG   GLU  73          HG1       GLU  73 -10.106  -2.157   1.295
  308    H    THR  74           HN       THR  74  -9.694   2.086   1.151
  309    HA   THR  74           HA       THR  74 -10.427   4.032   3.079
  310    HB   THR  74           HB       THR  74  -9.106   5.581   1.524
  311    HG1  THR  74           HG1      THR  74  -8.647   4.825  -0.358
  312   1HG2  THR  74          HG21      THR  74  -7.110   3.611   1.855
  313   2HG2  THR  74          HG22      THR  74  -8.197   3.518   3.239
  314   3HG2  THR  74          HG23      THR  74  -7.415   5.045   2.834
  315    H    GLY  75           HN       GLY  75 -10.711   4.340  -0.470
  316   1HA   GLY  75          HA2       GLY  75 -13.084   4.656  -1.276
  317   2HA   GLY  75          HA1       GLY  75 -13.201   5.861  -0.005
  318    H    SER  76           HN       SER  76 -10.555   6.956  -0.407
  319    HA   SER  76           HA       SER  76 -11.132   8.963  -2.243
  320   1HB   SER  76          HB2       SER  76  -9.495   9.606  -0.755
  321   2HB   SER  76          HB1       SER  76  -8.656   8.059  -0.842
  322    HG   SER  76           HG       SER  76  -8.533  10.255  -2.590
  323    H    ALA  77           HN       ALA  77  -8.131   7.241  -2.890
  324    HA   ALA  77           HA       ALA  77  -9.101   6.097  -5.360
  325   1HB   ALA  77          HB1       ALA  77  -7.303   7.412  -6.670
  326   2HB   ALA  77          HB2       ALA  77  -7.408   8.570  -5.344
  327   3HB   ALA  77          HB3       ALA  77  -8.837   8.205  -6.310
  328    H    GLY  78           HN       GLY  78  -7.557   4.633  -6.311
  329   1HA   GLY  78          HA2       GLY  78  -5.154   4.234  -4.640
  330   2HA   GLY  78          HA1       GLY  78  -6.187   2.887  -5.069
  331    H    ASN  79           HN       ASN  79  -3.401   3.180  -5.556
  332    HA   ASN  79           HA       ASN  79  -3.351   2.998  -8.498
  333   1HB   ASN  79          HB2       ASN  79  -2.248   5.081  -7.348
  334   2HB   ASN  79          HB1       ASN  79  -0.990   3.939  -6.885
  335   1HD2  ASN  79          HD21      ASN  79  -0.534   6.146  -8.511
  336   2HD2  ASN  79          HD22      ASN  79  -0.106   5.593 -10.090
  337    H    LEU  80           HN       LEU  80  -2.300   1.197  -9.261
  338    HA   LEU  80           HA       LEU  80  -1.075  -0.608  -7.254
  339   1HB   LEU  80          HB2       LEU  80  -1.722  -2.415  -8.770
  340   2HB   LEU  80          HB1       LEU  80  -3.116  -1.464  -8.290
  341    HG   LEU  80           HG       LEU  80  -2.351  -0.221 -10.614
  342   1HD1  LEU  80          HD11      LEU  80  -0.935  -1.578 -11.676
  343   2HD1  LEU  80          HD12      LEU  80  -2.366  -2.544 -12.030
  344   3HD1  LEU  80          HD13      LEU  80  -1.337  -2.961 -10.659
  345   1HD2  LEU  80          HD21      LEU  80  -4.624  -0.696 -10.072
  346   2HD2  LEU  80          HD22      LEU  80  -4.342  -2.433 -10.168
  347   3HD2  LEU  80          HD23      LEU  80  -4.274  -1.448 -11.627
  348    H    GLU  81           HN       GLU  81   0.973  -1.372  -7.605
  349    HA   GLU  81           HA       GLU  81   2.243  -0.781 -10.212
  350   1HB   GLU  81          HB2       GLU  81   3.076   0.823  -8.579
  351   2HB   GLU  81          HB1       GLU  81   3.370  -0.460  -7.416
  352   1HG   GLU  81          HG2       GLU  81   5.453  -0.548  -8.156
  353   2HG   GLU  81          HG1       GLU  81   4.826  -1.193  -9.673
  354    H    GLY  82           HN       GLY  82   3.436  -2.543 -11.010
  355   1HA   GLY  82          HA2       GLY  82   2.944  -5.106  -9.970
  356   2HA   GLY  82          HA1       GLY  82   4.172  -4.715 -11.155
  357    H    GLY  83           HN       GLY  83   3.609  -4.480  -7.593
  358   1HA   GLY  83          HA2       GLY  83   5.568  -6.056  -6.689
  359   2HA   GLY  83          HA1       GLY  83   6.491  -4.648  -7.119
  360    H    ARG  84           HN       ARG  84   4.318  -2.983  -6.352
  361    HA   ARG  84           HA       ARG  84   4.219  -3.139  -3.435
  362   1HB   ARG  84          HB2       ARG  84   4.442  -0.530  -3.706
  363   2HB   ARG  84          HB1       ARG  84   5.896  -1.514  -3.746
  364   1HG   ARG  84          HG2       ARG  84   4.762  -1.168  -6.387
  365   2HG   ARG  84          HG1       ARG  84   5.120   0.374  -5.610
  366   1HD   ARG  84          HD2       ARG  84   7.355  -1.036  -5.013
  367   2HD   ARG  84          HD1       ARG  84   6.932  -1.734  -6.576
  368    HE   ARG  84           HE       ARG  84   6.767   0.919  -7.038
  369   1HH1  ARG  84          HH11      ARG  84   9.248  -1.095  -5.633
  370   2HH1  ARG  84          HH12      ARG  84  10.547  -0.073  -6.151
  371   1HH2  ARG  84          HH21      ARG  84   8.475   2.265  -7.722
  372   2HH2  ARG  84          HH22      ARG  84  10.109   1.832  -7.339
  373    H    LEU  85           HN       LEU  85   2.337  -2.354  -2.647
  374    HA   LEU  85           HA       LEU  85   0.186  -1.658  -4.653
  375   1HB   LEU  85          HB2       LEU  85  -1.314  -2.192  -2.624
  376   2HB   LEU  85          HB1       LEU  85  -0.577  -3.519  -3.488
  377    HG   LEU  85           HG       LEU  85   1.265  -3.257  -1.587
  378   1HD1  LEU  85          HD11      LEU  85   0.634  -2.265   0.331
  379   2HD1  LEU  85          HD12      LEU  85  -1.055  -2.733   0.140
  380   3HD1  LEU  85          HD13      LEU  85  -0.424  -1.338  -0.734
  381   1HD2  LEU  85          HD21      LEU  85  -1.066  -4.644  -0.521
  382   2HD2  LEU  85          HD22      LEU  85   0.512  -5.276  -0.986
  383   3HD2  LEU  85          HD23      LEU  85  -0.732  -5.038  -2.206
  384    H    ILE  86           HN       ILE  86  -0.674   0.389  -4.473
  385    HA   ILE  86           HA       ILE  86   0.289   2.101  -2.259
  386    HB   ILE  86           HB       ILE  86  -0.413   2.841  -5.108
  387   1HG1  ILE  86          HG12      ILE  86   2.318   2.929  -3.847
  388   2HG1  ILE  86          HG11      ILE  86   1.721   1.487  -4.659
  389   1HG2  ILE  86          HG21      ILE  86   1.077   4.668  -3.303
  390   2HG2  ILE  86          HG22      ILE  86  -0.670   4.535  -3.103
  391   3HG2  ILE  86          HG23      ILE  86   0.004   5.035  -4.653
  392   1HD1  ILE  86          HD11      ILE  86   3.154   3.356  -5.889
  393   2HD1  ILE  86          HD12      ILE  86   1.545   4.027  -6.155
  394   3HD1  ILE  86          HD13      ILE  86   1.924   2.399  -6.716
  395    H    LEU  87           HN       LEU  87  -1.146   3.350  -1.172
  396    HA   LEU  87           HA       LEU  87  -3.942   3.372  -2.099
  397   1HB   LEU  87          HB2       LEU  87  -4.730   3.107   0.120
  398   2HB   LEU  87          HB1       LEU  87  -3.506   1.879  -0.100
  399    HG   LEU  87           HG       LEU  87  -3.228   2.717   2.081
  400   1HD1  LEU  87          HD11      LEU  87  -1.167   2.493   0.596
  401   2HD1  LEU  87          HD12      LEU  87  -1.001   3.373   2.115
  402   3HD1  LEU  87          HD13      LEU  87  -1.134   4.256   0.596
  403   1HD2  LEU  87          HD21      LEU  87  -3.818   4.750   2.725
  404   2HD2  LEU  87          HD22      LEU  87  -4.260   5.102   1.054
  405   3HD2  LEU  87          HD23      LEU  87  -2.644   5.494   1.640
  406    H    GLN  88           HN       GLN  88  -4.883   5.338  -2.128
  407    HA   GLN  88           HA       GLN  88  -3.334   7.573  -0.994
  408   1HB   GLN  88          HB2       GLN  88  -5.108   7.753  -3.428
  409   2HB   GLN  88          HB1       GLN  88  -4.025   8.988  -2.801
  410   1HG   GLN  88          HG2       GLN  88  -2.108   7.539  -3.319
  411   2HG   GLN  88          HG1       GLN  88  -3.216   6.351  -4.006
  412   1HE2  GLN  88          HE21      GLN  88  -2.134   6.536  -5.998
  413   2HE2  GLN  88          HE22      GLN  88  -2.405   7.885  -7.044
  414    H    ARG  89           HN       ARG  89  -4.322   8.076   0.818
  415    HA   ARG  89           HA       ARG  89  -7.217   7.958   1.033
  416   1HB   ARG  89          HB2       ARG  89  -5.203   7.532   2.829
  417   2HB   ARG  89          HB1       ARG  89  -5.703   9.164   3.251
  418   1HG   ARG  89          HG2       ARG  89  -7.938   7.327   2.872
  419   2HG   ARG  89          HG1       ARG  89  -6.842   6.853   4.171
  420   1HD   ARG  89          HD2       ARG  89  -7.753   8.383   5.496
  421   2HD   ARG  89          HD1       ARG  89  -7.268   9.651   4.371
  422    HE   ARG  89           HE       ARG  89  -9.454   9.847   3.777
  423   1HH1  ARG  89          HH11      ARG  89  -8.969   6.630   5.043
  424   2HH1  ARG  89          HH12      ARG  89 -10.642   6.198   4.927
  425   1HH2  ARG  89          HH21      ARG  89 -11.653   9.280   3.624
  426   2HH2  ARG  89          HH22      ARG  89 -12.166   7.701   4.120
  427    H    ARG  90           HN       ARG  90  -8.365   9.834   2.089
  428    HA   ARG  90           HA       ARG  90  -7.959  12.170   0.484
  429   1HB   ARG  90          HB2       ARG  90  -9.971  11.253   2.470
  430   2HB   ARG  90          HB1       ARG  90  -9.837  12.986   2.210
  431   1HG   ARG  90          HG2       ARG  90 -10.887  12.878   0.253
  432   2HG   ARG  90          HG1       ARG  90  -9.924  11.500  -0.282
  433   1HD   ARG  90          HD2       ARG  90 -11.593  10.093   0.142
  434   2HD   ARG  90          HD1       ARG  90 -11.751  10.698   1.790
  435    HE   ARG  90           HE       ARG  90 -12.955  12.571   0.153
  436   1HH1  ARG  90          HH11      ARG  90 -13.402   9.198   0.930
  437   2HH1  ARG  90          HH12      ARG  90 -15.110   9.231   0.653
  438   1HH2  ARG  90          HH21      ARG  90 -15.206  12.615  -0.212
  439   2HH2  ARG  90          HH22      ARG  90 -16.135  11.169   0.006
  Start of MODEL    8
    1    H    GLU  39           HN       GLU  39   4.302  -2.277   5.052
    2    HA   GLU  39           HA       GLU  39   5.446   0.175   6.015
    3   1HB   GLU  39          HB2       GLU  39   5.900  -1.637   3.696
    4   2HB   GLU  39          HB1       GLU  39   6.468   0.021   3.562
    5   1HG   GLU  39          HG2       GLU  39   7.191  -1.249   6.083
    6   2HG   GLU  39          HG1       GLU  39   7.852  -2.064   4.665
    7    H    ILE  40           HN       ILE  40   4.022   1.839   6.011
    8    HA   ILE  40           HA       ILE  40   2.837   2.589   3.408
    9    HB   ILE  40           HB       ILE  40   1.028   3.691   4.682
   10   1HG1  ILE  40          HG12      ILE  40   1.208   2.390   7.188
   11   2HG1  ILE  40          HG11      ILE  40   2.780   3.128   6.896
   12   1HG2  ILE  40          HG21      ILE  40  -0.188   1.826   4.565
   13   2HG2  ILE  40          HG22      ILE  40   0.766   1.025   5.813
   14   3HG2  ILE  40          HG23      ILE  40   1.314   1.007   4.138
   15   1HD1  ILE  40          HD11      ILE  40   0.718   4.402   8.034
   16   2HD1  ILE  40          HD12      ILE  40   0.445   4.829   6.345
   17   3HD1  ILE  40          HD13      ILE  40   1.984   5.218   7.115
   18    H    LEU  41           HN       LEU  41   3.324   4.615   2.681
   19    HA   LEU  41           HA       LEU  41   4.533   6.519   4.595
   20   1HB   LEU  41          HB2       LEU  41   5.743   5.263   2.309
   21   2HB   LEU  41          HB1       LEU  41   5.603   6.986   2.012
   22    HG   LEU  41           HG       LEU  41   7.773   6.469   2.965
   23   1HD1  LEU  41          HD11      LEU  41   7.830   8.281   4.308
   24   2HD1  LEU  41          HD12      LEU  41   6.479   7.729   5.297
   25   3HD1  LEU  41          HD13      LEU  41   6.176   8.485   3.733
   26   1HD2  LEU  41          HD21      LEU  41   7.517   5.797   5.551
   27   2HD2  LEU  41          HD22      LEU  41   7.746   4.618   4.259
   28   3HD2  LEU  41          HD23      LEU  41   6.128   4.943   4.881
   29    H    ILE  42           HN       ILE  42   3.689   8.581   4.447
   30    HA   ILE  42           HA       ILE  42   1.989   9.082   2.091
   31    HB   ILE  42           HB       ILE  42   0.413  10.251   3.379
   32   1HG1  ILE  42          HG12      ILE  42   1.957  11.590   4.743
   33   2HG1  ILE  42          HG11      ILE  42   0.705  10.859   5.738
   34   1HG2  ILE  42          HG21      ILE  42   0.532   8.486   5.571
   35   2HG2  ILE  42          HG22      ILE  42   1.171   7.618   4.178
   36   3HG2  ILE  42          HG23      ILE  42  -0.435   8.339   4.105
   37   1HD1  ILE  42          HD11      ILE  42   3.615  10.345   5.670
   38   2HD1  ILE  42          HD12      ILE  42   2.550   8.983   6.021
   39   3HD1  ILE  42          HD13      ILE  42   2.502  10.423   7.037
   40    H    GLU  43           HN       GLU  43   2.408  10.783   0.915
   41    HA   GLU  43           HA       GLU  43   3.963  13.040   2.003
   42   1HB   GLU  43          HB2       GLU  43   4.356  11.543  -0.607
   43   2HB   GLU  43          HB1       GLU  43   5.049  13.129  -0.298
   44   1HG   GLU  43          HG2       GLU  43   5.618  10.631   1.283
   45   2HG   GLU  43          HG1       GLU  43   6.667  11.336   0.054
   46    H    GLY  44           HN       GLY  44   3.081  15.029   1.335
   47   1HA   GLY  44          HA2       GLY  44   1.526  16.458   0.404
   48   2HA   GLY  44          HA1       GLY  44   1.746  15.502  -1.053
   49    H    ASN  45           HN       ASN  45   0.248  13.832  -1.544
   50    HA   ASN  45           HA       ASN  45  -2.059  13.548   0.235
   51   1HB   ASN  45          HB2       ASN  45  -3.627  13.897  -1.662
   52   2HB   ASN  45          HB1       ASN  45  -2.722  15.343  -1.228
   53   1HD2  ASN  45          HD21      ASN  45  -2.757  12.621  -3.471
   54   2HD2  ASN  45          HD22      ASN  45  -2.025  13.467  -4.788
   55    H    ARG  46           HN       ARG  46   0.185  12.075  -1.740
   56    HA   ARG  46           HA       ARG  46  -1.525   9.715  -2.219
   57   1HB   ARG  46          HB2       ARG  46   0.234   9.121  -3.906
   58   2HB   ARG  46          HB1       ARG  46  -0.621  10.614  -4.271
   59   1HG   ARG  46          HG2       ARG  46   1.241  11.919  -3.431
   60   2HG   ARG  46          HG1       ARG  46   2.092  10.442  -2.973
   61   1HD   ARG  46          HD2       ARG  46   2.239   9.761  -5.283
   62   2HD   ARG  46          HD1       ARG  46   1.267  11.142  -5.787
   63    HE   ARG  46           HE       ARG  46   3.405  12.240  -4.488
   64   1HH1  ARG  46          HH11      ARG  46   3.012  10.066  -7.189
   65   2HH1  ARG  46          HH12      ARG  46   4.463  10.585  -7.979
   66   1HH2  ARG  46          HH21      ARG  46   5.314  12.923  -5.526
   67   2HH2  ARG  46          HH22      ARG  46   5.771  12.206  -7.035
   68    H    THR  47           HN       THR  47  -0.915   7.765  -1.331
   69    HA   THR  47           HA       THR  47   1.627   7.691   0.179
   70    HB   THR  47           HB       THR  47  -1.073   6.514   0.837
   71    HG1  THR  47           HG1      THR  47  -0.767   8.698   1.416
   72   1HG2  THR  47          HG21      THR  47  -0.263   5.195   2.455
   73   2HG2  THR  47          HG22      THR  47   1.060   6.295   2.835
   74   3HG2  THR  47          HG23      THR  47   1.191   5.207   1.456
   75    H    ILE  48           HN       ILE  48   2.874   5.914  -0.149
   76    HA   ILE  48           HA       ILE  48   1.898   3.860  -2.044
   77    HB   ILE  48           HB       ILE  48   3.807   5.180  -2.860
   78   1HG1  ILE  48          HG12      ILE  48   5.138   2.611  -2.237
   79   2HG1  ILE  48          HG11      ILE  48   3.543   2.490  -2.971
   80   1HG2  ILE  48          HG21      ILE  48   4.663   5.068  -0.204
   81   2HG2  ILE  48          HG22      ILE  48   5.499   5.810  -1.567
   82   3HG2  ILE  48          HG23      ILE  48   5.852   4.143  -1.119
   83   1HD1  ILE  48          HD11      ILE  48   5.923   3.944  -4.096
   84   2HD1  ILE  48          HD12      ILE  48   4.316   3.908  -4.823
   85   3HD1  ILE  48          HD13      ILE  48   5.249   2.419  -4.669
   86    H    ILE  49           HN       ILE  49   1.986   1.686  -1.417
   87    HA   ILE  49           HA       ILE  49   3.227   1.178   1.204
   88    HB   ILE  49           HB       ILE  49   0.820  -0.237   0.100
   89   1HG1  ILE  49          HG12      ILE  49   1.070   1.783   2.328
   90   2HG1  ILE  49          HG11      ILE  49   0.296   2.058   0.771
   91   1HG2  ILE  49          HG21      ILE  49   2.691  -1.085   1.983
   92   2HG2  ILE  49          HG22      ILE  49   1.104  -1.785   1.668
   93   3HG2  ILE  49          HG23      ILE  49   1.293  -0.558   2.920
   94   1HD1  ILE  49          HD11      ILE  49  -1.535   0.765   1.308
   95   2HD1  ILE  49          HD12      ILE  49  -1.154   1.542   2.844
   96   3HD1  ILE  49          HD13      ILE  49  -0.670  -0.129   2.556
   97    H    ARG  50           HN       ARG  50   4.696  -0.274   1.300
   98    HA   ARG  50           HA       ARG  50   5.474  -1.723  -1.082
   99   1HB   ARG  50          HB2       ARG  50   6.716  -1.395   1.646
  100   2HB   ARG  50          HB1       ARG  50   7.380  -2.486   0.438
  101   1HG   ARG  50          HG2       ARG  50   7.137  -0.188  -0.993
  102   2HG   ARG  50          HG1       ARG  50   7.508   0.432   0.617
  103   1HD   ARG  50          HD2       ARG  50   9.562  -0.656   0.698
  104   2HD   ARG  50          HD1       ARG  50   9.113  -1.803  -0.564
  105    HE   ARG  50           HE       ARG  50   9.790  -0.286  -2.144
  106   1HH1  ARG  50          HH11      ARG  50   9.521   1.325   0.941
  107   2HH1  ARG  50          HH12      ARG  50  10.261   2.788   0.383
  108   1HH2  ARG  50          HH21      ARG  50  10.764   1.639  -2.880
  109   2HH2  ARG  50          HH22      ARG  50  10.965   2.966  -1.787
  110    H    ASN  51           HN       ASN  51   3.161  -2.761  -0.602
  111    HA   ASN  51           HA       ASN  51   3.321  -4.993   1.220
  112   1HB   ASN  51          HB2       ASN  51   1.216  -3.600   0.708
  113   2HB   ASN  51          HB1       ASN  51   1.125  -4.536  -0.781
  114   1HD2  ASN  51          HD21      ASN  51   1.326  -4.868   2.729
  115   2HD2  ASN  51          HD22      ASN  51   0.396  -6.321   2.822
  116    H    PHE  52           HN       PHE  52   4.983  -4.652  -1.298
  117    HA   PHE  52           HA       PHE  52   4.356  -6.307  -3.293
  118   1HB   PHE  52          HB2       PHE  52   6.483  -4.973  -3.099
  119   2HB   PHE  52          HB1       PHE  52   7.159  -6.360  -2.243
  120    HD1  PHE  52           HD1      PHE  52   8.817  -6.205  -4.248
  121    HD2  PHE  52           HD2      PHE  52   4.737  -7.366  -4.635
  122    HE1  PHE  52           HE1      PHE  52   9.318  -7.295  -6.400
  123    HE2  PHE  52           HE2      PHE  52   5.215  -8.446  -6.772
  124    HZ   PHE  52           HZ       PHE  52   7.525  -8.419  -7.664
  125    H    ARG  53           HN       ARG  53   5.695  -7.637  -0.208
  126    HA   ARG  53           HA       ARG  53   6.065 -10.217  -1.223
  127   1HB   ARG  53          HB2       ARG  53   6.349  -9.085   1.229
  128   2HB   ARG  53          HB1       ARG  53   4.961 -10.125   1.507
  129   1HG   ARG  53          HG2       ARG  53   6.170 -12.067   0.957
  130   2HG   ARG  53          HG1       ARG  53   7.492 -11.134   0.252
  131   1HD   ARG  53          HD2       ARG  53   6.745 -10.901   3.152
  132   2HD   ARG  53          HD1       ARG  53   7.858 -12.137   2.572
  133    HE   ARG  53           HE       ARG  53   9.436 -10.487   2.113
  134   1HH1  ARG  53          HH11      ARG  53   6.455  -9.067   3.260
  135   2HH1  ARG  53          HH12      ARG  53   7.173  -7.527   3.584
  136   1HH2  ARG  53          HH21      ARG  53  10.373  -8.461   2.541
  137   2HH2  ARG  53          HH22      ARG  53   9.393  -7.182   3.179
  138    H    GLU  54           HN       GLU  54   3.301  -9.530   0.921
  139    HA   GLU  54           HA       GLU  54   1.731 -11.684   0.176
  140   1HB   GLU  54          HB2       GLU  54   0.791  -8.951   1.079
  141   2HB   GLU  54          HB1       GLU  54  -0.181 -10.416   1.089
  142   1HG   GLU  54          HG2       GLU  54   2.096 -11.101   2.510
  143   2HG   GLU  54          HG1       GLU  54   1.741  -9.451   3.020
  144    H    LEU  55           HN       LEU  55   1.684  -8.382  -1.034
  145    HA   LEU  55           HA       LEU  55  -0.334  -8.507  -2.888
  146   1HB   LEU  55          HB2       LEU  55   1.006  -6.493  -2.231
  147   2HB   LEU  55          HB1       LEU  55   2.281  -7.066  -3.290
  148    HG   LEU  55           HG       LEU  55  -0.499  -6.552  -4.308
  149   1HD1  LEU  55          HD11      LEU  55   1.389  -4.609  -3.359
  150   2HD1  LEU  55          HD12      LEU  55  -0.228  -4.373  -4.020
  151   3HD1  LEU  55          HD13      LEU  55   1.162  -4.445  -5.101
  152   1HD2  LEU  55          HD21      LEU  55   2.120  -7.263  -5.442
  153   2HD2  LEU  55          HD22      LEU  55   1.221  -6.020  -6.314
  154   3HD2  LEU  55          HD23      LEU  55   0.491  -7.601  -6.033
  155    H    ALA  56           HN       ALA  56   3.048  -9.422  -3.329
  156    HA   ALA  56           HA       ALA  56   3.177  -9.948  -5.989
  157   1HB   ALA  56          HB1       ALA  56   5.118 -10.114  -4.537
  158   2HB   ALA  56          HB2       ALA  56   4.926 -11.593  -5.476
  159   3HB   ALA  56          HB3       ALA  56   4.446 -11.559  -3.780
  160    H    LYS  57           HN       LYS  57   2.195 -12.198  -3.403
  161    HA   LYS  57           HA       LYS  57   1.479 -14.363  -5.046
  162   1HB   LYS  57          HB2       LYS  57   0.686 -13.396  -2.369
  163   2HB   LYS  57          HB1       LYS  57  -0.530 -14.380  -3.171
  164   1HG   LYS  57          HG2       LYS  57   0.559 -16.118  -2.307
  165   2HG   LYS  57          HG1       LYS  57   1.753 -15.833  -3.575
  166   1HD   LYS  57          HD2       LYS  57   3.074 -15.886  -1.680
  167   2HD   LYS  57          HD1       LYS  57   2.773 -14.158  -1.862
  168   1HE   LYS  57          HE2       LYS  57   0.819 -14.471  -0.283
  169   2HE   LYS  57          HE1       LYS  57   1.456 -16.082   0.040
  170   1HZ   LYS  57          HZ1       LYS  57   3.063 -13.616   0.384
  171   2HZ   LYS  57          HZ2       LYS  57   3.426 -15.173   0.935
  172   3HZ   LYS  57          HZ3       LYS  57   2.154 -14.304   1.634
  173    H    ALA  58           HN       ALA  58  -0.337 -11.547  -4.019
  174    HA   ALA  58           HA       ALA  58  -2.735 -11.914  -5.314
  175   1HB   ALA  58          HB1       ALA  58  -3.208  -9.822  -4.653
  176   2HB   ALA  58          HB2       ALA  58  -1.734  -9.155  -5.352
  177   3HB   ALA  58          HB3       ALA  58  -1.682  -9.951  -3.779
  178    H    VAL  59           HN       VAL  59   0.229 -10.341  -6.666
  179    HA   VAL  59           HA       VAL  59  -0.899  -9.572  -9.033
  180    HB   VAL  59           HB       VAL  59   1.036  -8.859  -9.676
  181   1HG1  VAL  59          HG11      VAL  59   2.760  -8.689  -8.162
  182   2HG1  VAL  59          HG12      VAL  59   2.574 -10.343  -7.589
  183   3HG1  VAL  59          HG13      VAL  59   1.408  -9.107  -7.111
  184   1HG2  VAL  59          HG21      VAL  59   2.043 -11.709  -9.574
  185   2HG2  VAL  59          HG22      VAL  59   2.944 -10.351 -10.248
  186   3HG2  VAL  59          HG23      VAL  59   1.418 -10.846 -10.979
  187    H    ASN  60           HN       ASN  60   0.498 -12.758  -8.358
  188    HA   ASN  60           HA       ASN  60   0.068 -13.915 -10.845
  189   1HB   ASN  60          HB2       ASN  60  -0.365 -15.156  -8.111
  190   2HB   ASN  60          HB1       ASN  60  -0.243 -16.059  -9.619
  191   1HD2  ASN  60          HD21      ASN  60   1.473 -14.146  -7.274
  192   2HD2  ASN  60          HD22      ASN  60   3.064 -14.599  -7.773
  193    H    ARG  61           HN       ARG  61  -2.152 -13.103  -8.258
  194    HA   ARG  61           HA       ARG  61  -4.429 -14.063  -9.874
  195   1HB   ARG  61          HB2       ARG  61  -3.857 -14.181  -7.105
  196   2HB   ARG  61          HB1       ARG  61  -5.233 -13.102  -7.295
  197   1HG   ARG  61          HG2       ARG  61  -6.612 -14.755  -7.981
  198   2HG   ARG  61          HG1       ARG  61  -5.324 -15.643  -8.800
  199   1HD   ARG  61          HD2       ARG  61  -4.438 -16.269  -6.547
  200   2HD   ARG  61          HD1       ARG  61  -5.881 -15.542  -5.840
  201    HE   ARG  61           HE       ARG  61  -7.028 -17.426  -6.400
  202   1HH1  ARG  61          HH11      ARG  61  -4.184 -17.244  -8.414
  203   2HH1  ARG  61          HH12      ARG  61  -4.454 -18.787  -9.152
  204   1HH2  ARG  61          HH21      ARG  61  -7.385 -19.457  -7.367
  205   2HH2  ARG  61          HH22      ARG  61  -6.271 -20.045  -8.556
  206    H    ASP  62           HN       ASP  62  -2.872 -11.512 -10.247
  207    HA   ASP  62           HA       ASP  62  -3.443  -9.475 -11.198
  208   1HB   ASP  62          HB2       ASP  62  -6.031 -10.533 -10.753
  209   2HB   ASP  62          HB1       ASP  62  -6.009  -8.922 -10.043
  210    H    GLU  63           HN       GLU  63  -1.813  -8.872  -9.833
  211    HA   GLU  63           HA       GLU  63  -2.006  -8.002  -7.177
  212   1HB   GLU  63          HB2       GLU  63  -0.117  -6.534  -7.624
  213   2HB   GLU  63          HB1       GLU  63   0.155  -8.093  -8.346
  214   1HG   GLU  63          HG2       GLU  63  -0.755  -5.632  -9.815
  215   2HG   GLU  63          HG1       GLU  63   0.899  -6.223  -9.754
  216    H    GLU  64           HN       GLU  64  -2.545  -6.508 -10.241
  217    HA   GLU  64           HA       GLU  64  -3.076  -3.894  -9.574
  218   1HB   GLU  64          HB2       GLU  64  -4.336  -5.679 -11.637
  219   2HB   GLU  64          HB1       GLU  64  -4.821  -3.996 -11.480
  220   1HG   GLU  64          HG2       GLU  64  -2.493  -3.309 -11.866
  221   2HG   GLU  64          HG1       GLU  64  -2.050  -5.003 -12.083
  222    H    PHE  65           HN       PHE  65  -5.345  -6.574  -9.586
  223    HA   PHE  65           HA       PHE  65  -7.616  -5.260  -8.714
  224   1HB   PHE  65          HB2       PHE  65  -7.333  -7.682  -9.535
  225   2HB   PHE  65          HB1       PHE  65  -6.956  -8.067  -7.860
  226    HD1  PHE  65           HD1      PHE  65  -9.538  -6.258  -9.854
  227    HD2  PHE  65           HD2      PHE  65  -8.682  -8.723  -6.492
  228    HE1  PHE  65           HE1      PHE  65 -11.943  -6.414  -9.360
  229    HE2  PHE  65           HE2      PHE  65 -11.086  -8.883  -5.992
  230    HZ   PHE  65           HZ       PHE  65 -12.721  -7.727  -7.428
  231    H    PHE  66           HN       PHE  66  -5.095  -6.892  -6.702
  232    HA   PHE  66           HA       PHE  66  -6.414  -6.453  -4.326
  233   1HB   PHE  66          HB2       PHE  66  -4.508  -7.818  -4.025
  234   2HB   PHE  66          HB1       PHE  66  -3.415  -6.544  -4.639
  235    HD1  PHE  66           HD1      PHE  66  -6.178  -6.939  -2.210
  236    HD2  PHE  66           HD2      PHE  66  -2.418  -5.147  -3.069
  237    HE1  PHE  66           HE1      PHE  66  -6.359  -5.617  -0.163
  238    HE2  PHE  66           HE2      PHE  66  -2.575  -3.849  -0.983
  239    HZ   PHE  66           HZ       PHE  66  -4.600  -4.043   0.401
  240    H    ALA  67           HN       ALA  67  -3.703  -4.229  -5.447
  241    HA   ALA  67           HA       ALA  67  -3.919  -2.412  -3.465
  242   1HB   ALA  67          HB1       ALA  67  -2.343  -1.896  -5.128
  243   2HB   ALA  67          HB2       ALA  67  -3.553  -0.627  -5.323
  244   3HB   ALA  67          HB3       ALA  67  -3.535  -2.004  -6.423
  245    H    LYS  68           HN       LYS  68  -6.073  -2.664  -6.294
  246    HA   LYS  68           HA       LYS  68  -7.775  -0.551  -5.909
  247   1HB   LYS  68          HB2       LYS  68  -7.865  -2.647  -7.544
  248   2HB   LYS  68          HB1       LYS  68  -9.023  -3.230  -6.357
  249   1HG   LYS  68          HG2       LYS  68 -10.392  -2.175  -7.865
  250   2HG   LYS  68          HG1       LYS  68 -10.122  -0.896  -6.680
  251   1HD   LYS  68          HD2       LYS  68  -9.383   0.403  -8.328
  252   2HD   LYS  68          HD1       LYS  68  -8.017  -0.696  -8.527
  253   1HE   LYS  68          HE2       LYS  68 -10.660  -1.277  -9.815
  254   2HE   LYS  68          HE1       LYS  68  -9.511  -0.174 -10.569
  255   1HZ   LYS  68          HZ1       LYS  68  -7.852  -1.971 -10.482
  256   2HZ   LYS  68          HZ2       LYS  68  -9.193  -2.372 -11.432
  257   3HZ   LYS  68          HZ3       LYS  68  -9.033  -3.021  -9.878
  258    H    TYR  69           HN       TYR  69  -7.827  -3.648  -4.217
  259    HA   TYR  69           HA       TYR  69  -9.982  -3.359  -2.529
  260   1HB   TYR  69          HB2       TYR  69  -7.465  -4.940  -2.405
  261   2HB   TYR  69          HB1       TYR  69  -8.377  -4.757  -0.917
  262    HD1  TYR  69           HD1      TYR  69 -11.141  -4.866  -1.751
  263    HD2  TYR  69           HD2      TYR  69  -7.824  -7.109  -3.186
  264    HE1  TYR  69           HE1      TYR  69 -12.663  -6.672  -2.432
  265    HE2  TYR  69           HE2      TYR  69  -9.336  -8.920  -3.871
  266    HH   TYR  69           HH       TYR  69 -12.381  -8.675  -4.393
  267    H    LEU  70           HN       LEU  70  -6.599  -2.899  -1.531
  268    HA   LEU  70           HA       LEU  70  -7.041  -1.735   0.908
  269   1HB   LEU  70          HB2       LEU  70  -4.821  -2.169  -0.542
  270   2HB   LEU  70          HB1       LEU  70  -4.936  -0.426  -0.716
  271    HG   LEU  70           HG       LEU  70  -5.314  -1.189   2.044
  272   1HD1  LEU  70          HD11      LEU  70  -3.116  -2.495   0.576
  273   2HD1  LEU  70          HD12      LEU  70  -3.934  -2.972   2.063
  274   3HD1  LEU  70          HD13      LEU  70  -2.691  -1.722   2.103
  275   1HD2  LEU  70          HD21      LEU  70  -3.236   0.323   2.206
  276   2HD2  LEU  70          HD22      LEU  70  -4.746   1.023   1.623
  277   3HD2  LEU  70          HD23      LEU  70  -3.478   0.584   0.479
  278    H    LEU  71           HN       LEU  71  -6.924  -0.113  -2.207
  279    HA   LEU  71           HA       LEU  71  -7.397   2.506  -1.389
  280   1HB   LEU  71          HB2       LEU  71  -6.749   2.157  -3.639
  281   2HB   LEU  71          HB1       LEU  71  -8.037   1.005  -3.918
  282    HG   LEU  71           HG       LEU  71  -8.284   3.281  -5.006
  283   1HD1  LEU  71          HD11      LEU  71 -10.127   1.505  -4.227
  284   2HD1  LEU  71          HD12      LEU  71 -10.515   3.002  -5.073
  285   3HD1  LEU  71          HD13      LEU  71 -10.670   2.916  -3.319
  286   1HD2  LEU  71          HD21      LEU  71  -9.347   4.990  -3.478
  287   2HD2  LEU  71          HD22      LEU  71  -7.607   4.766  -3.302
  288   3HD2  LEU  71          HD23      LEU  71  -8.713   4.048  -2.132
  289    H    LYS  72           HN       LYS  72  -9.640  -0.092  -2.345
  290    HA   LYS  72           HA       LYS  72 -12.051   1.247  -2.071
  291   1HB   LYS  72          HB2       LYS  72 -11.456  -1.600  -1.236
  292   2HB   LYS  72          HB1       LYS  72 -13.056  -0.937  -1.524
  293   1HG   LYS  72          HG2       LYS  72 -11.335  -0.494  -3.793
  294   2HG   LYS  72          HG1       LYS  72 -11.402  -2.205  -3.364
  295   1HD   LYS  72          HD2       LYS  72 -13.152  -1.695  -4.954
  296   2HD   LYS  72          HD1       LYS  72 -13.870  -2.079  -3.388
  297   1HE   LYS  72          HE2       LYS  72 -13.770   0.497  -3.022
  298   2HE   LYS  72          HE1       LYS  72 -13.645   0.558  -4.780
  299   1HZ   LYS  72          HZ1       LYS  72 -15.957   0.604  -3.581
  300   2HZ   LYS  72          HZ2       LYS  72 -15.769  -1.076  -3.598
  301   3HZ   LYS  72          HZ3       LYS  72 -15.757  -0.210  -5.051
  302    H    GLU  73           HN       GLU  73 -10.126  -0.368   0.409
  303    HA   GLU  73           HA       GLU  73 -11.763  -0.037   2.611
  304   1HB   GLU  73          HB2       GLU  73  -8.770   0.324   2.689
  305   2HB   GLU  73          HB1       GLU  73  -9.813  -0.275   3.971
  306   1HG   GLU  73          HG2       GLU  73 -10.377  -2.181   2.356
  307   2HG   GLU  73          HG1       GLU  73  -8.959  -1.648   1.453
  308    H    THR  74           HN       THR  74  -9.324   2.266   1.393
  309    HA   THR  74           HA       THR  74  -9.899   4.242   3.357
  310    HB   THR  74           HB       THR  74  -8.700   5.702   1.474
  311    HG1  THR  74           HG1      THR  74  -7.318   4.326   0.271
  312   1HG2  THR  74          HG21      THR  74  -6.492   4.456   2.239
  313   2HG2  THR  74          HG22      THR  74  -7.599   3.791   3.442
  314   3HG2  THR  74          HG23      THR  74  -7.388   5.537   3.306
  315    H    GLY  75           HN       GLY  75 -10.335   4.567  -0.178
  316   1HA   GLY  75          HA2       GLY  75 -12.616   4.999  -1.020
  317   2HA   GLY  75          HA1       GLY  75 -12.853   6.003   0.401
  318    H    SER  76           HN       SER  76 -10.889   5.714  -2.536
  319    HA   SER  76           HA       SER  76 -11.311   8.404  -3.272
  320   1HB   SER  76          HB2       SER  76  -8.868   7.795  -1.698
  321   2HB   SER  76          HB1       SER  76  -8.663   8.837  -3.106
  322    HG   SER  76           HG       SER  76  -9.144  10.061  -1.259
  323    H    ALA  77           HN       ALA  77  -8.096   7.122  -3.847
  324    HA   ALA  77           HA       ALA  77  -8.948   5.739  -6.269
  325   1HB   ALA  77          HB1       ALA  77  -8.462   8.367  -6.576
  326   2HB   ALA  77          HB2       ALA  77  -8.135   7.168  -7.827
  327   3HB   ALA  77          HB3       ALA  77  -6.830   7.732  -6.784
  328    H    GLY  78           HN       GLY  78  -7.486   4.105  -6.845
  329   1HA   GLY  78          HA2       GLY  78  -4.935   4.138  -5.353
  330   2HA   GLY  78          HA1       GLY  78  -5.942   2.707  -5.377
  331    H    ASN  79           HN       ASN  79  -3.155   3.280  -6.262
  332    HA   ASN  79           HA       ASN  79  -3.374   2.183  -8.999
  333   1HB   ASN  79          HB2       ASN  79  -2.403   4.699  -8.341
  334   2HB   ASN  79          HB1       ASN  79  -0.940   3.724  -8.446
  335   1HD2  ASN  79          HD21      ASN  79  -0.304   4.899 -10.275
  336   2HD2  ASN  79          HD22      ASN  79  -1.014   4.610 -11.824
  337    H    LEU  80           HN       LEU  80  -2.033   0.418  -9.393
  338    HA   LEU  80           HA       LEU  80  -0.088  -0.286  -7.273
  339   1HB   LEU  80          HB2       LEU  80  -2.281  -1.696  -7.618
  340   2HB   LEU  80          HB1       LEU  80  -1.406  -2.356  -8.984
  341    HG   LEU  80           HG       LEU  80  -0.105  -2.331  -6.299
  342   1HD1  LEU  80          HD11      LEU  80  -1.256  -4.854  -6.634
  343   2HD1  LEU  80          HD12      LEU  80  -2.549  -3.680  -6.879
  344   3HD1  LEU  80          HD13      LEU  80  -1.608  -3.658  -5.388
  345   1HD2  LEU  80          HD21      LEU  80   0.022  -4.312  -8.560
  346   2HD2  LEU  80          HD22      LEU  80   1.082  -4.222  -7.154
  347   3HD2  LEU  80          HD23      LEU  80   1.127  -2.952  -8.373
  348    H    GLU  81           HN       GLU  81   1.965  -0.836  -7.963
  349    HA   GLU  81           HA       GLU  81   2.316  -1.188 -10.890
  350   1HB   GLU  81          HB2       GLU  81   3.523   0.780  -9.055
  351   2HB   GLU  81          HB1       GLU  81   4.682  -0.058 -10.077
  352   1HG   GLU  81          HG2       GLU  81   2.257   1.048 -11.372
  353   2HG   GLU  81          HG1       GLU  81   3.490   2.182 -10.822
  354    H    GLY  82           HN       GLY  82   3.656  -2.877 -11.450
  355   1HA   GLY  82          HA2       GLY  82   5.011  -4.714 -11.203
  356   2HA   GLY  82          HA1       GLY  82   5.792  -3.820  -9.912
  357    H    GLY  83           HN       GLY  83   4.617  -3.888  -7.751
  358   1HA   GLY  83          HA2       GLY  83   2.813  -6.061  -7.250
  359   2HA   GLY  83          HA1       GLY  83   4.447  -6.443  -6.806
  360    H    ARG  84           HN       ARG  84   3.757  -3.274  -6.493
  361    HA   ARG  84           HA       ARG  84   3.485  -3.337  -3.607
  362   1HB   ARG  84          HB2       ARG  84   4.329  -1.053  -5.426
  363   2HB   ARG  84          HB1       ARG  84   4.471  -1.122  -3.674
  364   1HG   ARG  84          HG2       ARG  84   6.190  -2.770  -3.805
  365   2HG   ARG  84          HG1       ARG  84   5.941  -2.967  -5.540
  366   1HD   ARG  84          HD2       ARG  84   6.561  -0.527  -5.773
  367   2HD   ARG  84          HD1       ARG  84   7.076  -0.590  -4.088
  368    HE   ARG  84           HE       ARG  84   8.940  -1.757  -4.733
  369   1HH1  ARG  84          HH11      ARG  84   6.653  -1.718  -7.369
  370   2HH1  ARG  84          HH12      ARG  84   7.765  -2.403  -8.506
  371   1HH2  ARG  84          HH21      ARG  84  10.402  -2.659  -6.229
  372   2HH2  ARG  84          HH22      ARG  84   9.892  -2.937  -7.861
  373    H    LEU  85           HN       LEU  85   1.831  -2.251  -2.755
  374    HA   LEU  85           HA       LEU  85  -0.374  -1.438  -4.617
  375   1HB   LEU  85          HB2       LEU  85  -1.361  -2.996  -3.296
  376   2HB   LEU  85          HB1       LEU  85  -0.235  -2.775  -1.978
  377    HG   LEU  85           HG       LEU  85  -2.697  -2.207  -1.563
  378   1HD1  LEU  85          HD11      LEU  85  -0.989   0.123  -0.891
  379   2HD1  LEU  85          HD12      LEU  85  -0.549  -1.471  -0.279
  380   3HD1  LEU  85          HD13      LEU  85  -2.120  -0.777   0.112
  381   1HD2  LEU  85          HD21      LEU  85  -2.269  -0.501  -3.751
  382   2HD2  LEU  85          HD22      LEU  85  -2.474   0.525  -2.335
  383   3HD2  LEU  85          HD23      LEU  85  -3.714  -0.652  -2.757
  384    H    ILE  86           HN       ILE  86  -1.041   0.651  -4.534
  385    HA   ILE  86           HA       ILE  86   0.007   2.410  -2.410
  386    HB   ILE  86           HB       ILE  86  -0.414   3.072  -5.336
  387   1HG1  ILE  86          HG12      ILE  86   2.268   3.439  -4.271
  388   2HG1  ILE  86          HG11      ILE  86   1.734   1.766  -4.145
  389   1HG2  ILE  86          HG21      ILE  86   0.102   5.256  -4.930
  390   2HG2  ILE  86          HG22      ILE  86   1.014   4.885  -3.468
  391   3HG2  ILE  86          HG23      ILE  86  -0.748   4.856  -3.439
  392   1HD1  ILE  86          HD11      ILE  86   2.944   2.193  -6.217
  393   2HD1  ILE  86          HD12      ILE  86   1.744   3.405  -6.667
  394   3HD1  ILE  86          HD13      ILE  86   1.276   1.710  -6.523
  395    H    LEU  87           HN       LEU  87  -1.471   3.704  -1.478
  396    HA   LEU  87           HA       LEU  87  -4.184   3.766  -2.623
  397   1HB   LEU  87          HB2       LEU  87  -5.094   3.678  -0.421
  398   2HB   LEU  87          HB1       LEU  87  -3.928   2.377  -0.535
  399    HG   LEU  87           HG       LEU  87  -3.266   5.033   0.723
  400   1HD1  LEU  87          HD11      LEU  87  -5.013   3.000   1.718
  401   2HD1  LEU  87          HD12      LEU  87  -4.517   4.514   2.475
  402   3HD1  LEU  87          HD13      LEU  87  -3.551   3.056   2.703
  403   1HD2  LEU  87          HD21      LEU  87  -1.233   4.083   0.470
  404   2HD2  LEU  87          HD22      LEU  87  -1.891   2.454   0.329
  405   3HD2  LEU  87          HD23      LEU  87  -1.709   3.197   1.918
  406    H    GLN  88           HN       GLN  88  -5.052   5.732  -2.810
  407    HA   GLN  88           HA       GLN  88  -3.544   8.002  -1.703
  408   1HB   GLN  88          HB2       GLN  88  -4.581   7.518  -4.419
  409   2HB   GLN  88          HB1       GLN  88  -4.920   9.118  -3.773
  410   1HG   GLN  88          HG2       GLN  88  -2.788   9.774  -3.938
  411   2HG   GLN  88          HG1       GLN  88  -2.160   8.220  -3.391
  412   1HE2  GLN  88          HE21      GLN  88  -1.910  10.229  -5.820
  413   2HE2  GLN  88          HE22      GLN  88  -1.748   9.146  -7.156
  414    H    ARG  89           HN       ARG  89  -4.607   8.561   0.028
  415    HA   ARG  89           HA       ARG  89  -7.504   8.454   0.136
  416   1HB   ARG  89          HB2       ARG  89  -5.496   8.232   2.019
  417   2HB   ARG  89          HB1       ARG  89  -6.161   9.827   2.342
  418   1HG   ARG  89          HG2       ARG  89  -8.383   8.871   2.588
  419   2HG   ARG  89          HG1       ARG  89  -7.744   7.269   2.217
  420   1HD   ARG  89          HD2       ARG  89  -6.620   7.109   4.232
  421   2HD   ARG  89          HD1       ARG  89  -6.575   8.856   4.463
  422    HE   ARG  89           HE       ARG  89  -9.192   8.380   4.623
  423   1HH1  ARG  89          HH11      ARG  89  -6.492   6.746   6.122
  424   2HH1  ARG  89          HH12      ARG  89  -7.401   6.262   7.514
  425   1HH2  ARG  89          HH21      ARG  89 -10.383   7.747   6.454
  426   2HH2  ARG  89          HH22      ARG  89  -9.609   6.831   7.703
  427    H    ARG  90           HN       ARG  90  -8.309  10.567   1.566
  428    HA   ARG  90           HA       ARG  90  -8.086  12.739  -0.357
  429   1HB   ARG  90          HB2       ARG  90  -9.988  12.015   1.824
  430   2HB   ARG  90          HB1       ARG  90  -9.869  13.705   1.355
  431   1HG   ARG  90          HG2       ARG  90 -10.754  13.336  -0.725
  432   2HG   ARG  90          HG1       ARG  90 -10.236  11.649  -0.764
  433   1HD   ARG  90          HD2       ARG  90 -11.928  11.112   0.939
  434   2HD   ARG  90          HD1       ARG  90 -12.463  12.792   0.919
  435    HE   ARG  90           HE       ARG  90 -13.064  10.753  -1.017
  436   1HH1  ARG  90          HH11      ARG  90 -12.804  14.189  -0.467
  437   2HH1  ARG  90          HH12      ARG  90 -13.882  14.603  -1.757
  438   1HH2  ARG  90          HH21      ARG  90 -14.482  11.297  -2.714
  439   2HH2  ARG  90          HH22      ARG  90 -14.837  12.963  -3.032
  Start of MODEL    9
    1    H    GLU  39           HN       GLU  39   4.652   0.381   7.047
    2    HA   GLU  39           HA       GLU  39   6.863   0.755   5.143
    3   1HB   GLU  39          HB2       GLU  39   4.488  -1.071   4.797
    4   2HB   GLU  39          HB1       GLU  39   5.988  -1.070   3.879
    5   1HG   GLU  39          HG2       GLU  39   7.189  -1.738   5.944
    6   2HG   GLU  39          HG1       GLU  39   5.630  -1.867   6.759
    7    H    ILE  40           HN       ILE  40   4.268   2.400   6.050
    8    HA   ILE  40           HA       ILE  40   3.373   3.063   3.320
    9    HB   ILE  40           HB       ILE  40   1.405   4.073   4.390
   10   1HG1  ILE  40          HG12      ILE  40   1.395   3.103   6.992
   11   2HG1  ILE  40          HG11      ILE  40   3.031   3.720   6.791
   12   1HG2  ILE  40          HG21      ILE  40   0.731   1.986   3.904
   13   2HG2  ILE  40          HG22      ILE  40   0.743   1.775   5.655
   14   3HG2  ILE  40          HG23      ILE  40   2.121   1.240   4.692
   15   1HD1  ILE  40          HD11      ILE  40   1.374   5.341   7.720
   16   2HD1  ILE  40          HD12      ILE  40   0.574   5.321   6.148
   17   3HD1  ILE  40          HD13      ILE  40   2.236   5.893   6.283
   18    H    LEU  41           HN       LEU  41   3.747   5.077   2.525
   19    HA   LEU  41           HA       LEU  41   4.759   7.157   4.361
   20   1HB   LEU  41          HB2       LEU  41   5.951   6.032   1.891
   21   2HB   LEU  41          HB1       LEU  41   6.018   7.777   2.060
   22    HG   LEU  41           HG       LEU  41   6.998   7.199   4.436
   23   1HD1  LEU  41          HD11      LEU  41   6.766   4.853   4.455
   24   2HD1  LEU  41          HD12      LEU  41   8.483   5.165   4.195
   25   3HD1  LEU  41          HD13      LEU  41   7.457   4.695   2.840
   26   1HD2  LEU  41          HD21      LEU  41   8.973   6.666   2.310
   27   2HD2  LEU  41          HD22      LEU  41   8.988   7.866   3.601
   28   3HD2  LEU  41          HD23      LEU  41   8.033   8.148   2.146
   29    H    ILE  42           HN       ILE  42   3.817   9.144   4.069
   30    HA   ILE  42           HA       ILE  42   2.042   9.368   1.735
   31    HB   ILE  42           HB       ILE  42   0.641  10.844   2.978
   32   1HG1  ILE  42          HG12      ILE  42   1.491  11.097   5.549
   33   2HG1  ILE  42          HG11      ILE  42   3.033  11.113   4.698
   34   1HG2  ILE  42          HG21      ILE  42   1.297   8.235   3.983
   35   2HG2  ILE  42          HG22      ILE  42  -0.271   9.033   3.879
   36   3HG2  ILE  42          HG23      ILE  42   0.749   9.276   5.295
   37   1HD1  ILE  42          HD11      ILE  42   0.722  12.999   4.370
   38   2HD1  ILE  42          HD12      ILE  42   2.077  12.930   3.245
   39   3HD1  ILE  42          HD13      ILE  42   2.354  13.357   4.933
   40    H    GLU  43           HN       GLU  43   2.381  10.886   0.289
   41    HA   GLU  43           HA       GLU  43   4.057  13.228   0.920
   42   1HB   GLU  43          HB2       GLU  43   4.248  11.283  -1.386
   43   2HB   GLU  43          HB1       GLU  43   4.839  12.932  -1.542
   44   1HG   GLU  43          HG2       GLU  43   6.021  12.134   0.778
   45   2HG   GLU  43          HG1       GLU  43   5.997  10.638  -0.154
   46    H    GLY  44           HN       GLY  44   3.161  15.131   0.063
   47   1HA   GLY  44          HA2       GLY  44   1.556  16.472  -0.913
   48   2HA   GLY  44          HA1       GLY  44   1.635  15.329  -2.245
   49    H    ASN  45           HN       ASN  45   0.057  13.681  -2.410
   50    HA   ASN  45           HA       ASN  45  -2.099  13.701  -0.424
   51   1HB   ASN  45          HB2       ASN  45  -3.808  13.845  -2.216
   52   2HB   ASN  45          HB1       ASN  45  -2.828  15.302  -2.079
   53   1HD2  ASN  45          HD21      ASN  45  -0.898  15.354  -3.551
   54   2HD2  ASN  45          HD22      ASN  45  -1.128  14.778  -5.162
   55    H    ARG  46           HN       ARG  46  -0.054  11.907  -2.346
   56    HA   ARG  46           HA       ARG  46  -1.828   9.543  -2.308
   57   1HB   ARG  46          HB2       ARG  46  -0.478   8.697  -4.162
   58   2HB   ARG  46          HB1       ARG  46  -1.114  10.287  -4.560
   59   1HG   ARG  46          HG2       ARG  46   0.974  10.764  -5.173
   60   2HG   ARG  46          HG1       ARG  46   1.301  10.906  -3.445
   61   1HD   ARG  46          HD2       ARG  46   2.358   8.877  -3.339
   62   2HD   ARG  46          HD1       ARG  46   1.441   8.208  -4.688
   63    HE   ARG  46           HE       ARG  46   3.068   8.955  -6.110
   64   1HH1  ARG  46          HH11      ARG  46   3.408  10.610  -3.057
   65   2HH1  ARG  46          HH12      ARG  46   4.903  11.368  -3.493
   66   1HH2  ARG  46          HH21      ARG  46   5.034   9.950  -6.684
   67   2HH2  ARG  46          HH22      ARG  46   5.826  10.994  -5.551
   68    H    THR  47           HN       THR  47  -1.097   7.717  -1.246
   69    HA   THR  47           HA       THR  47   1.593   7.864  -0.020
   70    HB   THR  47           HB       THR  47  -0.945   6.565   0.987
   71    HG1  THR  47           HG1      THR  47   0.129   9.017   1.360
   72   1HG2  THR  47          HG21      THR  47   0.125   5.606   2.718
   73   2HG2  THR  47          HG22      THR  47   1.392   6.829   2.757
   74   3HG2  THR  47          HG23      THR  47   1.443   5.550   1.548
   75    H    ILE  48           HN       ILE  48   2.898   6.113  -0.306
   76    HA   ILE  48           HA       ILE  48   1.812   3.835  -1.862
   77    HB   ILE  48           HB       ILE  48   4.670   4.820  -1.744
   78   1HG1  ILE  48          HG12      ILE  48   2.737   5.115  -4.047
   79   2HG1  ILE  48          HG11      ILE  48   3.016   6.387  -2.862
   80   1HG2  ILE  48          HG21      ILE  48   5.039   2.729  -2.472
   81   2HG2  ILE  48          HG22      ILE  48   4.445   3.345  -4.014
   82   3HG2  ILE  48          HG23      ILE  48   3.354   2.482  -2.928
   83   1HD1  ILE  48          HD11      ILE  48   4.612   7.096  -4.231
   84   2HD1  ILE  48          HD12      ILE  48   4.605   5.591  -5.151
   85   3HD1  ILE  48          HD13      ILE  48   5.556   5.715  -3.671
   86    H    ILE  49           HN       ILE  49   2.135   1.760  -1.024
   87    HA   ILE  49           HA       ILE  49   3.879   1.609   1.336
   88    HB   ILE  49           HB       ILE  49   1.641   1.517   2.187
   89   1HG1  ILE  49          HG12      ILE  49   2.907  -1.229   2.131
   90   2HG1  ILE  49          HG11      ILE  49   3.281   0.063   3.266
   91   1HG2  ILE  49          HG21      ILE  49   0.425   0.868   0.229
   92   2HG2  ILE  49          HG22      ILE  49   0.091  -0.292   1.515
   93   3HG2  ILE  49          HG23      ILE  49   1.211  -0.711   0.219
   94   1HD1  ILE  49          HD11      ILE  49   1.286  -1.951   3.439
   95   2HD1  ILE  49          HD12      ILE  49   0.501  -0.372   3.398
   96   3HD1  ILE  49          HD13      ILE  49   1.725  -0.717   4.620
   97    H    ARG  50           HN       ARG  50   5.368   0.209   1.272
   98    HA   ARG  50           HA       ARG  50   5.761  -1.461  -1.013
   99   1HB   ARG  50          HB2       ARG  50   7.288  -0.880   1.491
  100   2HB   ARG  50          HB1       ARG  50   7.735  -2.281   0.526
  101   1HG   ARG  50          HG2       ARG  50   7.422  -0.003  -1.180
  102   2HG   ARG  50          HG1       ARG  50   8.503   0.395   0.157
  103   1HD   ARG  50          HD2       ARG  50   9.131  -2.216  -0.841
  104   2HD   ARG  50          HD1       ARG  50   9.089  -1.069  -2.179
  105    HE   ARG  50           HE       ARG  50  10.562   0.221  -0.319
  106   1HH1  ARG  50          HH11      ARG  50  10.761  -2.972  -1.714
  107   2HH1  ARG  50          HH12      ARG  50  12.482  -3.074  -1.545
  108   1HH2  ARG  50          HH21      ARG  50  12.824   0.088  -0.097
  109   2HH2  ARG  50          HH22      ARG  50  13.653  -1.338  -0.627
  110    H    ASN  51           HN       ASN  51   3.591  -2.548  -0.503
  111    HA   ASN  51           HA       ASN  51   3.821  -4.662   1.473
  112   1HB   ASN  51          HB2       ASN  51   1.690  -3.265   0.993
  113   2HB   ASN  51          HB1       ASN  51   1.498  -4.330  -0.396
  114   1HD2  ASN  51          HD21      ASN  51   0.240  -3.876   2.431
  115   2HD2  ASN  51          HD22      ASN  51  -0.019  -5.494   2.980
  116    H    PHE  52           HN       PHE  52   5.411  -4.495  -1.052
  117    HA   PHE  52           HA       PHE  52   4.666  -6.153  -3.006
  118   1HB   PHE  52          HB2       PHE  52   6.872  -4.922  -2.839
  119   2HB   PHE  52          HB1       PHE  52   7.480  -6.355  -2.010
  120    HD1  PHE  52           HD1      PHE  52   9.089  -6.189  -4.083
  121    HD2  PHE  52           HD2      PHE  52   4.977  -7.279  -4.333
  122    HE1  PHE  52           HE1      PHE  52   9.497  -7.274  -6.257
  123    HE2  PHE  52           HE2      PHE  52   5.366  -8.355  -6.494
  124    HZ   PHE  52           HZ       PHE  52   7.642  -8.359  -7.464
  125    H    ARG  53           HN       ARG  53   5.983  -7.486   0.086
  126    HA   ARG  53           HA       ARG  53   6.289 -10.095  -0.770
  127   1HB   ARG  53          HB2       ARG  53   5.798  -8.792   1.770
  128   2HB   ARG  53          HB1       ARG  53   5.009 -10.361   1.709
  129   1HG   ARG  53          HG2       ARG  53   7.315 -11.185   0.831
  130   2HG   ARG  53          HG1       ARG  53   7.911  -9.696   1.566
  131   1HD   ARG  53          HD2       ARG  53   7.729 -10.530   3.627
  132   2HD   ARG  53          HD1       ARG  53   6.101 -11.134   3.320
  133    HE   ARG  53           HE       ARG  53   6.983 -13.206   2.925
  134   1HH1  ARG  53          HH11      ARG  53   9.554 -10.850   2.791
  135   2HH1  ARG  53          HH12      ARG  53  10.808 -12.039   2.684
  136   1HH2  ARG  53          HH21      ARG  53   8.631 -14.772   2.785
  137   2HH2  ARG  53          HH22      ARG  53  10.284 -14.266   2.682
  138    H    GLU  54           HN       GLU  54   3.354  -9.222   1.013
  139    HA   GLU  54           HA       GLU  54   1.739 -11.299   0.152
  140   1HB   GLU  54          HB2       GLU  54   1.438  -9.124   1.825
  141   2HB   GLU  54          HB1       GLU  54   0.288  -8.782   0.540
  142   1HG   GLU  54          HG2       GLU  54  -1.128 -10.341   1.250
  143   2HG   GLU  54          HG1       GLU  54   0.154 -11.537   1.441
  144    H    LEU  55           HN       LEU  55   2.072  -8.040  -1.144
  145    HA   LEU  55           HA       LEU  55   0.213  -8.036  -3.147
  146   1HB   LEU  55          HB2       LEU  55   1.837  -6.203  -2.399
  147   2HB   LEU  55          HB1       LEU  55   2.975  -6.914  -3.525
  148    HG   LEU  55           HG       LEU  55   1.824  -4.974  -4.478
  149   1HD1  LEU  55          HD11      LEU  55   0.732  -7.287  -5.992
  150   2HD1  LEU  55          HD12      LEU  55   2.476  -7.179  -5.752
  151   3HD1  LEU  55          HD13      LEU  55   1.615  -5.872  -6.565
  152   1HD2  LEU  55          HD21      LEU  55  -0.311  -4.654  -3.943
  153   2HD2  LEU  55          HD22      LEU  55  -0.502  -6.320  -3.402
  154   3HD2  LEU  55          HD23      LEU  55  -0.711  -5.917  -5.106
  155    H    ALA  56           HN       ALA  56   3.533  -9.273  -3.386
  156    HA   ALA  56           HA       ALA  56   3.661  -9.970  -6.024
  157   1HB   ALA  56          HB1       ALA  56   5.275 -11.713  -5.339
  158   2HB   ALA  56          HB2       ALA  56   4.801 -11.456  -3.660
  159   3HB   ALA  56          HB3       ALA  56   5.581 -10.159  -4.564
  160    H    LYS  57           HN       LYS  57   2.584 -12.006  -3.297
  161    HA   LYS  57           HA       LYS  57   1.710 -14.202  -4.810
  162   1HB   LYS  57          HB2       LYS  57   0.641 -12.993  -2.254
  163   2HB   LYS  57          HB1       LYS  57  -0.051 -14.450  -2.950
  164   1HG   LYS  57          HG2       LYS  57   2.578 -15.100  -2.913
  165   2HG   LYS  57          HG1       LYS  57   2.462 -14.062  -1.490
  166   1HD   LYS  57          HD2       LYS  57   1.931 -16.081  -0.552
  167   2HD   LYS  57          HD1       LYS  57   0.320 -15.533  -1.022
  168   1HE   LYS  57          HE2       LYS  57   0.448 -16.848  -3.061
  169   2HE   LYS  57          HE1       LYS  57   2.086 -17.355  -2.653
  170   1HZ   LYS  57          HZ1       LYS  57   1.345 -18.851  -1.166
  171   2HZ   LYS  57          HZ2       LYS  57  -0.084 -18.775  -2.068
  172   3HZ   LYS  57          HZ3       LYS  57   0.062 -17.882  -0.639
  173    H    ALA  58           HN       ALA  58   0.055 -11.263  -3.855
  174    HA   ALA  58           HA       ALA  58  -2.411 -11.594  -5.012
  175   1HB   ALA  58          HB1       ALA  58  -2.756  -9.433  -4.495
  176   2HB   ALA  58          HB2       ALA  58  -1.264  -8.898  -5.269
  177   3HB   ALA  58          HB3       ALA  58  -1.216  -9.602  -3.652
  178    H    VAL  59           HN       VAL  59   0.518 -10.211  -6.599
  179    HA   VAL  59           HA       VAL  59  -0.690  -9.549  -8.954
  180    HB   VAL  59           HB       VAL  59   1.236  -8.901  -9.671
  181   1HG1  VAL  59          HG11      VAL  59   3.038  -8.740  -8.249
  182   2HG1  VAL  59          HG12      VAL  59   2.836 -10.373  -7.625
  183   3HG1  VAL  59          HG13      VAL  59   1.734  -9.096  -7.120
  184   1HG2  VAL  59          HG21      VAL  59   2.157 -11.775  -9.546
  185   2HG2  VAL  59          HG22      VAL  59   3.071 -10.464 -10.290
  186   3HG2  VAL  59          HG23      VAL  59   1.497 -10.922 -10.941
  187    H    ASN  60           HN       ASN  60   0.696 -12.710  -8.164
  188    HA   ASN  60           HA       ASN  60   0.157 -13.997 -10.559
  189   1HB   ASN  60          HB2       ASN  60   1.266 -14.984  -8.493
  190   2HB   ASN  60          HB1       ASN  60  -0.352 -15.229  -7.842
  191   1HD2  ASN  60          HD21      ASN  60   1.466 -15.834 -10.830
  192   2HD2  ASN  60          HD22      ASN  60   0.842 -17.424 -11.088
  193    H    ARG  61           HN       ARG  61  -1.983 -13.027  -7.952
  194    HA   ARG  61           HA       ARG  61  -4.290 -14.078  -9.472
  195   1HB   ARG  61          HB2       ARG  61  -3.685 -14.368  -6.810
  196   2HB   ARG  61          HB1       ARG  61  -4.824 -13.028  -6.787
  197   1HG   ARG  61          HG2       ARG  61  -5.421 -15.567  -8.262
  198   2HG   ARG  61          HG1       ARG  61  -5.749 -15.393  -6.537
  199   1HD   ARG  61          HD2       ARG  61  -6.810 -13.573  -8.696
  200   2HD   ARG  61          HD1       ARG  61  -7.713 -14.892  -7.951
  201    HE   ARG  61           HE       ARG  61  -6.960 -13.399  -5.831
  202   1HH1  ARG  61          HH11      ARG  61  -8.560 -12.620  -8.834
  203   2HH1  ARG  61          HH12      ARG  61  -9.458 -11.303  -8.158
  204   1HH2  ARG  61          HH21      ARG  61  -8.140 -11.666  -4.941
  205   2HH2  ARG  61          HH22      ARG  61  -9.219 -10.760  -5.949
  206    H    ASP  62           HN       ASP  62  -2.778 -11.505  -9.930
  207    HA   ASP  62           HA       ASP  62  -3.464  -9.505 -10.918
  208   1HB   ASP  62          HB2       ASP  62  -6.059  -9.697  -9.381
  209   2HB   ASP  62          HB1       ASP  62  -5.695  -8.675 -10.767
  210    H    GLU  63           HN       GLU  63  -1.717  -8.907  -9.641
  211    HA   GLU  63           HA       GLU  63  -1.815  -7.949  -6.990
  212   1HB   GLU  63          HB2       GLU  63   0.068  -6.430  -7.670
  213   2HB   GLU  63          HB1       GLU  63   0.346  -8.119  -8.013
  214   1HG   GLU  63          HG2       GLU  63  -0.213  -7.745 -10.359
  215   2HG   GLU  63          HG1       GLU  63  -0.541  -6.050 -10.007
  216    H    GLU  64           HN       GLU  64  -2.344  -6.542 -10.108
  217    HA   GLU  64           HA       GLU  64  -2.763  -3.888  -9.443
  218   1HB   GLU  64          HB2       GLU  64  -4.319  -3.802 -11.425
  219   2HB   GLU  64          HB1       GLU  64  -2.736  -4.495 -11.751
  220   1HG   GLU  64          HG2       GLU  64  -3.793  -6.759 -11.432
  221   2HG   GLU  64          HG1       GLU  64  -5.352  -5.935 -11.429
  222    H    PHE  65           HN       PHE  65  -5.101  -6.496  -9.532
  223    HA   PHE  65           HA       PHE  65  -7.376  -5.159  -8.736
  224   1HB   PHE  65          HB2       PHE  65  -6.458  -7.936  -8.793
  225   2HB   PHE  65          HB1       PHE  65  -7.646  -7.622  -7.535
  226    HD1  PHE  65           HD1      PHE  65  -7.040  -7.170 -11.173
  227    HD2  PHE  65           HD2      PHE  65  -9.904  -7.570  -8.051
  228    HE1  PHE  65           HE1      PHE  65  -8.839  -7.305 -12.846
  229    HE2  PHE  65           HE2      PHE  65 -11.707  -7.707  -9.718
  230    HZ   PHE  65           HZ       PHE  65 -11.176  -7.575 -12.119
  231    H    PHE  66           HN       PHE  66  -4.911  -6.753  -6.642
  232    HA   PHE  66           HA       PHE  66  -6.284  -6.246  -4.303
  233   1HB   PHE  66          HB2       PHE  66  -4.443  -7.681  -3.956
  234   2HB   PHE  66          HB1       PHE  66  -3.289  -6.461  -4.563
  235    HD1  PHE  66           HD1      PHE  66  -6.042  -6.817  -2.114
  236    HD2  PHE  66           HD2      PHE  66  -2.313  -5.003  -3.053
  237    HE1  PHE  66           HE1      PHE  66  -6.192  -5.482  -0.068
  238    HE2  PHE  66           HE2      PHE  66  -2.442  -3.694  -0.981
  239    HZ   PHE  66           HZ       PHE  66  -4.425  -3.889   0.453
  240    H    ALA  67           HN       ALA  67  -3.457  -4.127  -5.375
  241    HA   ALA  67           HA       ALA  67  -3.682  -2.302  -3.399
  242   1HB   ALA  67          HB1       ALA  67  -3.504  -1.285  -6.231
  243   2HB   ALA  67          HB2       ALA  67  -2.196  -2.226  -5.517
  244   3HB   ALA  67          HB3       ALA  67  -2.680  -0.697  -4.786
  245    H    LYS  68           HN       LYS  68  -5.781  -2.455  -6.299
  246    HA   LYS  68           HA       LYS  68  -7.406  -0.276  -5.851
  247   1HB   LYS  68          HB2       LYS  68  -8.426  -3.032  -6.578
  248   2HB   LYS  68          HB1       LYS  68  -9.222  -1.502  -6.907
  249   1HG   LYS  68          HG2       LYS  68  -6.584  -1.466  -8.016
  250   2HG   LYS  68          HG1       LYS  68  -7.441  -2.912  -8.554
  251   1HD   LYS  68          HD2       LYS  68  -7.810  -1.058 -10.096
  252   2HD   LYS  68          HD1       LYS  68  -9.315  -1.521  -9.299
  253   1HE   LYS  68          HE2       LYS  68  -8.605   0.344  -7.589
  254   2HE   LYS  68          HE1       LYS  68  -7.655   0.931  -8.954
  255   1HZ   LYS  68          HZ1       LYS  68 -10.417   0.259  -9.538
  256   2HZ   LYS  68          HZ2       LYS  68  -9.486   1.569 -10.066
  257   3HZ   LYS  68          HZ3       LYS  68 -10.193   1.600  -8.529
  258    H    TYR  69           HN       TYR  69  -7.632  -3.464  -4.315
  259    HA   TYR  69           HA       TYR  69  -9.770  -3.270  -2.663
  260   1HB   TYR  69          HB2       TYR  69  -7.171  -4.678  -2.420
  261   2HB   TYR  69          HB1       TYR  69  -8.148  -4.541  -0.969
  262    HD1  TYR  69           HD1      TYR  69  -9.990  -5.957  -0.616
  263    HD2  TYR  69           HD2      TYR  69  -8.207  -5.762  -4.473
  264    HE1  TYR  69           HE1      TYR  69 -11.344  -7.879  -1.332
  265    HE2  TYR  69           HE2      TYR  69  -9.557  -7.684  -5.201
  266    HH   TYR  69           HH       TYR  69 -10.742  -9.579  -4.220
  267    H    LEU  70           HN       LEU  70  -6.467  -2.248  -1.850
  268    HA   LEU  70           HA       LEU  70  -6.916  -1.203   0.656
  269   1HB   LEU  70          HB2       LEU  70  -4.806  -1.133  -1.023
  270   2HB   LEU  70          HB1       LEU  70  -5.329   0.537  -1.142
  271    HG   LEU  70           HG       LEU  70  -3.609   0.321   0.557
  272   1HD1  LEU  70          HD11      LEU  70  -5.794   1.762   0.826
  273   2HD1  LEU  70          HD12      LEU  70  -4.613   1.645   2.131
  274   3HD1  LEU  70          HD13      LEU  70  -6.080   0.668   2.178
  275   1HD2  LEU  70          HD21      LEU  70  -5.474  -1.504   2.057
  276   2HD2  LEU  70          HD22      LEU  70  -3.818  -1.066   2.474
  277   3HD2  LEU  70          HD23      LEU  70  -4.133  -2.083   1.069
  278    H    LEU  71           HN       LEU  71  -7.449   0.326  -2.459
  279    HA   LEU  71           HA       LEU  71  -8.517   2.759  -1.550
  280   1HB   LEU  71          HB2       LEU  71  -8.396   3.158  -3.736
  281   2HB   LEU  71          HB1       LEU  71  -8.089   1.464  -4.052
  282    HG   LEU  71           HG       LEU  71 -10.599   1.131  -4.088
  283   1HD1  LEU  71          HD11      LEU  71 -11.646   3.485  -4.796
  284   2HD1  LEU  71          HD12      LEU  71 -10.449   4.045  -3.628
  285   3HD1  LEU  71          HD13      LEU  71 -11.679   2.878  -3.140
  286   1HD2  LEU  71          HD21      LEU  71  -9.999   3.068  -6.232
  287   2HD2  LEU  71          HD22      LEU  71 -10.601   1.412  -6.329
  288   3HD2  LEU  71          HD23      LEU  71  -8.883   1.713  -6.062
  289    H    LYS  72           HN       LYS  72 -10.020  -0.327  -2.510
  290    HA   LYS  72           HA       LYS  72 -12.687   0.259  -2.187
  291   1HB   LYS  72          HB2       LYS  72 -11.297  -2.022  -2.608
  292   2HB   LYS  72          HB1       LYS  72 -11.790  -2.278  -0.940
  293   1HG   LYS  72          HG2       LYS  72 -13.690  -3.080  -1.760
  294   2HG   LYS  72          HG1       LYS  72 -14.104  -1.414  -2.168
  295   1HD   LYS  72          HD2       LYS  72 -14.119  -1.966  -4.321
  296   2HD   LYS  72          HD1       LYS  72 -12.405  -2.372  -4.215
  297   1HE   LYS  72          HE2       LYS  72 -14.410  -4.357  -3.262
  298   2HE   LYS  72          HE1       LYS  72 -14.189  -4.147  -4.998
  299   1HZ   LYS  72          HZ1       LYS  72 -11.758  -4.431  -3.434
  300   2HZ   LYS  72          HZ2       LYS  72 -12.160  -5.085  -4.940
  301   3HZ   LYS  72          HZ3       LYS  72 -12.735  -5.809  -3.523
  302    H    GLU  73           HN       GLU  73 -10.347  -0.655   0.302
  303    HA   GLU  73           HA       GLU  73 -12.079  -0.596   2.507
  304   1HB   GLU  73          HB2       GLU  73  -9.177  -0.578   2.067
  305   2HB   GLU  73          HB1       GLU  73  -9.674   0.217   3.556
  306   1HG   GLU  73          HG2       GLU  73  -9.332  -1.956   4.235
  307   2HG   GLU  73          HG1       GLU  73 -11.073  -1.914   3.954
  308    H    THR  74           HN       THR  74  -9.667   1.913   1.699
  309    HA   THR  74           HA       THR  74 -10.734   3.862   3.392
  310    HB   THR  74           HB       THR  74  -8.582   4.363   2.722
  311    HG1  THR  74           HG1      THR  74  -8.726   6.306   1.775
  312   1HG2  THR  74          HG21      THR  74  -7.685   3.440   0.931
  313   2HG2  THR  74          HG22      THR  74  -8.504   4.650  -0.056
  314   3HG2  THR  74          HG23      THR  74  -9.275   3.096   0.254
  315    H    GLY  75           HN       GLY  75 -10.910   4.038  -0.187
  316   1HA   GLY  75          HA2       GLY  75 -13.336   4.089  -0.985
  317   2HA   GLY  75          HA1       GLY  75 -13.493   5.415   0.155
  318    H    SER  76           HN       SER  76 -10.665   6.277  -0.605
  319    HA   SER  76           HA       SER  76 -11.469   8.144  -2.589
  320   1HB   SER  76          HB2       SER  76  -9.006   7.600  -1.040
  321   2HB   SER  76          HB1       SER  76  -8.790   8.446  -2.573
  322    HG   SER  76           HG       SER  76  -9.644  10.163  -1.721
  323    H    ALA  77           HN       ALA  77  -8.339   6.641  -3.171
  324    HA   ALA  77           HA       ALA  77  -9.321   5.043  -5.377
  325   1HB   ALA  77          HB1       ALA  77  -9.211   7.513  -6.144
  326   2HB   ALA  77          HB2       ALA  77  -8.519   6.264  -7.179
  327   3HB   ALA  77          HB3       ALA  77  -7.467   7.256  -6.170
  328    H    GLY  78           HN       GLY  78  -7.838   3.458  -5.989
  329   1HA   GLY  78          HA2       GLY  78  -5.156   3.711  -4.767
  330   2HA   GLY  78          HA1       GLY  78  -6.080   2.228  -4.641
  331    H    ASN  79           HN       ASN  79  -3.426   2.886  -5.807
  332    HA   ASN  79           HA       ASN  79  -3.836   1.708  -8.486
  333   1HB   ASN  79          HB2       ASN  79  -2.061   3.990  -7.618
  334   2HB   ASN  79          HB1       ASN  79  -1.735   3.075  -9.088
  335   1HD2  ASN  79          HD21      ASN  79  -3.715   2.837 -10.535
  336   2HD2  ASN  79          HD22      ASN  79  -4.652   4.269 -10.775
  337    H    LEU  80           HN       LEU  80  -2.451   0.031  -9.004
  338    HA   LEU  80           HA       LEU  80  -0.430  -0.725  -6.975
  339   1HB   LEU  80          HB2       LEU  80  -2.349  -2.304  -7.496
  340   2HB   LEU  80          HB1       LEU  80  -1.698  -2.439  -9.114
  341    HG   LEU  80           HG       LEU  80  -1.097  -4.360  -7.727
  342   1HD1  LEU  80          HD11      LEU  80   0.974  -4.586  -8.592
  343   2HD1  LEU  80          HD12      LEU  80   1.507  -3.003  -8.030
  344   3HD1  LEU  80          HD13      LEU  80   0.494  -3.133  -9.468
  345   1HD2  LEU  80          HD21      LEU  80  -0.107  -2.238  -5.921
  346   2HD2  LEU  80          HD22      LEU  80   0.789  -3.753  -5.987
  347   3HD2  LEU  80          HD23      LEU  80  -0.919  -3.753  -5.547
  348    H    GLU  81           HN       GLU  81   1.725  -0.889  -7.633
  349    HA   GLU  81           HA       GLU  81   2.220  -0.746 -10.552
  350   1HB   GLU  81          HB2       GLU  81   2.586   1.411  -9.049
  351   2HB   GLU  81          HB1       GLU  81   4.079   0.588  -8.621
  352   1HG   GLU  81          HG2       GLU  81   4.915   0.713 -10.780
  353   2HG   GLU  81          HG1       GLU  81   3.322   0.976 -11.487
  354    H    GLY  82           HN       GLY  82   3.813  -2.165 -11.255
  355   1HA   GLY  82          HA2       GLY  82   5.280  -3.933 -11.141
  356   2HA   GLY  82          HA1       GLY  82   6.053  -2.972  -9.899
  357    H    GLY  83           HN       GLY  83   5.075  -3.253  -7.619
  358   1HA   GLY  83          HA2       GLY  83   3.703  -5.741  -7.087
  359   2HA   GLY  83          HA1       GLY  83   5.407  -5.801  -6.731
  360    H    ARG  84           HN       ARG  84   4.206  -2.829  -6.273
  361    HA   ARG  84           HA       ARG  84   4.025  -3.023  -3.380
  362   1HB   ARG  84          HB2       ARG  84   4.494  -0.612  -5.180
  363   2HB   ARG  84          HB1       ARG  84   4.663  -0.669  -3.431
  364   1HG   ARG  84          HG2       ARG  84   6.709  -1.631  -3.519
  365   2HG   ARG  84          HG1       ARG  84   6.341  -2.539  -4.986
  366   1HD   ARG  84          HD2       ARG  84   7.978  -0.909  -5.557
  367   2HD   ARG  84          HD1       ARG  84   6.446  -0.373  -6.242
  368    HE   ARG  84           HE       ARG  84   7.011   0.723  -3.642
  369   1HH1  ARG  84          HH11      ARG  84   7.454   1.120  -7.082
  370   2HH1  ARG  84          HH12      ARG  84   7.715   2.828  -6.977
  371   1HH2  ARG  84          HH21      ARG  84   7.356   2.970  -3.503
  372   2HH2  ARG  84          HH22      ARG  84   7.659   3.878  -4.947
  373    H    LEU  85           HN       LEU  85   2.274  -2.087  -2.468
  374    HA   LEU  85           HA       LEU  85  -0.074  -1.596  -4.269
  375   1HB   LEU  85          HB2       LEU  85  -1.240  -2.816  -2.810
  376   2HB   LEU  85          HB1       LEU  85   0.266  -3.219  -2.014
  377    HG   LEU  85           HG       LEU  85  -0.318  -0.852  -0.817
  378   1HD1  LEU  85          HD11      LEU  85  -2.824  -1.351  -0.183
  379   2HD1  LEU  85          HD12      LEU  85  -2.847  -1.986  -1.825
  380   3HD1  LEU  85          HD13      LEU  85  -2.389  -0.309  -1.535
  381   1HD2  LEU  85          HD21      LEU  85   0.011  -2.248   0.870
  382   2HD2  LEU  85          HD22      LEU  85  -0.372  -3.633  -0.150
  383   3HD2  LEU  85          HD23      LEU  85  -1.660  -2.784   0.703
  384    H    ILE  86           HN       ILE  86  -0.977   0.423  -4.226
  385    HA   ILE  86           HA       ILE  86   0.059   2.357  -2.247
  386    HB   ILE  86           HB       ILE  86  -0.750   2.933  -5.102
  387   1HG1  ILE  86          HG12      ILE  86   2.069   3.247  -4.262
  388   2HG1  ILE  86          HG11      ILE  86   1.500   1.588  -4.418
  389   1HG2  ILE  86          HG21      ILE  86  -0.904   4.720  -3.243
  390   2HG2  ILE  86          HG22      ILE  86  -0.118   5.130  -4.767
  391   3HG2  ILE  86          HG23      ILE  86   0.856   4.741  -3.350
  392   1HD1  ILE  86          HD11      ILE  86   1.610   3.716  -6.528
  393   2HD1  ILE  86          HD12      ILE  86   0.700   2.219  -6.726
  394   3HD1  ILE  86          HD13      ILE  86   2.447   2.165  -6.489
  395    H    LEU  87           HN       LEU  87  -1.392   3.608  -1.244
  396    HA   LEU  87           HA       LEU  87  -4.193   3.484  -2.129
  397   1HB   LEU  87          HB2       LEU  87  -4.942   3.377   0.117
  398   2HB   LEU  87          HB1       LEU  87  -3.705   2.152  -0.040
  399    HG   LEU  87           HG       LEU  87  -3.394   3.148   2.074
  400   1HD1  LEU  87          HD11      LEU  87  -1.183   3.832   2.022
  401   2HD1  LEU  87          HD12      LEU  87  -1.358   4.623   0.457
  402   3HD1  LEU  87          HD13      LEU  87  -1.358   2.864   0.559
  403   1HD2  LEU  87          HD21      LEU  87  -4.488   5.438   0.901
  404   2HD2  LEU  87          HD22      LEU  87  -2.870   5.895   1.432
  405   3HD2  LEU  87          HD23      LEU  87  -4.015   5.208   2.583
  406    H    GLN  88           HN       GLN  88  -5.171   5.399  -2.284
  407    HA   GLN  88           HA       GLN  88  -3.695   7.761  -1.343
  408   1HB   GLN  88          HB2       GLN  88  -5.339   7.466  -3.861
  409   2HB   GLN  88          HB1       GLN  88  -4.735   8.999  -3.251
  410   1HG   GLN  88          HG2       GLN  88  -2.427   7.769  -3.324
  411   2HG   GLN  88          HG1       GLN  88  -3.256   6.735  -4.487
  412   1HE2  GLN  88          HE21      GLN  88  -2.242   7.350  -6.315
  413   2HE2  GLN  88          HE22      GLN  88  -2.291   8.950  -6.967
  414    H    ARG  89           HN       ARG  89  -4.681   8.319   0.436
  415    HA   ARG  89           HA       ARG  89  -7.595   8.175   0.614
  416   1HB   ARG  89          HB2       ARG  89  -6.310   7.327   2.498
  417   2HB   ARG  89          HB1       ARG  89  -5.502   8.876   2.680
  418   1HG   ARG  89          HG2       ARG  89  -7.284   9.848   3.693
  419   2HG   ARG  89          HG1       ARG  89  -8.459   8.866   2.816
  420   1HD   ARG  89          HD2       ARG  89  -7.552   6.904   4.201
  421   2HD   ARG  89          HD1       ARG  89  -6.829   8.141   5.229
  422    HE   ARG  89           HE       ARG  89  -9.414   8.913   5.073
  423   1HH1  ARG  89          HH11      ARG  89  -7.881   5.884   5.887
  424   2HH1  ARG  89          HH12      ARG  89  -9.143   5.392   6.965
  425   1HH2  ARG  89          HH21      ARG  89 -11.075   8.266   6.491
  426   2HH2  ARG  89          HH22      ARG  89 -10.956   6.743   7.309
  427    H    ARG  90           HN       ARG  90  -5.414  10.652   1.923
  428    HA   ARG  90           HA       ARG  90  -6.173  12.764   0.264
  429   1HB   ARG  90          HB2       ARG  90  -8.413  12.441   1.197
  430   2HB   ARG  90          HB1       ARG  90  -7.771  12.599   2.826
  431   1HG   ARG  90          HG2       ARG  90  -7.927  14.807   2.751
  432   2HG   ARG  90          HG1       ARG  90  -7.044  14.878   1.225
  433   1HD   ARG  90          HD2       ARG  90  -8.921  15.090   0.012
  434   2HD   ARG  90          HD1       ARG  90  -9.790  13.894   0.973
  435    HE   ARG  90           HE       ARG  90  -9.886  16.731   1.268
  436   1HH1  ARG  90          HH11      ARG  90 -10.128  13.719   3.014
  437   2HH1  ARG  90          HH12      ARG  90 -11.114  14.383   4.272
  438   1HH2  ARG  90          HH21      ARG  90 -11.183  17.607   2.921
  439   2HH2  ARG  90          HH22      ARG  90 -11.715  16.590   4.219
  Start of MODEL   10
    1    H    GLU  39           HN       GLU  39   5.581   0.693   7.056
    2    HA   GLU  39           HA       GLU  39   6.638  -0.085   4.448
    3   1HB   GLU  39          HB2       GLU  39   4.480  -1.056   6.231
    4   2HB   GLU  39          HB1       GLU  39   4.187  -1.205   4.503
    5   1HG   GLU  39          HG2       GLU  39   5.149  -3.230   5.045
    6   2HG   GLU  39          HG1       GLU  39   6.513  -2.302   4.422
    7    H    ILE  40           HN       ILE  40   4.321   2.052   5.905
    8    HA   ILE  40           HA       ILE  40   3.330   2.830   3.235
    9    HB   ILE  40           HB       ILE  40   2.072   3.452   5.912
   10   1HG1  ILE  40          HG12      ILE  40   1.426   1.212   3.983
   11   2HG1  ILE  40          HG11      ILE  40   2.114   1.028   5.592
   12   1HG2  ILE  40          HG21      ILE  40   0.040   3.657   4.296
   13   2HG2  ILE  40          HG22      ILE  40   1.284   3.868   3.065
   14   3HG2  ILE  40          HG23      ILE  40   1.197   4.980   4.429
   15   1HD1  ILE  40          HD11      ILE  40  -0.543   2.342   5.180
   16   2HD1  ILE  40          HD12      ILE  40   0.119   1.604   6.639
   17   3HD1  ILE  40          HD13      ILE  40  -0.381   0.589   5.286
   18    H    LEU  41           HN       LEU  41   3.725   4.875   2.518
   19    HA   LEU  41           HA       LEU  41   4.730   6.868   4.459
   20   1HB   LEU  41          HB2       LEU  41   6.051   5.726   2.127
   21   2HB   LEU  41          HB1       LEU  41   5.918   7.472   2.009
   22    HG   LEU  41           HG       LEU  41   6.878   7.342   4.488
   23   1HD1  LEU  41          HD11      LEU  41   6.853   4.764   4.195
   24   2HD1  LEU  41          HD12      LEU  41   8.243   5.539   4.954
   25   3HD1  LEU  41          HD13      LEU  41   8.327   5.033   3.267
   26   1HD2  LEU  41          HD21      LEU  41   9.217   7.298   3.282
   27   2HD2  LEU  41          HD22      LEU  41   8.095   8.639   3.050
   28   3HD2  LEU  41          HD23      LEU  41   8.217   7.371   1.831
   29    H    ILE  42           HN       ILE  42   3.755   8.863   4.255
   30    HA   ILE  42           HA       ILE  42   2.102   9.224   1.839
   31    HB   ILE  42           HB       ILE  42   0.428  10.314   3.065
   32   1HG1  ILE  42          HG12      ILE  42   1.858  11.799   4.408
   33   2HG1  ILE  42          HG11      ILE  42   0.629  11.029   5.401
   34   1HG2  ILE  42          HG21      ILE  42   1.359   7.771   4.001
   35   2HG2  ILE  42          HG22      ILE  42  -0.292   8.361   3.822
   36   3HG2  ILE  42          HG23      ILE  42   0.591   8.651   5.319
   37   1HD1  ILE  42          HD11      ILE  42   2.431  10.774   6.751
   38   2HD1  ILE  42          HD12      ILE  42   3.568  10.673   5.407
   39   3HD1  ILE  42          HD13      ILE  42   2.562   9.284   5.817
   40    H    GLU  43           HN       GLU  43   2.436  10.931   0.635
   41    HA   GLU  43           HA       GLU  43   3.852  13.285   1.707
   42   1HB   GLU  43          HB2       GLU  43   4.538  11.506  -0.579
   43   2HB   GLU  43          HB1       GLU  43   4.663  13.233  -0.888
   44   1HG   GLU  43          HG2       GLU  43   6.687  13.157  -0.004
   45   2HG   GLU  43          HG1       GLU  43   5.923  12.868   1.559
   46    H    GLY  44           HN       GLY  44   2.877  15.216   1.018
   47   1HA   GLY  44          HA2       GLY  44   1.254  16.557   0.077
   48   2HA   GLY  44          HA1       GLY  44   1.536  15.612  -1.376
   49    H    ASN  45           HN       ASN  45   0.113  13.901  -1.900
   50    HA   ASN  45           HA       ASN  45  -2.194  13.505  -0.135
   51   1HB   ASN  45          HB2       ASN  45  -3.694  13.682  -2.185
   52   2HB   ASN  45          HB1       ASN  45  -3.043  15.191  -1.551
   53   1HD2  ASN  45          HD21      ASN  45  -2.497  12.700  -3.989
   54   2HD2  ASN  45          HD22      ASN  45  -1.772  13.749  -5.155
   55    H    ARG  46           HN       ARG  46   0.143  12.124  -2.064
   56    HA   ARG  46           HA       ARG  46  -1.438   9.666  -2.508
   57   1HB   ARG  46          HB2       ARG  46   0.203   9.155  -4.268
   58   2HB   ARG  46          HB1       ARG  46  -0.569  10.707  -4.561
   59   1HG   ARG  46          HG2       ARG  46   1.444  11.604  -4.758
   60   2HG   ARG  46          HG1       ARG  46   1.706  11.284  -3.042
   61   1HD   ARG  46          HD2       ARG  46   2.266   8.860  -4.003
   62   2HD   ARG  46          HD1       ARG  46   2.678   9.814  -5.427
   63    HE   ARG  46           HE       ARG  46   4.114   9.701  -2.940
   64   1HH1  ARG  46          HH11      ARG  46   3.470  11.615  -5.787
   65   2HH1  ARG  46          HH12      ARG  46   4.954  12.502  -5.677
   66   1HH2  ARG  46          HH21      ARG  46   6.065  10.866  -2.795
   67   2HH2  ARG  46          HH22      ARG  46   6.427  12.077  -3.980
   68    H    THR  47           HN       THR  47  -0.692   7.766  -1.595
   69    HA   THR  47           HA       THR  47   1.870   7.898  -0.122
   70    HB   THR  47           HB       THR  47  -0.724   6.538   0.583
   71    HG1  THR  47           HG1      THR  47  -0.698   8.672   1.198
   72   1HG2  THR  47          HG21      THR  47   1.330   6.476   2.627
   73   2HG2  THR  47          HG22      THR  47   1.715   5.489   1.220
   74   3HG2  THR  47          HG23      THR  47   0.211   5.221   2.101
   75    H    ILE  48           HN       ILE  48   3.238   6.231  -0.421
   76    HA   ILE  48           HA       ILE  48   2.421   4.070  -2.272
   77    HB   ILE  48           HB       ILE  48   4.941   3.817  -2.574
   78   1HG1  ILE  48          HG12      ILE  48   5.086   6.634  -1.522
   79   2HG1  ILE  48          HG11      ILE  48   5.363   5.254  -0.466
   80   1HG2  ILE  48          HG21      ILE  48   3.215   5.982  -3.577
   81   2HG2  ILE  48          HG22      ILE  48   4.100   4.733  -4.453
   82   3HG2  ILE  48          HG23      ILE  48   4.943   6.171  -3.877
   83   1HD1  ILE  48          HD11      ILE  48   7.377   6.410  -1.558
   84   2HD1  ILE  48          HD12      ILE  48   6.886   5.553  -3.019
   85   3HD1  ILE  48          HD13      ILE  48   7.309   4.648  -1.566
   86    H    ILE  49           HN       ILE  49   2.636   1.943  -1.578
   87    HA   ILE  49           HA       ILE  49   3.955   1.569   1.023
   88    HB   ILE  49           HB       ILE  49   1.490   0.112   0.120
   89   1HG1  ILE  49          HG12      ILE  49   0.611   1.380   2.244
   90   2HG1  ILE  49          HG11      ILE  49   1.931   2.484   1.872
   91   1HG2  ILE  49          HG21      ILE  49   1.471  -0.881   2.309
   92   2HG2  ILE  49          HG22      ILE  49   2.874   0.074   2.791
   93   3HG2  ILE  49          HG23      ILE  49   3.040  -1.178   1.560
   94   1HD1  ILE  49          HD11      ILE  49   0.369   3.512   0.639
   95   2HD1  ILE  49          HD12      ILE  49  -0.629   2.064   0.502
   96   3HD1  ILE  49          HD13      ILE  49   0.771   2.274  -0.550
   97    H    ARG  50           HN       ARG  50   5.390   0.074   1.145
   98    HA   ARG  50           HA       ARG  50   6.075  -1.469  -1.205
   99   1HB   ARG  50          HB2       ARG  50   7.606  -0.314   0.683
  100   2HB   ARG  50          HB1       ARG  50   7.489  -1.930   1.367
  101   1HG   ARG  50          HG2       ARG  50   8.385  -2.882  -0.682
  102   2HG   ARG  50          HG1       ARG  50   8.462  -1.276  -1.408
  103   1HD   ARG  50          HD2       ARG  50  10.018  -0.581   0.379
  104   2HD   ARG  50          HD1       ARG  50   9.981  -2.222   1.020
  105    HE   ARG  50           HE       ARG  50  11.328  -2.919  -0.720
  106   1HH1  ARG  50          HH11      ARG  50  10.294   0.373  -1.271
  107   2HH1  ARG  50          HH12      ARG  50  11.423   0.642  -2.555
  108   1HH2  ARG  50          HH21      ARG  50  12.808  -2.563  -2.411
  109   2HH2  ARG  50          HH22      ARG  50  12.848  -1.023  -3.204
  110    H    ASN  51           HN       ASN  51   3.744  -2.409  -0.737
  111    HA   ASN  51           HA       ASN  51   3.777  -4.569   1.170
  112   1HB   ASN  51          HB2       ASN  51   1.759  -3.051   0.513
  113   2HB   ASN  51          HB1       ASN  51   1.594  -4.173  -0.834
  114   1HD2  ASN  51          HD21      ASN  51   1.709  -3.951   2.674
  115   2HD2  ASN  51          HD22      ASN  51   0.759  -5.362   2.977
  116    H    PHE  52           HN       PHE  52   5.502  -4.478  -1.305
  117    HA   PHE  52           HA       PHE  52   4.765  -6.155  -3.259
  118   1HB   PHE  52          HB2       PHE  52   7.036  -5.032  -3.015
  119   2HB   PHE  52          HB1       PHE  52   7.523  -6.475  -2.126
  120    HD1  PHE  52           HD1      PHE  52   9.232  -6.498  -4.117
  121    HD2  PHE  52           HD2      PHE  52   5.064  -7.280  -4.542
  122    HE1  PHE  52           HE1      PHE  52   9.655  -7.670  -6.241
  123    HE2  PHE  52           HE2      PHE  52   5.470  -8.441  -6.655
  124    HZ   PHE  52           HZ       PHE  52   7.782  -8.644  -7.513
  125    H    ARG  53           HN       ARG  53   5.931  -7.411  -0.079
  126    HA   ARG  53           HA       ARG  53   6.132 -10.072  -0.827
  127   1HB   ARG  53          HB2       ARG  53   6.121  -8.689   1.582
  128   2HB   ARG  53          HB1       ARG  53   4.780  -9.813   1.744
  129   1HG   ARG  53          HG2       ARG  53   6.955 -11.243   0.637
  130   2HG   ARG  53          HG1       ARG  53   7.565 -10.308   2.004
  131   1HD   ARG  53          HD2       ARG  53   5.312 -11.254   3.096
  132   2HD   ARG  53          HD1       ARG  53   5.628 -12.545   1.938
  133    HE   ARG  53           HE       ARG  53   8.014 -12.234   3.158
  134   1HH1  ARG  53          HH11      ARG  53   4.774 -12.680   4.375
  135   2HH1  ARG  53          HH12      ARG  53   5.291 -13.503   5.808
  136   1HH2  ARG  53          HH21      ARG  53   8.696 -13.318   5.041
  137   2HH2  ARG  53          HH22      ARG  53   7.518 -13.866   6.186
  138    H    GLU  54           HN       GLU  54   3.267  -8.968   0.953
  139    HA   GLU  54           HA       GLU  54   1.547 -11.010   0.258
  140   1HB   GLU  54          HB2       GLU  54   1.356  -8.590   1.659
  141   2HB   GLU  54          HB1       GLU  54   0.131  -8.481   0.402
  142   1HG   GLU  54          HG2       GLU  54  -0.881  -9.396   2.349
  143   2HG   GLU  54          HG1       GLU  54  -0.746 -10.681   1.150
  144    H    LEU  55           HN       LEU  55   2.046  -7.894  -1.308
  145    HA   LEU  55           HA       LEU  55   0.205  -7.999  -3.331
  146   1HB   LEU  55          HB2       LEU  55   1.910  -6.167  -2.730
  147   2HB   LEU  55          HB1       LEU  55   2.996  -7.010  -3.819
  148    HG   LEU  55           HG       LEU  55   0.592  -6.682  -5.242
  149   1HD1  LEU  55          HD11      LEU  55   1.146  -4.432  -3.414
  150   2HD1  LEU  55          HD12      LEU  55  -0.370  -4.960  -4.144
  151   3HD1  LEU  55          HD13      LEU  55   0.783  -4.018  -5.089
  152   1HD2  LEU  55          HD21      LEU  55   2.498  -4.694  -5.969
  153   2HD2  LEU  55          HD22      LEU  55   2.117  -6.213  -6.779
  154   3HD2  LEU  55          HD23      LEU  55   3.357  -6.169  -5.526
  155    H    ALA  56           HN       ALA  56   3.478  -9.396  -3.388
  156    HA   ALA  56           HA       ALA  56   3.622 -10.308  -5.958
  157   1HB   ALA  56          HB1       ALA  56   4.621 -11.651  -3.451
  158   2HB   ALA  56          HB2       ALA  56   5.499 -10.501  -4.460
  159   3HB   ALA  56          HB3       ALA  56   5.100 -12.099  -5.088
  160    H    LYS  57           HN       LYS  57   2.386 -12.098  -3.126
  161    HA   LYS  57           HA       LYS  57   1.416 -14.338  -4.514
  162   1HB   LYS  57          HB2       LYS  57   1.130 -13.267  -1.902
  163   2HB   LYS  57          HB1       LYS  57  -0.498 -13.547  -2.502
  164   1HG   LYS  57          HG2       LYS  57   0.034 -15.538  -1.451
  165   2HG   LYS  57          HG1       LYS  57   0.371 -15.881  -3.148
  166   1HD   LYS  57          HD2       LYS  57   2.756 -15.378  -2.741
  167   2HD   LYS  57          HD1       LYS  57   2.389 -15.135  -1.032
  168   1HE   LYS  57          HE2       LYS  57   3.017 -17.314  -0.932
  169   2HE   LYS  57          HE1       LYS  57   1.316 -17.551  -1.328
  170   1HZ   LYS  57          HZ1       LYS  57   2.405 -18.897  -2.835
  171   2HZ   LYS  57          HZ2       LYS  57   3.673 -17.804  -3.079
  172   3HZ   LYS  57          HZ3       LYS  57   2.149 -17.492  -3.743
  173    H    ALA  58           HN       ALA  58  -0.082 -11.260  -3.779
  174    HA   ALA  58           HA       ALA  58  -2.537 -11.522  -4.971
  175   1HB   ALA  58          HB1       ALA  58  -1.142  -8.927  -5.288
  176   2HB   ALA  58          HB2       ALA  58  -1.363  -9.549  -3.654
  177   3HB   ALA  58          HB3       ALA  58  -2.763  -9.280  -4.691
  178    H    VAL  59           HN       VAL  59   0.505 -10.430  -6.582
  179    HA   VAL  59           HA       VAL  59  -0.615  -9.828  -8.994
  180    HB   VAL  59           HB       VAL  59   1.375  -9.343  -9.671
  181   1HG1  VAL  59          HG11      VAL  59   2.867 -10.917  -7.628
  182   2HG1  VAL  59          HG12      VAL  59   1.855  -9.571  -7.107
  183   3HG1  VAL  59          HG13      VAL  59   3.167  -9.297  -8.246
  184   1HG2  VAL  59          HG21      VAL  59   2.096 -12.270  -9.481
  185   2HG2  VAL  59          HG22      VAL  59   3.031 -11.037 -10.328
  186   3HG2  VAL  59          HG23      VAL  59   1.406 -11.446 -10.879
  187    H    ASN  60           HN       ASN  60   0.532 -13.020  -7.980
  188    HA   ASN  60           HA       ASN  60  -0.072 -14.420 -10.294
  189   1HB   ASN  60          HB2       ASN  60  -0.380 -15.217  -7.392
  190   2HB   ASN  60          HB1       ASN  60  -0.629 -16.346  -8.722
  191   1HD2  ASN  60          HD21      ASN  60   1.682 -14.468  -6.945
  192   2HD2  ASN  60          HD22      ASN  60   3.097 -15.230  -7.580
  193    H    ARG  61           HN       ARG  61  -2.172 -13.135  -7.791
  194    HA   ARG  61           HA       ARG  61  -4.523 -14.076  -9.325
  195   1HB   ARG  61          HB2       ARG  61  -4.068 -13.533  -6.427
  196   2HB   ARG  61          HB1       ARG  61  -5.682 -13.289  -7.079
  197   1HG   ARG  61          HG2       ARG  61  -6.058 -15.494  -7.339
  198   2HG   ARG  61          HG1       ARG  61  -4.388 -15.836  -7.791
  199   1HD   ARG  61          HD2       ARG  61  -4.772 -16.896  -5.700
  200   2HD   ARG  61          HD1       ARG  61  -3.770 -15.480  -5.384
  201    HE   ARG  61           HE       ARG  61  -5.483 -14.575  -4.160
  202   1HH1  ARG  61          HH11      ARG  61  -6.708 -17.267  -6.015
  203   2HH1  ARG  61          HH12      ARG  61  -8.247 -17.274  -5.221
  204   1HH2  ARG  61          HH21      ARG  61  -7.506 -14.587  -3.113
  205   2HH2  ARG  61          HH22      ARG  61  -8.699 -15.754  -3.574
  206    H    ASP  62           HN       ASP  62  -2.850 -11.679  -9.898
  207    HA   ASP  62           HA       ASP  62  -3.331  -9.636 -10.897
  208   1HB   ASP  62          HB2       ASP  62  -5.973  -9.536  -9.446
  209   2HB   ASP  62          HB1       ASP  62  -5.493  -8.690 -10.913
  210    H    GLU  63           HN       GLU  63  -1.592  -9.162  -9.547
  211    HA   GLU  63           HA       GLU  63  -1.738  -8.153  -6.917
  212   1HB   GLU  63          HB2       GLU  63   0.324  -6.880  -7.432
  213   2HB   GLU  63          HB1       GLU  63   0.444  -8.560  -7.893
  214   1HG   GLU  63          HG2       GLU  63   1.365  -7.551  -9.720
  215   2HG   GLU  63          HG1       GLU  63  -0.318  -7.661 -10.233
  216    H    GLU  64           HN       GLU  64  -2.011  -6.759 -10.073
  217    HA   GLU  64           HA       GLU  64  -2.256  -4.071  -9.422
  218   1HB   GLU  64          HB2       GLU  64  -3.690  -3.893 -11.501
  219   2HB   GLU  64          HB1       GLU  64  -2.125  -4.659 -11.726
  220   1HG   GLU  64          HG2       GLU  64  -3.321  -6.870 -11.481
  221   2HG   GLU  64          HG1       GLU  64  -4.826  -5.961 -11.599
  222    H    PHE  65           HN       PHE  65  -4.751  -6.515  -9.685
  223    HA   PHE  65           HA       PHE  65  -6.979  -5.035  -9.021
  224   1HB   PHE  65          HB2       PHE  65  -6.570  -7.613  -9.660
  225   2HB   PHE  65          HB1       PHE  65  -6.834  -7.787  -7.929
  226    HD1  PHE  65           HD1      PHE  65  -8.359  -7.359 -11.125
  227    HD2  PHE  65           HD2      PHE  65  -8.964  -6.806  -6.949
  228    HE1  PHE  65           HE1      PHE  65 -10.788  -7.243 -11.496
  229    HE2  PHE  65           HE2      PHE  65 -11.395  -6.690  -7.312
  230    HZ   PHE  65           HZ       PHE  65 -12.310  -6.910  -9.588
  231    H    PHE  66           HN       PHE  66  -4.760  -6.811  -6.801
  232    HA   PHE  66           HA       PHE  66  -6.227  -6.270  -4.538
  233   1HB   PHE  66          HB2       PHE  66  -4.454  -7.764  -4.091
  234   2HB   PHE  66          HB1       PHE  66  -3.229  -6.581  -4.632
  235    HD1  PHE  66           HD1      PHE  66  -6.122  -6.844  -2.341
  236    HD2  PHE  66           HD2      PHE  66  -2.287  -5.160  -3.058
  237    HE1  PHE  66           HE1      PHE  66  -6.353  -5.497  -0.314
  238    HE2  PHE  66           HE2      PHE  66  -2.496  -3.839  -0.994
  239    HZ   PHE  66           HZ       PHE  66  -4.573  -3.962   0.308
  240    H    ALA  67           HN       ALA  67  -3.300  -4.238  -5.465
  241    HA   ALA  67           HA       ALA  67  -3.523  -2.411  -3.489
  242   1HB   ALA  67          HB1       ALA  67  -1.820  -1.846  -4.924
  243   2HB   ALA  67          HB2       ALA  67  -3.020  -0.675  -5.468
  244   3HB   ALA  67          HB3       ALA  67  -2.773  -2.170  -6.370
  245    H    LYS  68           HN       LYS  68  -5.500  -2.516  -6.466
  246    HA   LYS  68           HA       LYS  68  -7.095  -0.298  -6.113
  247   1HB   LYS  68          HB2       LYS  68  -7.198  -2.435  -7.774
  248   2HB   LYS  68          HB1       LYS  68  -8.561  -2.803  -6.726
  249   1HG   LYS  68          HG2       LYS  68  -9.694  -0.835  -7.326
  250   2HG   LYS  68          HG1       LYS  68  -8.249  -0.132  -8.056
  251   1HD   LYS  68          HD2       LYS  68  -9.457  -2.670  -9.108
  252   2HD   LYS  68          HD1       LYS  68 -10.054  -1.090  -9.617
  253   1HE   LYS  68          HE2       LYS  68  -8.014  -0.514 -10.611
  254   2HE   LYS  68          HE1       LYS  68  -7.138  -1.781  -9.755
  255   1HZ   LYS  68          HZ1       LYS  68  -7.927  -1.999 -12.278
  256   2HZ   LYS  68          HZ2       LYS  68  -9.274  -2.673 -11.509
  257   3HZ   LYS  68          HZ3       LYS  68  -7.737  -3.330 -11.252
  258    H    TYR  69           HN       TYR  69  -7.505  -3.474  -4.578
  259    HA   TYR  69           HA       TYR  69  -9.725  -3.193  -3.056
  260   1HB   TYR  69          HB2       TYR  69  -7.243  -4.763  -2.714
  261   2HB   TYR  69          HB1       TYR  69  -8.225  -4.537  -1.279
  262    HD1  TYR  69           HD1      TYR  69 -10.942  -4.637  -2.241
  263    HD2  TYR  69           HD2      TYR  69  -7.592  -6.952  -3.460
  264    HE1  TYR  69           HE1      TYR  69 -12.453  -6.444  -2.945
  265    HE2  TYR  69           HE2      TYR  69  -9.091  -8.764  -4.170
  266    HH   TYR  69           HH       TYR  69 -11.881  -9.306  -3.252
  267    H    LEU  70           HN       LEU  70  -6.441  -2.338  -2.025
  268    HA   LEU  70           HA       LEU  70  -6.976  -1.327   0.467
  269   1HB   LEU  70          HB2       LEU  70  -4.771  -1.349  -1.004
  270   2HB   LEU  70          HB1       LEU  70  -5.225   0.319  -1.299
  271    HG   LEU  70           HG       LEU  70  -4.962  -0.796   1.484
  272   1HD1  LEU  70          HD11      LEU  70  -2.832   0.612  -0.112
  273   2HD1  LEU  70          HD12      LEU  70  -2.846  -1.108   0.275
  274   3HD1  LEU  70          HD13      LEU  70  -2.719   0.086   1.567
  275   1HD2  LEU  70          HD21      LEU  70  -6.066   1.195   1.697
  276   2HD2  LEU  70          HD22      LEU  70  -5.324   1.888   0.255
  277   3HD2  LEU  70          HD23      LEU  70  -4.396   1.757   1.748
  278    H    LEU  71           HN       LEU  71  -7.287   0.315  -2.627
  279    HA   LEU  71           HA       LEU  71  -8.323   2.748  -1.638
  280   1HB   LEU  71          HB2       LEU  71  -7.944   3.254  -3.774
  281   2HB   LEU  71          HB1       LEU  71  -7.791   1.562  -4.197
  282    HG   LEU  71           HG       LEU  71 -10.297   1.487  -4.437
  283   1HD1  LEU  71          HD11      LEU  71  -9.936   4.317  -3.666
  284   2HD1  LEU  71          HD12      LEU  71 -11.287   3.221  -3.373
  285   3HD1  LEU  71          HD13      LEU  71 -11.096   3.983  -4.953
  286   1HD2  LEU  71          HD21      LEU  71 -10.064   1.915  -6.626
  287   2HD2  LEU  71          HD22      LEU  71  -8.371   2.193  -6.218
  288   3HD2  LEU  71          HD23      LEU  71  -9.483   3.556  -6.348
  289    H    LYS  72           HN       LYS  72  -9.855  -0.207  -2.924
  290    HA   LYS  72           HA       LYS  72 -12.517   0.534  -2.729
  291   1HB   LYS  72          HB2       LYS  72 -11.082  -1.854  -3.117
  292   2HB   LYS  72          HB1       LYS  72 -12.175  -2.171  -1.778
  293   1HG   LYS  72          HG2       LYS  72 -13.405  -0.789  -4.049
  294   2HG   LYS  72          HG1       LYS  72 -12.813  -2.412  -4.404
  295   1HD   LYS  72          HD2       LYS  72 -14.492  -1.866  -1.979
  296   2HD   LYS  72          HD1       LYS  72 -15.231  -2.146  -3.557
  297   1HE   LYS  72          HE2       LYS  72 -13.515  -4.014  -1.942
  298   2HE   LYS  72          HE1       LYS  72 -15.181  -4.245  -2.471
  299   1HZ   LYS  72          HZ1       LYS  72 -14.146  -5.467  -4.044
  300   2HZ   LYS  72          HZ2       LYS  72 -12.696  -4.604  -3.949
  301   3HZ   LYS  72          HZ3       LYS  72 -14.002  -3.968  -4.815
  302    H    GLU  73           HN       GLU  73 -10.421  -0.853  -0.239
  303    HA   GLU  73           HA       GLU  73 -12.264  -1.022   1.840
  304   1HB   GLU  73          HB2       GLU  73  -9.574  -1.514   1.550
  305   2HB   GLU  73          HB1       GLU  73  -9.588  -0.173   2.687
  306   1HG   GLU  73          HG2       GLU  73 -10.303  -1.456   4.354
  307   2HG   GLU  73          HG1       GLU  73 -11.543  -2.212   3.354
  308    H    THR  74           HN       THR  74 -10.086   1.679   1.026
  309    HA   THR  74           HA       THR  74 -11.137   3.374   3.074
  310    HB   THR  74           HB       THR  74  -9.735   4.572   0.748
  311    HG1  THR  74           HG1      THR  74  -7.973   3.445   0.955
  312   1HG2  THR  74          HG21      THR  74  -8.652   4.801   3.464
  313   2HG2  THR  74          HG22      THR  74 -10.262   5.479   3.225
  314   3HG2  THR  74          HG23      THR  74  -8.914   6.034   2.230
  315    H    GLY  75           HN       GLY  75 -11.131   3.939  -0.455
  316   1HA   GLY  75          HA2       GLY  75 -13.480   4.092  -1.420
  317   2HA   GLY  75          HA1       GLY  75 -13.760   5.237  -0.119
  318    H    SER  76           HN       SER  76 -11.099   6.442  -0.336
  319    HA   SER  76           HA       SER  76 -11.683   8.519  -2.099
  320   1HB   SER  76          HB2       SER  76 -10.133   8.899  -0.312
  321   2HB   SER  76          HB1       SER  76  -9.050   7.639  -0.904
  322    HG   SER  76           HG       SER  76  -9.168  10.239  -1.590
  323    H    ALA  77           HN       ALA  77  -8.517   7.250  -2.784
  324    HA   ALA  77           HA       ALA  77  -9.403   6.092  -5.316
  325   1HB   ALA  77          HB1       ALA  77  -7.165   8.000  -5.599
  326   2HB   ALA  77          HB2       ALA  77  -8.763   8.706  -5.359
  327   3HB   ALA  77          HB3       ALA  77  -8.476   7.613  -6.713
  328    H    GLY  78           HN       GLY  78  -7.826   4.661  -6.242
  329   1HA   GLY  78          HA2       GLY  78  -5.476   4.234  -4.507
  330   2HA   GLY  78          HA1       GLY  78  -6.480   2.889  -4.997
  331    H    ASN  79           HN       ASN  79  -3.713   3.146  -5.398
  332    HA   ASN  79           HA       ASN  79  -3.564   3.104  -8.342
  333   1HB   ASN  79          HB2       ASN  79  -2.062   4.692  -6.396
  334   2HB   ASN  79          HB1       ASN  79  -1.007   3.737  -7.434
  335   1HD2  ASN  79          HD21      ASN  79  -4.133   5.174  -8.199
  336   2HD2  ASN  79          HD22      ASN  79  -3.549   6.229  -9.437
  337    H    LEU  80           HN       LEU  80  -2.506   1.320  -9.161
  338    HA   LEU  80           HA       LEU  80  -1.271  -0.542  -7.198
  339   1HB   LEU  80          HB2       LEU  80  -2.008  -2.338  -8.742
  340   2HB   LEU  80          HB1       LEU  80  -3.351  -1.435  -8.067
  341    HG   LEU  80           HG       LEU  80  -2.990  -0.074 -10.374
  342   1HD1  LEU  80          HD11      LEU  80  -1.756  -2.725 -10.735
  343   2HD1  LEU  80          HD12      LEU  80  -1.474  -1.210 -11.592
  344   3HD1  LEU  80          HD13      LEU  80  -2.873  -2.204 -11.997
  345   1HD2  LEU  80          HD21      LEU  80  -4.593  -2.607 -10.351
  346   2HD2  LEU  80          HD22      LEU  80  -4.975  -1.059 -11.104
  347   3HD2  LEU  80          HD23      LEU  80  -5.037  -1.226  -9.349
  348    H    GLU  81           HN       GLU  81   0.735  -1.308  -7.679
  349    HA   GLU  81           HA       GLU  81   1.876  -0.721 -10.348
  350   1HB   GLU  81          HB2       GLU  81   2.581   0.670  -8.155
  351   2HB   GLU  81          HB1       GLU  81   3.620  -0.729  -7.924
  352   1HG   GLU  81          HG2       GLU  81   5.085   0.306  -9.227
  353   2HG   GLU  81          HG1       GLU  81   4.011  -0.076 -10.572
  354    H    GLY  82           HN       GLY  82   3.065  -2.485 -11.184
  355   1HA   GLY  82          HA2       GLY  82   2.622  -5.049 -10.160
  356   2HA   GLY  82          HA1       GLY  82   3.855  -4.636 -11.330
  357    H    GLY  83           HN       GLY  83   3.278  -4.463  -7.753
  358   1HA   GLY  83          HA2       GLY  83   5.103  -6.052  -6.764
  359   2HA   GLY  83          HA1       GLY  83   6.181  -4.813  -7.339
  360    H    ARG  84           HN       ARG  84   3.933  -2.991  -6.549
  361    HA   ARG  84           HA       ARG  84   4.204  -2.833  -3.653
  362   1HB   ARG  84          HB2       ARG  84   4.448  -0.549  -5.657
  363   2HB   ARG  84          HB1       ARG  84   4.630  -0.433  -3.912
  364   1HG   ARG  84          HG2       ARG  84   6.736  -1.295  -3.931
  365   2HG   ARG  84          HG1       ARG  84   6.444  -2.270  -5.372
  366   1HD   ARG  84          HD2       ARG  84   6.201   0.180  -6.434
  367   2HD   ARG  84          HD1       ARG  84   7.321   0.542  -5.122
  368    HE   ARG  84           HE       ARG  84   8.428  -1.629  -6.288
  369   1HH1  ARG  84          HH11      ARG  84   7.304   1.429  -7.538
  370   2HH1  ARG  84          HH12      ARG  84   8.446   1.459  -8.838
  371   1HH2  ARG  84          HH21      ARG  84   9.934  -1.588  -7.998
  372   2HH2  ARG  84          HH22      ARG  84   9.939  -0.253  -9.100
  373    H    LEU  85           HN       LEU  85   2.403  -2.011  -2.719
  374    HA   LEU  85           HA       LEU  85  -0.006  -1.553  -4.475
  375   1HB   LEU  85          HB2       LEU  85  -0.803  -3.135  -3.053
  376   2HB   LEU  85          HB1       LEU  85   0.503  -2.923  -1.910
  377    HG   LEU  85           HG       LEU  85  -1.835  -2.507  -1.047
  378   1HD1  LEU  85          HD11      LEU  85  -0.446   0.008  -0.550
  379   2HD1  LEU  85          HD12      LEU  85   0.546  -1.435  -0.345
  380   3HD1  LEU  85          HD13      LEU  85  -0.950  -1.259   0.568
  381   1HD2  LEU  85          HD21      LEU  85  -3.177  -1.037  -2.015
  382   2HD2  LEU  85          HD22      LEU  85  -1.963  -0.799  -3.268
  383   3HD2  LEU  85          HD23      LEU  85  -1.970   0.235  -1.842
  384    H    ILE  86           HN       ILE  86  -0.894   0.497  -4.336
  385    HA   ILE  86           HA       ILE  86   0.307   2.408  -2.426
  386    HB   ILE  86           HB       ILE  86  -0.707   2.874  -5.236
  387   1HG1  ILE  86          HG12      ILE  86   1.927   3.629  -5.184
  388   2HG1  ILE  86          HG11      ILE  86   1.927   2.234  -4.110
  389   1HG2  ILE  86          HG21      ILE  86   0.871   4.942  -3.840
  390   2HG2  ILE  86          HG22      ILE  86  -0.801   4.733  -3.321
  391   3HG2  ILE  86          HG23      ILE  86  -0.441   5.105  -5.006
  392   1HD1  ILE  86          HD11      ILE  86   2.139   2.163  -6.834
  393   2HD1  ILE  86          HD12      ILE  86   0.436   1.787  -6.568
  394   3HD1  ILE  86          HD13      ILE  86   1.686   0.807  -5.800
  395    H    LEU  87           HN       LEU  87  -1.032   3.693  -1.262
  396    HA   LEU  87           HA       LEU  87  -3.939   3.450  -1.747
  397   1HB   LEU  87          HB2       LEU  87  -4.239   3.851   0.626
  398   2HB   LEU  87          HB1       LEU  87  -3.146   2.500   0.401
  399    HG   LEU  87           HG       LEU  87  -1.348   4.500   0.618
  400   1HD1  LEU  87          HD11      LEU  87  -3.569   5.907   1.149
  401   2HD1  LEU  87          HD12      LEU  87  -2.000   6.267   1.868
  402   3HD1  LEU  87          HD13      LEU  87  -3.187   5.331   2.770
  403   1HD2  LEU  87          HD21      LEU  87  -2.026   2.284   2.035
  404   2HD2  LEU  87          HD22      LEU  87  -2.307   3.554   3.226
  405   3HD2  LEU  87          HD23      LEU  87  -0.723   3.391   2.468
  406    H    GLN  88           HN       GLN  88  -5.048   5.340  -2.068
  407    HA   GLN  88           HA       GLN  88  -3.491   7.826  -1.761
  408   1HB   GLN  88          HB2       GLN  88  -4.425   6.821  -4.116
  409   2HB   GLN  88          HB1       GLN  88  -5.736   7.896  -3.655
  410   1HG   GLN  88          HG2       GLN  88  -3.299   9.274  -3.228
  411   2HG   GLN  88          HG1       GLN  88  -3.235   8.538  -4.829
  412   1HE2  GLN  88          HE21      GLN  88  -5.813  10.016  -2.885
  413   2HE2  GLN  88          HE22      GLN  88  -6.319  11.136  -4.099
  414    H    ARG  89           HN       ARG  89  -4.133   8.774  -0.005
  415    HA   ARG  89           HA       ARG  89  -5.469  10.191   1.212
  416   1HB   ARG  89          HB2       ARG  89  -7.074   9.878  -0.997
  417   2HB   ARG  89          HB1       ARG  89  -8.097   9.296   0.309
  418   1HG   ARG  89          HG2       ARG  89  -7.070  11.592   1.370
  419   2HG   ARG  89          HG1       ARG  89  -7.228  12.006  -0.337
  420   1HD   ARG  89          HD2       ARG  89  -9.568  10.602   0.536
  421   2HD   ARG  89          HD1       ARG  89  -9.244  11.947   1.628
  422    HE   ARG  89           HE       ARG  89  -8.994  12.954  -0.929
  423   1HH1  ARG  89          HH11      ARG  89 -11.500  11.453   0.980
  424   2HH1  ARG  89          HH12      ARG  89 -12.786  12.290   0.178
  425   1HH2  ARG  89          HH21      ARG  89 -10.685  14.056  -1.986
  426   2HH2  ARG  89          HH22      ARG  89 -12.324  13.767  -1.506
  427    H    ARG  90           HN       ARG  90  -5.248   6.967   1.343
  428    HA   ARG  90           HA       ARG  90  -7.305   6.469   3.314
  429   1HB   ARG  90          HB2       ARG  90  -6.619   4.653   1.826
  430   2HB   ARG  90          HB1       ARG  90  -4.975   4.753   2.434
  431   1HG   ARG  90          HG2       ARG  90  -6.613   4.416   4.685
  432   2HG   ARG  90          HG1       ARG  90  -7.205   3.288   3.466
  433   1HD   ARG  90          HD2       ARG  90  -4.499   2.982   3.257
  434   2HD   ARG  90          HD1       ARG  90  -4.700   3.286   4.981
  435    HE   ARG  90           HE       ARG  90  -5.398   0.916   3.582
  436   1HH1  ARG  90          HH11      ARG  90  -6.387   2.963   6.229
  437   2HH1  ARG  90          HH12      ARG  90  -7.168   1.681   7.093
  438   1HH2  ARG  90          HH21      ARG  90  -6.425  -0.771   4.716
  439   2HH2  ARG  90          HH22      ARG  90  -7.189  -0.439   6.235